smiles,gap
c1cncc(c1CO)F,0.2279
O=CC12C3OC1COC23,0.2052
CC(C)(C)C(O)C1CN1,0.3145
C#CC1COC(=N1)C#C,0.2196
CC1C2CC3C2CC13,0.3656
O=C1C=CC2(NC12)C#N,0.1747
O=CC1CC(C1)C1CC1,0.2265
FC1=NC(=N)NN=C1,0.1573
CN=CN1C=CCC1=O,0.2037
c1c(ocn1)CCCO,0.2424
C(C#N)N=C(C#N)N,0.2242
CC1C2C(CO)CN12,0.2927
OCC1N=COC2CC12,0.2561
CC1=C(O)OC(=N)C=N1,0.1533
COC(C)CCCC#N,0.3007
CC(C#N)C1(O)CC1,0.3105
Cc1nc(co1)O,0.2221
C1C2COC3COC12C3,0.317
CC(C)(CC1CC1)C#C,0.3162
CCCOC1CC1CC,0.3324
OC12CN3CC=CC1C23,0.2182
CCC(=O)c1cc[nH]n1,0.2061
Cc1cn(nn1)C(C)C,0.2512
CC1=C(ON=N1)C1CO1,0.2187
CC1COC2C3OC1C23,0.2842
C1C=CC23OC4C2NC134,0.2111
c1cncnc1CCO,0.2102
CC1OC(=O)CC1=NO,0.2446
OC1C2COC12C1CC1,0.2895
c1coc(=O)cc1C=O,0.1498
CC1=CC(=NC)OC1,0.2074
C(CO)COC(=O)CO,0.287
CCC#CC1(CO1)C#C,0.2524
CN(C)c1[nH]ncn1,0.2434
OCC12CC3N1CC23O,0.3184
CC(CC#C)C(C)C#C,0.3021
CC1=NC=NC=CC1=O,0.1613
CC12CC(C1)C(O2)C#N,0.2809
N#CCC1=CC2CC1O2,0.2279
CC1COC(C)(C)C1=O,0.2153
CC12C3NC1C(=O)C23O,0.2136
N=C1NC23CCC2OC13,0.2419
CC(=O)Oc1ccoc1,0.2192
COC1OC(C)CC=C1,0.2652
CC1CN2C1C2(C)C#C,0.2723
CC1OC2C3CC1C2O3,0.3235
CCN1CC=CC1=O,0.2101
O=C1CC(C#C)N2CC12,0.2161
CC1CCC=CC1=NO,0.1941
OC1CNC2CC2C1=O,0.2066
N=C1OCC1CCC=O,0.2288
O1C=NC2C3C4C1C2N34,0.2536
OCCCC1CO1,0.3417
NC1CC(O)C=C1C#N,0.1921
OCC(O)CNCC#N,0.274
CCC12CCC1N1CC21,0.2927
CC12CC3C(C=CC1)C23,0.2479
COC1CN2C(CO)C12,0.2993
CC12C3C4N1C4(C#C)C23,0.2349
C(=O)Oc1noc(=O)o1,0.2387
CCN=COC(=O)N,0.2622
CC(O)C1=C(N)C=NO1,0.2021
N#CC#CC1C2COC12,0.2151
C(C(F)(F)F)N,0.3268
N#CCCC12CC1CO2,0.2847
CCC1(C)OC1CC#C,0.3092
OCC12CCN3C1CC23,0.2948
c12c(nno1)onn2,0.1774
CC1C(=O)COC1=O,0.2129
CCC1CCC2CC12,0.3448
CN1C=NC2CC12C#C,0.2287
COC1CC2(OC12)C#C,0.2624
CC1(C)N2C3CC3C12C,0.2793
Cc1c[nH]c(=O)c(=O)[nH]1,0.1767
NC1CC(O)C1(O)C#N,0.2547
OCC1=CCC2(CN2)C1,0.2604
CC12CC(C1)(O2)C1CO1,0.3195
CC1C=CC2(O)CC12,0.2457
c1c(nc2n1C=CC2)N,0.1698
C1CC1C#CCO,0.2708
O=COC1CC2OCC12,0.2571
COCC1NC1CCO,0.3243
C1CC23C4C5C4C2C5C13,0.3279
CCC1(O)CCC=C1,0.2608
CC(CO)N1CC(O)C1,0.302
COC12C3C4C1C2(C)N34,0.2734
CCC(C)C1C(O)C1O,0.2809
CC(CC#C)C(C)(C)O,0.3083
CC1CN1C1=NNC=C1,0.2332
CC1=NOC(=N)C(N)=N1,0.1796
CC1C2CCC=CC12,0.2498
CC1(O)C2CCC12C#N,0.2819
OCC1C2CC2CC1O,0.302
COCC(O)CC(C)O,0.3281
C1OC2CC11NC1CC2,0.3169
CC(=O)C#CCC1CN1,0.2071
CNCc1ncncn1,0.1744
CCCC1C2CC3C2N13,0.3277
CC#CC1CCC2CC12,0.3005
Cc1cc(ccn1)C=O,0.1818
CC1=CN(C=O)C2CC12,0.2016
OC1CCC=C2COC12,0.2545
O=CC1CC2(OC12)C#N,0.2131
CC1(OC(=O)C=C1)C#N,0.2219
CC1(O)C(O)C1(O)CO,0.2855
CC1COCC1(O)CO,0.3013
C#CC1CCC11CC1,0.2992
CC1CC2OC(=N)C2C1,0.2876
CN(C)c1c(ocn1)N,0.2191
CCOCC1(C)OC1C,0.3368
CC12CC(C1)CO2,0.3243
CC12CC(O1)C=C2C=O,0.1806
CC(O)(CO)C1CCC1,0.3104
OCC1(O)C2C3OC1C23,0.2823
N#CC12COCCC1O2,0.272
CC(C)[NH2+]C(C)C([O-])=O,0.2655
CCC1C2CCC(=O)N12,0.2377
O=C1NC2CC=CC2=C1,0.1871
CC1CC1(C)CCCO,0.3365
OC1C=CC2=C1OC=C2,0.1769
C1CC23C4CC2C(C4)C13,0.3402
CCC(N)(CN)C#N,0.2885
CCC1CN1C1(C)CC1,0.2925
CC1C2CC1C2=O,0.2511
CC(C)C(C)COC=O,0.286
CCC12CC1CC(=O)C2,0.2233
OC1CC2CC3C2OC13,0.3003
CC12OC3C4C(C13)C24O,0.3025
COC12CC1OC2(C)C,0.3025
CCCC(C)C(=O)CC,0.2302
O=C1OCC2C3CN1C23,0.2584
OCC1CCO1,0.3174
CC1C2C(C)C1C21CC1,0.3659
OCC1(OC1C#N)C#N,0.2617
CCC1OCC11CCO1,0.313
NC(=O)N1CCC1C#C,0.2731
C1CCOC(=O)C1,0.2713
CC1(CC(C1)=NO)C#C,0.2487
c1nc(c(o1)C=O)CO,0.1893
CC(C)(O)C1OCC1=O,0.2174
CC#CC1CC(=O)C1C,0.2183
C1C2CC3CC(O3)C1O2,0.3094
O=COC1C2OC2C1=O,0.204
CC(=O)C1C2CCC12,0.2206
CC1(C)CC2C3CC2C13,0.3728
c1c(nc(nc1O)O)O,0.2363
c1c(onn1)CCCO,0.2346
CC1C=CC2=CCOC12,0.1941
c1c2cn[nH]c2oc1N,0.2221
CC12NC1C=CC1NC21,0.2367
CC1(CC1)c2cnco2,0.2305
CC(C#C)C1CC1C#C,0.2892
OCC1CCC=C1,0.2641
CN=c1cc[nH]cc1F,0.1796
O=C1NC(CC#C)CO1,0.2939
CC1C2C3C2C1C3O,0.3255
CC1CC1(C)OC(C)=O,0.2743
OC(C#N)C1NCC1O,0.2784
CC1COCOC1CO,0.3386
C#Cc1c(nc(o1)N)O,0.1906
CCc1ccccc1O,0.2185
COc1ccco1,0.23
OC1CNC1=NCC#C,0.2565
OC1COC2COC12,0.2964
OC1(CC2CC2C1)C#C,0.3005
CC1(CN1C=O)C1CC1,0.2571
C1CC23CC4CN(C12)C34,0.2755
O=C1CCC2CC2OC1,0.2155
C1CC1C12COCC1O2,0.3363
COCC(C)(CO)C#C,0.3005
COCC1C(O)C1C#C,0.2835
CC1OC(=N)C1(O)C#N,0.2672
CC(=O)C1CN=C(C)O1,0.2198
C1C(CO1)C#N,0.2867
O=C1NC2CCN3C2C13,0.2501
OC1C2CC(C2)NC1=O,0.2578
C(=O)C(C=O)N=C(N)N,0.1899
CC12CC3C1CC23C=O,0.2155
C1OC2CC=CC1CO2,0.2597
CCC(O)CC(C)C#C,0.3109
NC1C(=N)OC11CCC1,0.2687
NC1(C#N)C2CC1C=C2,0.2362
CC(C)(CC#C)OC=O,0.2758
COC1C2NC1C2C#N,0.2715
CNC1=CC(=O)CC1C,0.207
CC(N=C(N)C#N)C#N,0.2234
N#CCC1OCC11CO1,0.2995
C1N=C2OCCC3C1C23,0.241
CC(NC(C)=[NH2+])C([O-])=O,0.2491
OC12C(OC1=N)C2C#N,0.2632
OC1COC2CCC2=C1,0.2484
CC1OC23CC12CCC3,0.2942
CCC(C1CO1)N1CC1,0.3188
Cc1cn[nH]c(=O)c1C,0.1745
CC(O)C12CC1C(=O)O2,0.2751
CC1CC23CC=CC12N3,0.2347
CC1(CCO)CCOC1,0.3186
CC#CC1CCOC1=N,0.268
COCC1CCN=CO1,0.274
c1c(=O)cnoc1CO,0.1809
C(=O)c1nc(no1)N,0.1632
OC12CC1OC2C1CN1,0.2901
CCC1(CC1)CC#CC,0.3003
CCN=COC1(CC1)C,0.2722
COC1CC=CC11CO1,0.2495
CNCc1nc[nH]n1,0.2247
CC1=CC2(CN2)COC1,0.2366
C1C2N=C3OCOC3C12,0.2452
CC1C2(C)OC(=N)C12O,0.2717
COC(C#N)C(=N)OC,0.277
Cc1c([nH]c(n1)CO)N,0.2306
CCCC(=O)C1CCC1,0.2285
N=C1NC(=CC=N1)C#N,0.1343
CC(=O)c1c(c[nH]n1)O,0.1766
NC1=NCC(O1)C#N,0.2457
Cc1cc(n[nH]1)C,0.2587
O=C1C2C3COC1OC23,0.2089
O=C1COC11CC1C#C,0.2033
CC(=O)C1CCC11CO1,0.2276
CC12CC3CC1CCC23,0.3502
CCCn1ccc(c1)C,0.2453
CC1(C)OC1C(F)(F)F,0.3543
Cc1cc2c([nH]1)nno2,0.1873
CC(O)C1=NNC(N)=N1,0.2545
CC12CCCC1=CCO2,0.2439
CC(C)C1CC(O1)C#C,0.2756
OC1C=CN(C=O)C1=N,0.2052
CC(C)C1C(CO)N1C,0.2767
CN=CNC(=O)C#C,0.1974
N#CC1NCC(=C1)C#N,0.1945
CCn1ccc(c1O)C,0.2322
CC(C)C1CC2COC12,0.3073
CN1CC2OC3CC12C3,0.2946
OC1CC(CC=O)C1=O,0.2111
OC1C2COC1COC2,0.3269
CCC(CC#C)C=O,0.2254
CCC12CC1OC=NC2,0.2703
C1CC1(CO)C2(CC2)O,0.3072
O=CN1CC2C=CCC12,0.2486
OCCOC1CC2NC12,0.3046
O=CC1CC2=CC=NN12,0.1988
CC12CC(=O)C(O)C1N2,0.2185
CC(C=O)N1C=NC=N1,0.2168
C#CC1(OC2CC12)C#N,0.2435
Cc1nc(co1)CO,0.241
CC(C)C1=NC2CC2O1,0.2608
Cc1c(nn[nH]1)O,0.2215
CC1N=COC2CC12O,0.261
CC1COC1CCC#N,0.2981
CC12CN3C1CC23,0.3193
CCC(C)N1C=NC=N1,0.2709
C1COC1=O,0.2878
C(COC(=O)N)O,0.3209
CC1=NON=C(C)C1=N,0.1863
CCOC(CC)C1CO1,0.3324
N=C1OC=CO1,0.238
N#CC12CNC1CCN2,0.2653
CN=C1OC(O)=CC=N1,0.1666
CC1C2CC1C=C2,0.2412
COC1CC2(CC2)C1O,0.3195
CN=C1OC(=O)NC1C,0.2663
CCc1ccc([nH]1)C#C,0.196
O=C1COC2CCC12,0.2111
CC1(CC1)c2n[nH]nn2,0.2354
CC#CCN(C=O)C=O,0.2145
CC1(CC1)C(=O)C2CC2,0.228
CC#CC1C2OC(C)C12,0.2741
OCCC1CC2CN12,0.3095
CC1OC(C)C11CN1C,0.3105
CC1=C(C)C2CC2(C)C1,0.2408
COCCCOC(C)=N,0.2881
C#CC1CC2=CN=CN12,0.2301
CNCc1nc(co1)O,0.2206
C1CC12CN(C2)C(=O)N,0.2887
O=CC(OCC#C)C#C,0.2043
CCC1=CC=CCC=C1,0.184
c1c(nc[nH]1)C(=O)C=O,0.1467
C1C2CCC3CC2OC13,0.327
CC(CC#N)CC(C)=O,0.2343
Cc1cc(oc1C)NC,0.2154
CCCC(OC)C1CO1,0.3315
CCC12CC(C1)CCC2,0.3457
C1CC1C1C2C3CN3C12,0.2818
OCCC1=CC2OC2C1,0.2409
CCNC(=O)OCC#N,0.2755
OC(C#C)C1=NNN=C1,0.2602
CC1CC23CC(C2)CC13,0.3386
CC1(CC1)C#CC#N,0.2274
CCN1CC(O)C1C#N,0.2562
O=CC1CCCOC1=O,0.2258
CC1C2OC(C)(C=O)C12,0.2181
CC1NC(=O)C2(C)CC12,0.2678
C1CC2OC3C1C3O2,0.3084
CCN1CC1(CO)C#C,0.266
COC(CO)(C#C)C#C,0.2699
CCC([NH3+])C([O-])=O,0.2681
CC(C)(C)C#CCC#C,0.2888
CC1C2OC3(CC3O)C12,0.2926
OCC1CCC=C1C#C,0.208
OCC1CC2C3OC3C12,0.3148
C#CCCC1(CCC1)O,0.306
N=C1OCCCC11CO1,0.2706
COC12C3C1C1OC3C21,0.3131
OC1C2NC2C2(O)CC12,0.2989
CC12CCC(C1O)C2O,0.3202
OC1C2CC2C11COC1,0.3023
OCC(O)C1CNC1=O,0.2748
C1OC2=NCC3C1C23,0.2217
C1C2CC3=C(N=NO3)N12,0.1906
O=C(C#C)C#CC1CN1,0.1769
O=COCC1CC=CC1,0.258
CN=COCC(=O)CO,0.2123
CC(C)C1CC1CC#N,0.3221
CC12OC=NC3C1NC23,0.2404
CC1=CC2(O)CC1(C)C2,0.2359
CCN(C)C(=O)C,0.2681
N1C2C1C1C3C4C2C4N13,0.2826
c1nc(c(o1)CN)C#N,0.2203
NC1=NOC=CC1=N,0.1817
CN1C2CCCOCC12,0.2911
C#CC1C=CCC1C#N,0.2604
C1C=CC=CCNC1=O,0.1905
C1OC2C3CC12OC3,0.2833
c1nc(nn1CC=O)N,0.1802
N=CNC(=O)CC1CN1,0.2357
c1c(cc(cc1F)F)N,0.2218
O=C(C#N)N1C2CCC12,0.2047
Cc1c(non1)C(=N)N,0.2018
OC12CC1OC(=O)C=C2,0.208
CCc1cc(c([nH]1)C)C,0.2321
N=COC1=NC=NO1,0.2407
CC1CCC2=NNN=C12,0.2422
NC1=CC(=O)O[C-]1C[NH3+],0.1791
OC1CCCOCC1,0.3228
OC1CC2(CN2)C1C=O,0.2218
CC1CC2=C(O1)C=CO2,0.21
c1c(nnnn1)C(=O)N,0.157
O=C1CCC2CN2C1,0.2161
CCc1nccc(n1)F,0.2237
N#CCC1CC1N1CC1,0.2933
CCC(C)C1CN1C=O,0.2556
OC1COC(=O)OC1=N,0.2675
CC1NCC2=NOC=C12,0.2272
COC1CC(C=C1)C#N,0.2557
CC(O)C1=CCC2NC12,0.2426
CC1COCC1CC#C,0.2992
C#CCCCNC=O,0.2813
CC1COC(=N)C1C,0.2839
CCC1CC1(O)C=O,0.2212
O=C(C#N)C1C2CC1C2,0.2004
O=C1NCC=C1C1CN1,0.1994
CC(=O)C1COCCO1,0.223
CCC1C(C)N1CC#C,0.2693
CC(=O)NCCOC=O,0.2636
CCOCC(=O)C1CC1,0.2344
CNC(=O)CC(F)(F)F,0.2771
CC1(CCC1C#N)C=O,0.2228
NC1=NC2C(CC2=O)O1,0.1947
CC12CCC1(CO2)C#N,0.2717
CNc1c[nH]cc1OC,0.2277
CC1C2OCC1(C)C2O,0.2954
CN1CC1C1OCCO1,0.3036
OC1CC2NC3COC123,0.2703
CC1(O)CC2(CO)NC12,0.2781
CC1(O)CC2(C)OCC12,0.3086
Cc1c([nH]cnc1=O)O,0.2084
CCC(C)(CC)CC=O,0.2234
CCC(O)C1CC(C)O1,0.3291
COC1CCC(=O)C1C,0.2189
CC([NH2+]CCO)C([O-])=O,0.2634
CCC1(CC1)C(=O)N,0.2748
COCCOC(=N)CO,0.2887
CC1C2C3CC(=O)C1N23,0.2157
OC12CC1C1(CN1)C2,0.3094
CC1C2CC1(C2)C(N)=O,0.2633
OC12CC1CC1CN1C2,0.3076
CC12NC3C(C13)C2C#N,0.2566
OC1COC1C#CC=O,0.2034
COC(=N)N1C=CN=N1,0.2307
C(C1CN1)C1=CN=NN1,0.2536
CC(O)C1(CN1C)C#N,0.272
CN=C1OC(N)=CN=C1,0.1534
CCN1C2CC1(C2)C#N,0.2451
CC1OC(=N)C=C1CO,0.2161
CC1OC2C(=O)CC12C,0.2
CCC(=N)OC(=O)CC,0.2425
O=CC12CN1CC(=O)C2,0.2068
CC1(O)C(=N)OC11CC1,0.2749
CC1CCN=COC1=O,0.2406
OCC1(O)C2CCC12O,0.2646
CC#CC(=O)C(=O)C=O,0.1202
CCC(=O)C(=O)C,0.158
c1cnnc(n1)C2CC2,0.1643
OC12CC3(CC1C23)C#N,0.2848
Cc1c(c(n[nH]1)C=O)O,0.1887
NC(=O)C12CC3C(O1)C23,0.2538
COC1C2OC(=NC)C12,0.2652
CC1C2(O)C3NC3C12O,0.2641
CCC#CCOC(C)C,0.2838
CC1CC2(COC2)C1=O,0.2096
CC1(CC1)C1(CN1)C=O,0.2222
O=CNCCCC1CO1,0.283
CC1CC1CC(O)C=O,0.223
CC1C2CC11CCC1O2,0.3074
C1C2CC1OCOC2,0.3285
CC#CC1(CC1)C,0.2883
O=CC12CCC3C1CN23,0.2042
O=C1CC2(OC12)C#N,0.2129
CC1C=CC2OCC12C,0.2507
CC(C)C1C(C)C1(C)C,0.3248
CC1(CCC(O1)(C)C)C,0.3064
CC(C)C(C)C(C)CO,0.3401
N#CC12C3C4CN1C2C34,0.2575
CC1C2N1CC2(O)C=O,0.1955
CC1C(O)C2(C)CC12O,0.3056
CC(C)C(=O)C1CN1,0.2295
Cc1[nH]ccc(=O)n1,0.2059
CC(CO)CCCC#C,0.3158
CCC1(O)CCNC1=O,0.2727
O=C1NCC2(NC12)C#C,0.2397
OCC12CC1C(=O)C2O,0.2133
CC1C2COC(=N)N12,0.2806
OC1C2CCC(=O)C12O,0.2133
N#CCNC1CCC=C1,0.2548
c1c(=O)cnn2c1CC2,0.1836
CC(NCCO)C#N,0.276
c1nc(nn1C(=O)N)N,0.2059
Cc1cc(nc(n1)N)O,0.2105
CCCOCCC,0.3396
CCC12CC1C1(O)CC21,0.2856
OC1C2CC2OC1=N,0.2712
CC1(CNC(=O)CN1)C,0.2459
CC1C(C)C(=O)C1C=O,0.2099
CC1CC(O)CC(C)=C1,0.2593
CC1C2CC1(C)C2O,0.3202
CC1CN2C1C2(C)CO,0.317
O=CNCC1NCC1=O,0.2119
C1CC12C(=O)C=CC2=O,0.1583
CC12C3C4OC1CN2C34,0.2796
CCCOCCN1CC1,0.3247
CC1C2C=CC(C)(O)C12,0.241
N=C1OC=C(CC=O)O1,0.1866
C#CCc1c(n[nH]n1)N,0.2184
OCCC(O)C(=O)C=O,0.1503
C1C2CC3C4OC3C4C12,0.3092
CC1(O)C=CCC11CC1,0.2649
O=CC1C2NC2C1C#N,0.2081
N#CCC1CCN2CC12,0.2766
CC#CCC12CN(C1)C2,0.2775
CC1CN2CC2C(=O)O1,0.2445
O=C1C2COC(O2)C1=O,0.1382
CC1C2CC1C2C=O,0.2202
CN1N=C(F)C=NC1=N,0.1386
OC1CCC2OCC1O2,0.3311
NC(=O)C1CCCOC1,0.2674
CCC(C)(CC)OCC,0.3225
OC1CC2(O)C(C#N)C12,0.2926
CC1CN(C=N)C1=O,0.2274
COC1CCCC(O)C1,0.3232
Cc1c(nccc1O)C,0.2377
CCC1CN(C1)CC#N,0.2601
C#CC1=C(COC1)C#N,0.1764
ON=C1COC2CCC12,0.2443
CC1(NC1CC=O)C#N,0.2207
CNc1cnoc1C#N,0.1725
CC12CN1CC21CN1,0.2905
Cc1cc(c[nH]c1=O)O,0.1644
CC1OC(C)(C#N)C1C,0.2846
N#CC1OC2CCC12,0.2684
CC1CC(O)C(C1)C#C,0.309
CC(C)C1CC2(C)CC12,0.3259
CCC12CC3C(C13)C2O,0.322
c1cn2c(n1)C=CC2=O,0.1324
CC1CC2(C)OCC1O2,0.3303
OCCC(C#C)N1CC1,0.2787
N#CC12NC1C1OCC21,0.2496
COc1cn[nH]c1N,0.2264
CC#CCC1(CO1)C#N,0.2612
C1C2CC1OCCCC2,0.3062
CC12CC1COC2(C)C,0.3236
OC12CN=C3C1C1C2N31,0.156
CC(C)c1c(non1)N,0.2203
CC12COC1CC2C#N,0.2779
CCC12OCC1N1CC21,0.2842
COC1CC1C(F)(F)F,0.3303
CC(C)(C#CC#C)C#N,0.2268
CCc1c(onc1O)N,0.236
CCN1CC1(C)CC#N,0.2755
OCC1(O)COC1C#C,0.2691
CC1C2CC2(O)CC1O,0.303
C1OC1C12OC1C1OC21,0.2785
ON=C1C2CC2C1C#C,0.2436
CCC1(CC#C)CN1C,0.2798
O=CCC(C#N)C1CO1,0.2255
CCc1cnn[nH]c1=O,0.1813
C1CC(C1)C#CCO,0.2734
NC(CO)(C#N)C1CN1,0.2759
Cc1coc(=O)nc1F,0.1922
COC(=O)C(C)CO,0.2808
COC(C)C12CN1CC2,0.3038
CC12CC3(CCC3C1)C2,0.3448
O=C1CC2CC(CO2)O1,0.2662
CC12C3C1C1C3C21O,0.2852
O=C1C2NC2C11CO1,0.2057
CC12CC3C1C=CC23C,0.2252
ON=C1C=CNCC1O,0.1798
CC12CC1(C)C(O2)C#N,0.2548
N#CCCC1CCC=C1,0.2624
OCCC1(CC1O)C#C,0.2892
CC#CCC(C=O)C=O,0.2027
N=COC12CC1CC2=O,0.2211
N=C1OC2CC12CC=O,0.2244
CC1CCC=CC2NC12,0.2341
CN1CC2OC2(C1)C#N,0.2275
c1c(nc[nH]1)C=O,0.205
CC1C2(C)CCCC12O,0.3195
CC12CC(=NO)C1N2,0.2423
ON=C1C(O)C=CC1O,0.235
CC1CCC(C)(O1)C#N,0.3038
CCC1(CC(=N)O1)C=O,0.2158
CN=C1OC2C(O)CC12,0.2758
CN=C1CC2CN=CN12,0.235
CN1CCCCC1C#N,0.2635
c1c(c([nH]n1)C=O)N,0.1662
CC(O)C(=O)C#C,0.1991
CN(C=N)C(=O)NC=O,0.2269
O=C1CC23COC2C1O3,0.2136
CC#CC1NC1CC#C,0.2739
CC12OCC1C2CO,0.3046
CCC1(COC1)CC,0.3138
CCc1c(con1)C#N,0.234
OC1C2C3CC3N2C1=N,0.2338
CC1C2COCCCN12,0.2962
CC(N)C(CC#N)C#N,0.2832
CC1N2CCC2C1=O,0.2016
CC1(CN1)C(O)CC#C,0.2992
CC12CC1N1CC(O)C21,0.2685
OC1C2OC3C2C(=O)C13,0.2213
CCCC12CCCC1O2,0.3394
CC1CC(=O)N1CC#C,0.2747
C1C2CC3OCCC3N12,0.3056
C1CN=CN2C1=NCC2,0.2114
CCNC(C#N)C(N)=O,0.237
CCC1CC2C1CC2=O,0.2194
CC1CC(C)(O)C11CN1,0.3066
COC1C2CCC12C#C,0.2603
CC12CC(O)(C1)CCC2,0.3249
CCOC1CC1(C)CO,0.3045
C#CC(=O)CCC1CC1,0.2065
C(CO)c1nc(on1)N,0.2487
Cn1c(=O)cccc1F,0.18
CCC12OC3C=CC1C23,0.2226
CC1C(C)C1(O)C#N,0.2863
CC#CC(C)(O)CO,0.2828
OC12C3CC4OC(C13)C24,0.3086
O=C1OC23CC(CC2)C13,0.2606
COC12CC(C)C1C2O,0.2969
CCOC1C2CC2C1=O,0.207
N=COC1CNC1C=O,0.2054
C1NC23C1OC1C2OC31,0.278
OC1C2CCC3(CC3)C12,0.3074
NC(C#N)C1(CN1)C#C,0.2661
N#CC1NCC2CC1O2,0.2584
CN=C1C=C(CO1)CO,0.2077
CN=C1OC(F)=CN=C1,0.1623
OC1C2C1C(=O)NC2=O,0.2287
O=CCC12CN1CC2,0.2148
C(=O)Oc1c([nH]nn1)O,0.2278
c1c2c(nco2)oc1N,0.1862
C1COC1(CO)CO,0.306
O=CNC1=NCC2CN12,0.2272
Cc1ncnc(n1)N,0.2225
C1NC2=NCCOC12,0.2523
C#CCCN1CC1C#C,0.2646
C(C=O)OC(CO)CO,0.2287
CC1NC11C2C3C1CN23,0.3062
COC(=O)COC(C)=N,0.2812
C1OC2C3OCC1C23,0.3045
c1coc(=NCC#N)[nH]1,0.2246
OC1COCC1(O)C=O,0.2149
[NH3+]C(CC([O-])=O)C1CN1,0.2761
CC1=CC=CCCOC1,0.2016
c1cnc(cn1)CO,0.1971
COC1C2CC2(O)C1C,0.3079
CC1N(C)C2(CC2)C1=O,0.1907
OC1CC11CC=CC1=O,0.1957
OC1CCC=C1C1CO1,0.245
CC(O)C(=O)OCC#N,0.2612
COC1CCC1(C)CO,0.3144
COC1C2CC1CCC2,0.3241
CC(C)OC(C=O)C=O,0.1978
COCC12CC(N1)C2=O,0.2473
O=C1CN2CCC12,0.2035
CC1(O)CCN2CC12,0.2946
OC(CCC#N)CC#N,0.3191
C#CCC12C3C4C3C1C24,0.2791
OC12CC3OC(=NC1)C23,0.2198
CC(C)(O)C12CC(C1)C2,0.3227
Cc1c([nH]c(=O)[nH]1)C,0.2305
OCC(=O)C1CN1C=O,0.2073
OC1C=CC2C3OC1C23,0.2359
COC1CCCC1CO,0.328
NC1C(C#N)C11COC1,0.2631
CC1(O)CC2(O)CC12O,0.2835
CC(OC=O)C(C)(C)O,0.2786
C1C2OC1C1OCC2O1,0.3004
CC(O)C1CCCCC1,0.3325
NC12CC34N=CN(C13)C24,0.2118
OC12CC(C1)C2(O)C#C,0.2782
CCC1C2OCC12CC,0.3028
Cc1cocc1CC#N,0.2392
CC1COC=NC1C=O,0.2185
OC12CC(C1C#N)C2=O,0.2413
CC(O)C(=O)C(O)C=O,0.1988
CC12CC1C1C2NC1=O,0.2599
CCOC12CC3C1CC23,0.3425
CCCOC(C)CC#N,0.3029
CC1=CCCC(O)C=C1,0.1942
CCC1C=CCC2OC12,0.2658
CCOC1CC=CC1C,0.2633
O=C(C#N)C12CC1OC2,0.1824
CC1=CC2CC1(O)C2O,0.2379
CN=C1OC2CC1C2=O,0.2048
O1C2C3C4C5C4C(C13)C25,0.31
CC1(OC1C#N)C=O,0.2153
CCNC(CCO)C#N,0.2706
CCC1OC2CC=CC12,0.26
C1OC1C1=NC=NO1,0.2446
c1c2c(cnn1)CCC2,0.1879
C1C=C(C(=O)O1)CC=O,0.2
N#CC12CCCCC1N2,0.2859
NC12C3N(CC13O)C2=O,0.2401
COC1C2C3CCC2C13,0.3453
CC(C=O)C1CC1,0.2251
O=CC1C2NC3C2NC13,0.2196
CC1C2CC2CN1C=O,0.2646
COC(C)C1(CN1)C=O,0.2107
OC(CC1CC1O)C#C,0.2901
CCOC=NC(C)CC,0.2707
C(C#N)C(=O)C(=O)N,0.1785
c1c(=NO)cn[nH]c1N,0.154
CCCC1CCCCC1,0.3704
CC(=N)OC1COC1=O,0.2516
COCC#CC(=O)N,0.2365
OCC(OC=O)C1CO1,0.2712
CCN1C2CC2(C)C1=O,0.2473
CC(CN1CC1C)C#C,0.2869
C1C=CC(=O)N1C=O,0.1942
C1CC1C1CC2OC12,0.3362
O=C1CC2CC(=O)C1O2,0.1779
CC1OC(C)C1(C)C,0.316
CC(CO)C1=NOC=C1,0.2526
CC1COCC(C1)C#C,0.2982
CN1C2CCC3OC3C12,0.2904
c1c([nH]cn1)OC(=O)N,0.2301
CC1C(O)C(C)C11CO1,0.3088
CCC12NC1(C)CC2O,0.3092
CCC1(OCCO1)C=O,0.2083
CC(O)(CO)C(O)C#C,0.2873
N=C1ON=NC=NC1=O,0.1543
C1OC23C4NC2C4C3=C1,0.2529
CC1COC1(CN)C#N,0.2562
OCC12CC1OCOC2,0.3191
c1cncncc1=NO,0.152
OC1(C#N)C2NC=NC12,0.2299
COC=Nc1cocn1,0.2056
C1C2NC1C1=C2OC=N1,0.2057
CC12OC3C4C1C4C23O,0.293
C1CC(=O)CC=C1,0.2244
O=CC12OC3C1CCC23,0.2058
CC(CCO)COC=O,0.282
CC12OC3C1OC(=N)C23,0.2566
CC1(C)C2C3C2C2C3N12,0.2964
OC(C=O)C(C=O)C=O,0.209
COC1(C)C(C)C1CO,0.314
C#CC12CCC1N=CN2,0.2413
CCCC(O)CC,0.3334
C1C(CO1)(C#N)OC=O,0.2613
NC1C(OC1C#N)C#N,0.2408
CC(=O)CCNC(=O)N,0.2319
C1CC23C4C5C4N(C12)C35,0.2786
CC1CCC1(O)CC=O,0.2175
CN1CC(C1)O,0.3034
[NH3+]C1CN2C1C2C([O-])=O,0.1271
CC1CC11CN=C(C)O1,0.2592
COC12CN3C(C13)C2O,0.2877
O=CCCC1(CO1)C#C,0.2288
OCC#CC(=O)C1CO1,0.2014
CCC12NC1C1CC21O,0.2734
O=COC1CCCC1=O,0.2115
CN1C2CN(CC12)C=O,0.253
COC=NC(CO)C#N,0.2642
CCCN=C(C#C)OC,0.226
N#CC12OCC1N1CC21,0.2382
NC1=CNC(=N)C(F)=N1,0.1361
OC1CC2NC2C(O)C1,0.3116
CC1CC2(O)COC12C,0.3013
CC1CCC2(C)CC12C,0.3283
OC1C2CC2CC2CC12,0.3244
N=COC1CC(=O)C=C1,0.1893
CC#CC(C)C(C)=O,0.2208
COC1CC(C=O)C1O,0.2229
C1C(=NO)COC=N1,0.2408
O=C1C2CC3CCC13O2,0.2318
CC(OC=O)C#CC#C,0.2241
O=CC1CCNC1=O,0.2215
c1[nH]c2nnc(n2n1)O,0.2058
C1CN1CCCCC=O,0.2167
CC1C=CC(=O)OC1=N,0.2141
CC1C2CNC(=O)N12,0.284
CC1C2OCC12C#C,0.2641
CC12CN3C(CC13)C2O,0.2848
OCC1C2CN3CC1C23,0.2712
CC1OC2C3C4OC13C24,0.2963
O=C1COC2C=CCC12,0.2171
NC(=O)C12NC1CC2=O,0.2208
CC12CC3CC1(C)N23,0.326
CC1CNC(C#N)C1=O,0.2001
CC1C2COC12C=O,0.2173
Cc1ncnn1CC#N,0.2578
CC1OC(=O)C(CO)=C1,0.2321
O=CC1NC(=O)C2NC12,0.2075
CC(C)C1C2CCC12C,0.3218
[NH3+]CC1=C([O-])C=NO1,0.1581
CC1CC2(OC12)C#N,0.2746
O=CC1C2CC=CCC12,0.2193
CC12C(C#N)N1CC2O,0.2673
CC1(C)NC(=N)NC1=O,0.236
OC12CC1N1CC1C2=O,0.1932
C1C2C3OC2C2OC3C12,0.2656
O=CC1OCCC11CN1,0.2105
CC(O)C(O)C#CC#C,0.2207
CC1=C(O)NC=NC1=N,0.1929
CCC(=O)CC#CC#C,0.2216
OC1C(CC1=O)C=O,0.2173
CC12CC(C1)CC(=O)N2,0.2681
C1CN2C1=CCOC2=O,0.2263
O=C1CC(OC1=O)C#N,0.1728
C1CC2(CCC1=O)CC2,0.2234
OC1CCC11CCCC1,0.3148
CC1C=CC2OC2C1C,0.241
OC1CCC=CNC1=O,0.2172
CC1CCOCC1(C)C,0.3191
CC1=NC2C(O1)C2(C)O,0.2472
OCC(O)C1COC=N1,0.2577
CC12C(O)C1CC1CC21,0.3039
C[NH+]=C1NCC1C([O-])=O,0.2342
NC1C(CC#C)OC1=O,0.2489
CC1N2CC2COC1=O,0.242
CC1NC11C2OC1C2C,0.3043
OC1CCCCC1O,0.3097
O=CCC1CCC1C#N,0.2254
O=CC1N=CNC1=O,0.2139
C1CC1(CCO)CC#N,0.3036
N=C1C=CNC=NC1=O,0.1789
Cc1nccc(n1)OC,0.225
CC(C)C(O)(C=O)C#N,0.2244
CC1=CC(=NO)C2OC12,0.1861
OC12CC1C(=N)OCC2,0.2685
OCC1C2C3C1C(=O)N23,0.2501
CC1(CC2CC12)OC=N,0.2775
O=C1C2OC3C=CC1C23,0.1905
CCC12NC3(C)C1NC23,0.292
C(C#N)c1c(non1)N,0.2112
CC1=CC2CC1(C)C2O,0.2357
c1c(=O)onc(n1)C=O,0.1515
CC12COC1CC(=O)C2,0.2213
OC1C=CC2OC=NC12,0.2525
CC1=C(C(=O)CC1=O)C,0.1625
OC1COCC2(O)CC12,0.3121
CC1C(O)C2OC12C,0.3234
CNC(C)(C#N)C(C)N,0.2789
CC1CCOCC1C,0.3231
c1c(c(c(nn1)F)N)O,0.2041
CCC1CN2CC1(O)C2,0.2899
CC1=C2CNC2C(=O)N1,0.1918
C1C2COCC3NC3C12,0.2977
O=CC1(CO1)C1CO1,0.2192
CCC1=CCCC1=O,0.1969
Cn1cnccc1=O,0.1963
NC(=O)C(CC#N)C#C,0.2679
CC(C#N)C(O)CC#C,0.2938
CC1(COC1)CC#N,0.2847
OC12CCOC3CC1C23,0.3162
CCC(O)CC1(O)CC1,0.3039
CCC(O)CCC#C,0.3135
O=C1OCC(C=C1)C#C,0.2157
CC1OC(=O)N2CC12C,0.2877
O=CC1CCCC(=O)C1,0.2126
C1C2C3CCC4OC2C134,0.2052
CCOC12CCC1C2C,0.3235
N#CC1C2OCOC12,0.2775
CCC(C)C(C)(O)C=O,0.2232
C1OC2C3NC3C2C=C1,0.2508
CC1(O)C=CC2CC1O2,0.2355
C1C2CC1C1N=COC21,0.269
OCC(O)C1CCOC1,0.3145
CN(C=NC1CC1)C=O,0.2206
COC(CC#C)C(C)=O,0.2192
CC12C3CC(N13)C21CO1,0.3201
OC1CCC2=NOC=C12,0.2397
CC1(CO1)C(F)(F)F,0.364
OCC1=CCC2OCC12,0.2584
OCC1COC2CC12,0.2997
CC(C#N)C1=CN=CN1,0.2493
CCOC(C)C(C)CC,0.3305
CC1=C(C)CC(O)CC1,0.2547
C1CC23OC4CC2N1C34,0.288
CN=C1OCCOC1=N,0.2178
CC12OC1C=CC2(C)C,0.245
CC1=CCC2OCC12C,0.2595
O=C1CCC2CCC2O1,0.2749
CC12OC3CC1C23C#C,0.2532
CC#CC1C2CC1(C)C2,0.2874
CC1OC2(C)C1OC2=N,0.2671
COC1CC1C1CC1C,0.3138
CC1C(CO)N1CCO,0.2917
ON=C1C2CC3C2CC13,0.2569
NC1=NCC(O)C(=O)N1,0.2261
OCC12OC3CC1OC23,0.3011
Cc1ncnn1C,0.2626
CC12CC(CC#N)C1O2,0.3006
CC1CNC1(C=O)C=O,0.1834
CC12CCC(C=C1)C2O,0.2562
COC12CC1(O)CC2,0.3007
CCC(O)CCC#CC,0.3026
CCOC(C)(C)C=O,0.226
CN(C)c1cnc(o1)O,0.2429
COCC1(C)CC2CC12,0.3368
C#CC(=O)OCCCO,0.2332
CC1NC(C#C)C1C#N,0.2657
O=CCC1OC2CCC12,0.2254
CCC1COC(CC)O1,0.3412
CC(=O)C(=O)OCC=O,0.1813
CC1=C(OC=N)N=CO1,0.2162
CC1OC2OCC1C2O,0.3276
CC1C(C#C)N1C1CC1,0.2594
OC1CC(=N)OCC=C1,0.2465
CC(C)OC1CCCO1,0.3407
CNC=Nc1c[nH]nn1,0.2052
C#CCC1CCC2CC12,0.3123
CC1C2C(O)C1C21CC1,0.3271
O=C1CNCC11CCO1,0.1823
OC1CC(C1)C1COC1,0.3141
CC1(CCCN1C=O)C,0.2668
O=CC12CC3C=CC1C23,0.2016
O=COCC1CN1,0.2654
CC1(COC1C#N)C#N,0.2721
COC1OCC2C(C)C12,0.3342
Cc1c[nH]cc1CO,0.2518
CCN=C1CC(=O)CO1,0.2089
OC1C2CC3C2CCC13,0.3349
C1C2C3CC4(CN4)C3N12,0.2846
c1cc(c(nc1)F)CO,0.2249
OCC1C2CC1C=CC2,0.253
CC1C(O)C(C#C)C1=O,0.2066
CCC(O)C(O)C(N)=O,0.2795
CC1OC1C1CC2CN12,0.307
CC(C)C1CNC(=O)N1,0.2982
CC1NC11CCC2NC12,0.3059
CC12CCC3OC1C2O3,0.3116
CC12CC1CC(C)(O)C2,0.3203
CC#CCC1CCO1,0.2918
OC12C3NC(=CC1=O)C23,0.1538
N#CCC1NC2COC12,0.2825
NC1=COC(=N)C(O)=N1,0.1452
OC1CC2(CC3CN23)C1,0.315
N#CC1NC11COC1,0.2698
O=CC1C=CC2OCC12,0.2135
OC(CC(=O)C#C)C#C,0.1998
C#CCOc1nnon1,0.2173
[NH3+]CCNC(=O)C([O-])=O,0.2223
CC1(CC=CCOC1)C,0.258
CC1(O)COC1CC#N,0.2964
CC1C2CC3C4C(C23)N14,0.3081
CC1=CCC(O)CC1O,0.2596
c1c[nH]nc1C2(CC2)O,0.2463
CC1CC2(COC2=O)C1,0.2768
C#CC1OC2CC12,0.2595
CC1NC1CC(=O)C#C,0.191
C1CC(C1)C(=O)C2CC2,0.2279
COC(C#C)C1CN1C,0.2578
c1c2c(co1)NC=NC2,0.213
CC(O)C1(C)CC=CC1,0.2659
O=C1C2NC1(C=C2)C#N,0.2375
CC1C2OCC2CC1=O,0.2207
CC1NC(=O)C1CO,0.2813
c1cn(cc1O)CCO,0.2302
CC1=CCC2OC12C#N,0.2344
OC1C2CC3CC2OC13,0.3049
OC1(C=O)C2NC2C1=O,0.1785
N#CC1CC2CCC2C1,0.3235
C1CN1C(=O)C(F)(F)F,0.2442
CC(C#C)C1NC1C#C,0.2823
N#CCC1(CCN1)C#N,0.26
CC1C2CC3(C)CC3N12,0.2991
c1c[nH]cc1CC=O,0.2007
CNc1cc([nH]c1O)O,0.2162
O=C1C=CC2(CN12)C#C,0.1957
c1cncc(c1N)C#N,0.1949
O=CNC1C2COC12,0.2676
NC1=NNC(=O)C(=N)N1,0.1842
COC1CC11CC(C)O1,0.2855
O=C1OC23CC(C2)OC13,0.2476
CC(C)n1ccnc1,0.2544
c1cnc([nH]1)C(F)(F)F,0.2462
c1c(c(c(o1)N)CO)O,0.2143
CCCC#CC(O)CO,0.2764
N=C1OC2=C(O1)C=CN2,0.2237
CCOCCC#CC#N,0.2333
OC1C(=N)NC11COC1,0.2661
CCN1CC1CCO,0.2992
OC1=CC=COC1=N,0.1675
CC(=O)CCOC(=O)N,0.2344
CC1COC(=O)C11CN1,0.2565
CN1C(C=O)C1(C)CO,0.1962
CC1CC(C)C2CC1C2,0.3565
N=C1OC(=O)C=CC=C1,0.158
O=C1CCCNC1C#N,0.1941
C#Cc1c([nH]c(n1)N)O,0.2063
OC1C2NC(=O)C12C#C,0.2437
CC#Cc1c[nH]nc1O,0.2142
C1COCCOCC=C1,0.2466
C1C2OC1C=CCC=C2,0.2334
OC1C=CC(O)C2NC12,0.2585
COC(=N)N(C=O)C=O,0.2168
C1C2OCC3CC=CC123,0.2414
CCC(O)C(=O)N1CC1,0.2468
COC1(C)CCC(C)O1,0.3328
C1C2CN1C1=CON=C21,0.249
CC1=CON=C1OC=N,0.2408
c1c(c(n[nH]c1=O)F)N,0.1793
CC1CC2(CO)NC12,0.2876
C1C(CO1)COC(=O)N,0.302
OC1CC2C3CC2C3C1,0.3364
OC(C#C)C1COC1=N,0.2841
OC(CC#C)(C=O)C#N,0.2034
C(c1c(n[nH]n1)C#N)O,0.2321
C(C(=O)C#N)OC(=O)N,0.1971
CCCCC1CC2OC12,0.3367
CC1(CC2OCC12)C#N,0.2898
c1c(c([nH]n1)C=O)C#N,0.189
C(CC=O)CC#CC#N,0.216
CN(C)c1cnccn1,0.1739
OC1C2CC(C#C)C1O2,0.2984
CC(C)C12CC1OCC2,0.3041
CC1(CC1)CCOC,0.3348
c1c([nH]c(=O)[nH]1)N2CC2,0.2301
OC1=CC(=N)NC(=O)O1,0.2198
CC12CC1CCCC=C2,0.2509
CCC(C)(C)C#CC#N,0.2464
CC(O)C#CC(N)=O,0.2321
OC(C=O)C1=NC=NO1,0.2204
COC1(C)CC1CC#N,0.3062
C#CC(=O)C1=CCOC1,0.1626
Cc1c[nH]c(c1C#C)N,0.2075
O=CC1(CO1)C#C,0.2198
CCC(C#C)C(C)C#C,0.301
CCC1(CO)OCC1C,0.3147
C1OC1C1C2OC=NC12,0.2579
CC(C)c1cncnn1,0.1652
CC1=CC(OC1)C#N,0.2544
C(C#CCO)C(=O)C=O,0.1496
CC(O)C1NC1C1CN1,0.3008
OC1C2CC=CC2C1=O,0.1991
CCOC(=O)C1(CC1)C,0.2822
FC1=CC(=O)NC(=N)O1,0.2213
C#CC12C3CC1COC23,0.2616
NCC1(OCC=C1)C#N,0.2327
CCCc1ccoc1N,0.2201
OC1CCC2=CNN=C12,0.2492
OC1CC2OC2C2OC12,0.3161
CC12CC3CC1(C)C3O2,0.3238
O=CC1COC2CCC12,0.2215
O=CCC1C2CC(=O)N12,0.2204
COC1C2OCC12C#N,0.2677
CC1NC1C(=O)C1CO1,0.2071
CC(O)C1=CNC(=O)O1,0.2372
OCC1CNC1C#N,0.2634
c1c(onc1N)C(=N)N,0.1967
Cc1ccc(=O)ncn1,0.1666
CC1CN(C)C(=O)CN1,0.2456
CC1(C)C2OC2C1C#C,0.2898
c1coc2c1NCC2,0.2047
CC(=NO)C(O)C1CC1,0.2539
CC1(CCCC1)CO,0.3332
CC1([NH2+]CC1O)C([O-])=O,0.2644
COC(C)CNC=O,0.2834
CC(C)C1OCC=C1,0.246
CC#CC1CC1(O)CO,0.2789
CC1C(C)C1C(N)=O,0.2706
c1nc2c(o1)CC(=O)C2,0.2093
C#CC#CC(=O)C=O,0.148
COC1CN2CC(O)C12,0.2652
CC1CN2N=CC=C2O1,0.2466
c1c2n(c(c1O)N)CC2,0.2205
O=C1CC2C3CC(=C1)C23,0.1774
CC12NC3CN(C13)C2=O,0.219
CC1(O)CC2C3C1CN23,0.2909
CC1(O)CC(O)CC1O,0.3205
OC1CC2CC1N1CC21,0.3336
CC(O)C1OC11CCC1,0.3197
OC12CNC1=NCC2=O,0.1825
CC1CC2(COC2=N)C1,0.2863
CC12C3C1C1(C)C3CN21,0.3053
O=C1OC(C#N)C2OC12,0.251
C#Cc1nc(=O)nco1,0.1846
OC1C(=O)OCC11CC1,0.2722
CC(C#N)N1C2CCC12,0.2904
CC(O)C(O)C#C,0.2834
c1c(oc(=O)c(n1)O)O,0.1571
CN(CC(O)C#C)C=O,0.2582
Cc1ccccc1C#C,0.2001
c1c(nnn1C=O)CO,0.2
C#CC1=NCCC(=O)O1,0.2206
C1N2C3C=C4CCC13C24,0.1456
CCN1CC(C1)(C)C#N,0.2605
CC1(CC(C1)C#N)C#C,0.2857
NC(=O)OC1CC1C#C,0.2857
OC1CC11C2C3CC2C13,0.313
CC1(C)CCCC11CO1,0.3289
CC1CC1CCOC=O,0.2852
CCC(C)C(=O)OC,0.2819
CC1CC2C3OC1(C)C23,0.3024
Cc1cc(c([nH]1)OC)N,0.2184
C1NC2=NC3COC3C12,0.2489
CCNc1c[nH]c(n1)C,0.2161
OC12CCN=C3NC1C23,0.1976
Cc1cc([nH]n1)N(C)C,0.237
COC12CC1(O)C=CC2,0.2428
CN1CC(O)CCC1=O,0.2654
CCC1OCC1C(C)C,0.3137
CC(NC=O)C1CN1C,0.2562
CC12OC3C1C(O)C23,0.298
CC12NC3CC1OC23,0.3028
NC12CC3C1OC23C#N,0.2368
CC1(C)CC2CCC12O,0.3066
C1c2c(nc([nH]2)O)CN1,0.2434
OC1COC2C3CC12C3,0.3095
CC1C2CC11OCOC21,0.3189
CNC(=O)C12CC1OC2,0.2636
[NH3+]C1CC1CCC([O-])=O,0.2777
OC1CC(=O)CC1=O,0.2004
Cc1n[nH]c2n1ncn2,0.2327
CC1OC2CC2C(=N)O1,0.2723
CN=COCC#CC=O,0.1912
CCN=C1OC2COC12,0.2556
CC(C)(C)OC(=O)CO,0.273
CC1CCN2CC2C1=O,0.2078
O=CC1CC1CCC#N,0.2281
OCC1(CC2CC12)C#N,0.2945
CCOC(=O)NCC#N,0.2934
OC1CC(O)(C=O)C=C1,0.2021
C1C2C3C4C2OCC1N34,0.3296
C#CC1(CCCC1)C#N,0.2916
CC12CC1C=CCC=C2,0.255
CCC1C2CC(OC)C12,0.3239
CC1CC1C(CO)C=O,0.2254
CCOC1CN=C(C)O1,0.2789
OCCC1CCC11CC1,0.3406
CC1(CC1)COCCO,0.3362
O=C1NCC2OCOC12,0.2544
CC1C2C3OC3(C)CN12,0.3029
CC1CC11COC(=N)C1,0.2858
C1CCNC(=O)OCC1,0.2926
c1cc([nH]c1C=O)C#N,0.174
C1C2CC3OCCC13O2,0.3138
N=C1OC2CCNC12,0.2607
C1C2CC11C=CCC1O2,0.2436
CC1OCC(C#N)C1C,0.2889
CC1CC2OC(C)CC12,0.3048
O=C1OCC1N1CC1,0.2394
CCOc1cc(co1)C,0.232
CCC1(CC)CC1OC,0.3064
NC1(CC1CO)C#N,0.2938
CC(=O)CC1COC=N1,0.229
OC1CN(C2CC2)C1=O,0.2605
Cc1c(c(co1)O)CO,0.2185
OCC1CC2=NC=NN12,0.2681
CC1(CCN(C1=O)C)C,0.2711
CC(=O)C(=O)NC=NC,0.1628
CC#CC1CC1C(N)=O,0.2506
CC1(C)CN1C1CC1O,0.3002
O=C1CC2CC=CC2C1,0.2175
CC1C2OCC2N1C,0.2871
OC1(C#C)C2C3NC3C12,0.2613
O=C[C-]1CC[NH2+]CC1=O,0.1612
C1CC1(C#N)OCCO,0.2878
OCCC1(O)CC2NC12,0.3001
CC(=O)C(=O)OC,0.182
CN(CCO)C(=O)OC,0.2951
CCC12CCC1(O2)C=O,0.2175
CC12CC1(NC2)C#N,0.238
CCC1OC1C1NC1C,0.3191
CC(O)CC1(CC1)C#N,0.3065
CC12CC3CC1CC23,0.356
C1C2CC3=C(ON=C3)N12,0.2245
OCC1CC(=O)C2CC12,0.2263
O1C2C3OC4OC3C2C14,0.2874
C1C=CC(=O)CN1C=O,0.174
CC12CC(C)(C1)O2,0.329
CC12NC1C1(O)CCC21,0.2901
CCCC1C=CC2CC12,0.246
CC12C3CC1N1CC3C21,0.2811
O=C1NCC2(CN2)C1=O,0.1662
CCC1C(O)C1C1CC1,0.2989
CC1OC2CC(=O)C2O1,0.2007
CC1CC2OC1(C)C2=O,0.2333
CC1CCC(=O)N1C,0.2713
NC1=NC2CC2(O1)C#C,0.2472
CC1OCC2(CO)NC12,0.2963
C(CCC=O)CCC#N,0.2289
CCCC12COCC1N2,0.3289
CNc1[nH]c(c(n1)O)N,0.2285
OC1CC2C3C1N=CN23,0.2311
O=CC1CC2C3CN3C12,0.203
OCC12OC3C4C3C1C24,0.315
O=C1NCC2NC12C#N,0.2421
CC1OC11COC1=O,0.2582
CN=CNC(=N)OC,0.2388
NC(C#N)C(=O)N1CC1,0.2409
C#CC12CC1OCCC2,0.2891
Cc1c(cno1)C#N,0.2294
CCC12CN3C1C3(C)C2,0.3019
CC1CC2(C1)CC(C)C2,0.3496
CC12CC1(CO)C1CN21,0.2906
CC12CC(C1)OCO2,0.3287
CCOCCC1CCO1,0.3291
CCCC1C(O)C1C#N,0.2981
OC12C3C1N1C3CN=C21,0.1815
CC1C(O)C(C)=CC1=O,0.1907
CC12CC1(O)CC(=O)N2,0.2641
CCC1(CC1)C2(CC2)O,0.3158
OCC1CC(O)C(O)C1,0.3154
C1CC23C=CCC2C3O1,0.2287
CC1OC1(C=O)C#N,0.2155
C1CC1CC2(CC2)CO,0.3274
O=C1CCN1CC1CN1,0.2785
CC1C2CC3(C)N2C13C,0.3176
CC(=O)C1(CC1)C1CO1,0.23
C1CC1C(=NO)CCO,0.2469
COC1CC1(C)C#C,0.281
COC1COC1C1CN1,0.301
c1c(ncn1C(=O)N)N,0.1784
CC1OC2C3CCC2C13,0.3208
C#CC1=CCCC2CC12,0.2063
C#CCC(=O)C(=N)N,0.194
CN(C)C(=O)CC(=O)N,0.2505
N#CC1CC2COCC12,0.2905
CC(C)C(C)CCC#C,0.3157
CC1(NCCC=C1)C#N,0.2442
CN1CC1C1=NNN=C1,0.2151
OC(C#N)C(O)C1CC1,0.3133
FC(F)(F)C1CC=CC1,0.2672
CN1N=NC(=N)C(F)=N1,0.1781
CC1CN1CC#CC#N,0.1987
COc1c(onn1)N,0.1859
CCC(=O)C(C#N)C#N,0.2358
CC1C(CC#N)OC1=O,0.2805
C1OC1C12CC(C1)O2,0.3202
C1C2C3C4COC2C4N13,0.2963
COC1C2C3CC1C23O,0.3046
C#CCCC1=CCCC1,0.2556
CC1=CCN2CC1(O)C2,0.2277
c1cc(=O)ccnc1,0.1525
Cc1c(nn[nH]1)NC,0.2051
CC(O)C1C2CC2C1C,0.3251
CC(C)CC1=CCOC1,0.2432
OC1CN=C2NC=CC12,0.2132
OC(C#N)C1=CON=N1,0.2359
CCC1OC2CCOC12,0.3301
OC1C2C3C4C1C2N34,0.299
CC1(CCC1)C#CC#N,0.2392
OC12CC3C1C1NC1C23,0.3161
OC12CC1N=CNC2=O,0.2143
OCC1OCOC1C#C,0.2782
CN1C(=N)ON=C1O,0.251
CCC1CC=CC(=O)O1,0.2168
CCC(=O)CO,0.2356
C1CC(=O)NCCC1=O,0.2201
CCC1CC(C)(C)O1,0.3215
CC12C(O)C1CC2=O,0.2324
CN=c1[nH]cco1,0.2183
CCOC(=O)C(=O)C,0.1818
CC12COC1CCOC2,0.3204
C1OCC11OCC2OC12,0.3215
CC1C(O)CC1(N)C#N,0.2798
CCCC1N(C)CC1=O,0.1991
CC1(O)C2OCC(=O)C12,0.215
OCC1COCC(O)C1,0.3116
CCC#CCCCC#C,0.2868
CC(C(O)C#C)C(C)=O,0.2273
CCC1(CCCC1)C#N,0.3448
CCCC1CN1CC,0.3082
CC(=O)NC(=N)C(=O)N,0.1895
C(=O)n1c(noc1=O)N,0.208
CC12CC(CO1)C2C#C,0.2765
OC1CC2C3N2CC13O,0.2764
CC(O)C(C=O)C(N)=O,0.2228
OC1CCC1(O)C1CC1,0.3154
CCC#CC1CCOC1,0.2931
C1CN1C12CC3C1N3C2,0.2948
CCC1OC1C#CC=O,0.2011
CC12CCC1CC2O,0.3222
C1C(CO1)(CCC=O)O,0.2296
CCC1CCC1(C)C#C,0.3024
Cn1c(c([nH]c1=O)O)N,0.2176
OC12CCC1C2C=O,0.2169
C1C2NC3=C(NN=C3)C12,0.2116
CC12OC3C1C(C#C)C23,0.2747
O=CC1=NC2CC2O1,0.182
OC1C(O)C1(O)CC=O,0.2185
CC12C3CC1C(C#C)C23,0.2941
CC1C=CC2(CO)NC12,0.2402
C#CC12CN1CC21CC1,0.2454
CC1=C(C(=O)C(=O)C1)C,0.1422
CC1(CCCCC1)C#N,0.3449
OCC12OC1COC2=N,0.2543
OC1C2CC(=O)C1N2,0.2181
CC1(O)CN=CNC1=N,0.2279
CCCCC(CC)C=O,0.2265
CN(C1CC1)C(=O)C#N,0.2056
CNC(=O)CC1CC1O,0.279
CC(O)C#CCC=O,0.2206
CNC(=N)c1conn1,0.1735
COC12C(C)C1CC2O,0.3069
CC1CC2(C1)CC2,0.3518
CC(C#C)C1CC(=O)N1,0.2844
c1cn2c(n1)CC2,0.259
C#Cc1cnc(o1)C#N,0.177
CC1C(O)C(O)CC1=O,0.2132
CCC1(CC1O)C(C)O,0.3177
O=CNCC12CC1CO2,0.2679
CC(C=O)C1(O)CCC1,0.2191
O=C1C2N3CC2(C#N)C13,0.2358
C1C2CC34COC23C1N4,0.2657
CCC#CCOC(C)=N,0.2805
OCCN1CC1C#N,0.2685
O=C1NCCC(O1)C#N,0.2701
Cc1nc(cn1C)CO,0.2418
C1C2C3C4C5NC5C13C24,0.309
CC(O)(C=O)C(=O)C#N,0.1608
CC12CC1NC(=N)C2=O,0.1857
CN=C1OC2CC1(C)C2,0.2786
CCC(C)C1=COC=N1,0.2461
CC12CCC(N1)C2=O,0.2289
OCCC1C2CCC12,0.3304
C#CC1(CC1)O,0.2774
CC(=NO)CC=O,0.2077
O=CC12CC1C1OCC21,0.2213
c1c(c(c([nH]1)N)C#N)O,0.2001
CN1C2C=CC1C2C=O,0.1923
CC12NC1CC2C(N)=O,0.2611
CC12OCC11NC2C=C1,0.2233
FC1=CC(=O)NN=N1,0.1817
CC(O)C1OCC1CO,0.3056
CC12CCN3C(C=C1)C23,0.2202
OC1=NC(OC=N)=CN1,0.2231
CC1(CCCC1(C)C)C,0.3546
c1c(c(oc1N)N)N,0.215
O=CC#CC1NC1C#N,0.198
O=CC1C2CC3C2CN13,0.2132
CC12CCC(C1)OC2,0.3126
CC1(C(=O)COCO1)C,0.2054
CCC1C=CC(O)C1O,0.2497
C1OC2CCCCCC12,0.3112
CCc1nnon1,0.248
CC1COC(CO)O1,0.3292
COC1C(CO)C1(C)C,0.3004
OCC(=O)C1CN1,0.228
O=CC12CC1CC(=O)N2,0.2132
CC12CCC1(O2)C1CC1,0.3177
CCC(=O)C1C2COC12,0.2201
CN1C2C(O)C2C1C=O,0.1863
C#CC(CC1CO1)C#C,0.2932
COC12COC1COC2,0.3123
CC(C)C(=O)C(=O)C#C,0.1479
C#CC1=CCOC(=O)N1,0.1909
CC12CC1COCC2=O,0.2143
CC12C3CC1C(=O)N2C3,0.2253
C#CCC12CC3C1CN23,0.2835
CCN=C1OCC2OC12,0.2547
C(=O)(C(=N)N)C(=N)N,0.16
OC12CC(C1)OCC2,0.3141
NC1=NNN=C1OC=N,0.2067
CC1(O)C2CC1C2C#C,0.2797
C#CC12C=CC3C1CC23,0.2247
c1c(c(c[nH]1)O)CC=O,0.1949
OC1(CCC2OC2)CC1,0.3218
CC12OCC3C1C=CC23,0.2318
CC12CC1C1CC1C2O,0.3057
Cc1c(coc1C#N)N,0.1847
CCC1CCC2COC12,0.3194
CCC(C)C1(C)CC1O,0.3301
CN=C1NN=CC(C)=C1,0.157
OC12CC1C(=CC2)C#C,0.2019
CC1CC23CC12C=CC3,0.2351
OCC1(O)CC(C1)C#C,0.2984
CC1CN1C(=O)C(N)=N,0.2111
C#CC(CC(=O)N)C#C,0.2696
COC12CC1OC2=O,0.2577
CC1OC2CC1C2CO,0.3065
OC1CC2CC(C1)C=C2,0.2501
CC(C)CCC#CC#C,0.2313
O=C1CC2CC(C#C)N12,0.2308
OC12CN3CC1C(=O)C23,0.2188
C#CC1=CCCC1C#N,0.2091
CC12COC1(C)C(=N)N2,0.2536
Cc1c(c2n(n1)CC2)O,0.2366
c1cc(cc(c1)O)CO,0.2166
C1OC1C1C2C3CN3C12,0.2804
CC1C2C3C(C)C2(C)N13,0.3141
N=COCC1OC1C#C,0.2641
OCC(=O)C1NC1C#C,0.2235
CC1C(O)C2CC2C1O,0.3072
c1c(c(nc(=O)[nH]1)O)N,0.1648
C#CCCC1CC2OC12,0.309
CC1C2CC2NC1C#N,0.2572
CC1CC2OC3CC12C3,0.3231
CC1C(CC#C)C1(C)C,0.3087
C1CC(C1)C#CC=O,0.2042
CNC(C=O)C#CC,0.1946
CC1(O)CC=CC1(C)C,0.262
CC(C)OCC1CN1C,0.3002
CC(=O)N,0.2783
CC12OCCC1C2CO,0.312
OC(C=O)C1=NCCO1,0.2202
CC1(C=O)C2CC(O)C12,0.2318
CC12CC1N=C(N2)C#N,0.1978
c1c(nn[nH]1)C#CCO,0.2219
CC#CC1COC1,0.292
CC(=O)CC1CC1,0.2282
OCC1C2C3COC1C23,0.314
CC1(C)CC2C(O)C2C1,0.3155
O=CC1CN1C1COC1,0.2107
CN=c1[nH]c(co1)N,0.2274
C1CC11CCCC2CC12,0.3189
CC1C2(O)COC12C#N,0.2393
CC12CC(C1O)C2=NO,0.2639
CCC12CN1CC2CO,0.2991
OCC1(O)CC=CC1,0.2647
CC1(COC1)OCCO,0.3161
CCC1OC2C(O)C12C,0.2954
OC1C2OC2CC1C#N,0.3046
OC1CC2CN3CC3C12,0.2832
c1c2c(nno2)on1,0.1925
C#CC1CCC2COC12,0.2981
N#CC1CC2(CCO2)C1,0.2885
[NH3+]C1CC1C#CC([O-])=O,0.205
OC12C(CC1=O)C2C#C,0.2161
CCOCC1C2CC1O2,0.3175
CCCC(C)C(=O)OC,0.282
C(C=O)C#CC#CC=O,0.1736
OC1CC(C#C)N2CC12,0.2748
NC(C#N)C1=CNN=C1,0.2511
C1CN1C12CC3OC1C23,0.2981
CC1(O)C2OC1(C)C2O,0.2922
Cn1c(=O)nc(nn1)F,0.1731
CC1=CC2OC2(C1)C=O,0.2092
CC1(O)C=CCCC1=O,0.2088
CC#CC1C(O)CC1O,0.2894
c1cn2c(n1)ncnn2,0.1534
C1C2C3C1C21CCC=C31,0.261
OC1C=C2CCC2C1O,0.2427
CC(O)C1(CO1)C#N,0.2851
C1C=C(CNC1=O)C#N,0.2078
CCC1(O)CC1CO,0.3214
CC(O)C(O)C(O)C=O,0.2392
CCCC12CC3CC1N23,0.328
CC(O)C1=NC(N)=CN1,0.2155
OC1=NC(=CN1)C1CN1,0.2415
CC#CC#C,0.2335
C1OC2CCOCCC12,0.314
O=COC1CCC1=O,0.2109
C1C=CC(=O)OCO1,0.2192
COC1CN(C)C1=O,0.257
OC1CC(=O)C2(O)CC12,0.2235
CC12CC(CCO)C1O2,0.3251
CCN(CCO)C(=O)N,0.2869
O=CC12CCC1CC2,0.2195
O=CC12CN1C(C2)C#C,0.2157
CC12CC3C1N2C3C#C,0.2769
CC#CCC1NCC1=O,0.2093
CC(OC=O)C1CN1C,0.245
CCN(C(=O)N)C(=O)N,0.2772
CCC#CCN1CC1,0.2791
CC1CC=C2C3OC3C12,0.2409
COC1CC(C)OC1=O,0.2498
CC12C3C(O)C1(C)CN23,0.2883
C#CC#CC(=N)NC=O,0.1827
OC1(CC1)C(=O)C1CO1,0.2098
COCC1C2CN1C2C,0.3062
CN1C2COC(C#C)C12,0.256
OC1C2CC1(C#N)C2O,0.2979
N#CCC12C3C4C3C1C24,0.2733
OC1COC(=O)C2OC12,0.25
CCC1(O)C2NC1C2=O,0.2514
CCC(=O)C1=CNCC1,0.1777
Cc1c(onn1)NC=O,0.1983
OC1=C(F)C=NOC1=N,0.171
CC(C=O)C(C)C(N)=O,0.2063
CC1C(C)C1CCC#N,0.3114
C(C1CO1)C1CC2OC12,0.3426
CC1CCC(C)(C1)C=O,0.2307
NC12C3C4C1C2(C#N)N34,0.2257
CCC1CN1CCC#C,0.2853
CNC(C)(C#N)C(C)C,0.2819
c1nc(c(c(n1)F)O)N,0.2139
CCC1(CN1)C(=O)C#N,0.1904
N=C1OC2C(C12)N1CC1,0.2717
Cc1nc(co1)COC,0.2411
CC#CCN=C(N)OC,0.279
C1C2OCCN=COC12,0.2461
OC(C#C)C1NCC1=O,0.2176
C(#N)c1c([nH]c(n1)O)N,0.2054
OC12CC3OC(C13)C2=O,0.2065
OC12CCC11NC2C=C1,0.2097
CNc1c(c[nH]n1)OC,0.2199
CC1=CCC2C(O)C2C1,0.2491
CC1OCC(C=O)C1O,0.2237
N#CC12NC3CC1CC23,0.2531
NCC1(OCC1O)C#N,0.2504
C(=Nc1[nH]c(=O)[nH]n1)N,0.1802
CC1N2CC1(C2)C=O,0.1888
NC(C#C)C(CO)C#N,0.2761
OCC1OC(=O)C2CC12,0.2693
CC(O)C1CC2CC1C2,0.3352
CC(C)C1(CC1)C(C)C,0.3381
CC1CC(O)C1(C)C#N,0.3049
N#CC1CC2(CO2)C=C1,0.2503
NC(=[NH2+])C1NC1C([O-])=O,0.2561
CC1C2C3C4OC2C1C34,0.3285
O=CC1NCC1C#N,0.2078
CC(O)C#CC(O)C=O,0.2139
Cc1cnc(=O)[nH]n1,0.1694
CC(=O)C1(CO1)C#C,0.2224
CC1C2CC1(O)C(=O)O2,0.2768
N#CC1(CO1)C1CN1,0.2581
CC1COC1(C)C1CC1,0.3278
CC12CC(=O)C3C1CN23,0.2161
c1nc2c(n[nH]c2o1)N,0.2092
O=C1C2CC(O2)C11CO1,0.1958
CCc1c(nc(o1)N)C,0.2304
CC(CC(C)C#N)C=O,0.2262
O=C1CC23CC(O2)C3N1,0.2756
C1CC=C(C1)C#CCO,0.204
OC12CC3OCC1NC23,0.2974
C#CC1C=CCC2CC12,0.2648
N=COC1=CNC(=O)O1,0.2139
CC1OC=NC11COC1,0.2631
C1CC1N(CCO)C=O,0.2636
CC(C)c1cc(co1)N,0.2205
CCC1=CCC(=N)OC1,0.2545
[O-]C(=O)C1CN(C1)C=[NH2+],0.2595
C1C2CC3(CCOC3)C12,0.3183
CC1OC1(C)CN1CC1,0.3189
CC(=O)C1COC1(C)C,0.2239
C1Oc2c([nH]nc2O1)O,0.2383
CC12CC1C(=O)N2C=O,0.2248
CC1C2CCC1CCC2,0.3568
O=C1CNCC2OC12,0.1933
CCC(CCOC)C=O,0.2265
C#CCC#CC1CCC1,0.282
c1c(cnc(c1O)O)F,0.1972
CC1=NNC(=N)C(N)=C1,0.169
CC#CC(C)(C)C(=O)C,0.2257
CC1C(O)COC1C#C,0.2935
CC1=C(F)ON=NC1=N,0.2135
CCOC12CC3CC1C23,0.3331
O=CC1CC2(CC2)O1,0.2041
C#CC(=O)OCCC#N,0.2378
CC1NC11CC2NC12C,0.2921
OC1CC11CCC2OC12,0.3057
c1c[nH]c2c1CCCN2,0.2274
NC1=NOC(=N)C=C1F,0.1605
NC(=O)C1OCC1C#N,0.2496
Cn1c(cnc1C#N)N,0.1901
C#CC12CC(C1)CCC2,0.3028
C1N=CN2C3C4NC3C124,0.2321
CCCC1(CN1)C#CC,0.282
c1c2c(nno2)oc1N,0.1757
N=C1CCCOCO1,0.277
CC1CN(C)C(=O)C1O,0.2723
COC(=O)NCC1CN1,0.3096
COC(C)C(O)CC=O,0.224
O=C1NCC(C=C1)C#C,0.2065
CC1(O)C2CC11CCC21,0.2994
C#CC12CC1C1CC1O2,0.2624
CC1CC2(O)C(O)C12,0.3004
CN1CC1C1CC(=O)O1,0.2505
COC1(CCC1)C(C)O,0.3011
COC1CC(C)N=CO1,0.2751
C1CC1C(=O)OCC=O,0.2285
OC1COC2C3CC3C12,0.2969
NC(=O)C12CC1OC=N2,0.244
OCC(O)COC=O,0.2799
c1cn[nH]c1CCC#N,0.2539
OC12C3C4C1N4C23,0.2728
CCC#CC1NC1(C)C,0.2743
CC1OCC2=C1COC2,0.2469
CC1CN2N=C(C)N=C12,0.2669
OCC1CC2NC12C#C,0.2531
O=CC1CC2CCC1C2,0.2238
CN1C2C3CC3(C)C12C,0.3158
CC12CC(C)(C1)C1OC21,0.3335
CC1=CN=CC(=N)N=C1,0.1677
CC1(CC(C1)C2CC2)C,0.3453
c1c([nH]cn1)C2CC2,0.2451
c1c(cn(c1O)C=O)N,0.1689
CC(C(N)=O)C(=O)C=O,0.161
CC1(CO1)C1CCCC1,0.3396
CC1C=CCC11CCC1,0.2625
O=C1NCC11C2CN1C2,0.2543
OCC1C2COCCN12,0.2792
CC1OCC(=O)N2CC12,0.2295
O=COC12CN3C1CC23,0.2576
NC(=O)CN1CC1C=O,0.2032
CC12NC1C1NC2C1O,0.2777
C1CC23OC(OC12)C=C3,0.2424
Cc1ncc(o1)C(C)C,0.2373
OC12C3N=C4NC1C4C23,0.1605
N#CC1C2C3C=CC1N23,0.218
CC1CC2(O)CCC12,0.3213
O=C1NC(=O)C2CC2O1,0.2504
CC1CCN=C(N1)C#N,0.2099
N#CC12NC3C1C=CC23,0.219
CC1(C)OC2CC1CO2,0.328
CC#CC12CC1CC=C2,0.2335
COC1CC1OC(N)=O,0.3053
OCC1(CC1)N1CC1C,0.2798
C1C2CC34COC3C2C14,0.3152
C1OC2C3C4OC4C1C23,0.2911
CCC1C=CC(O)C1=O,0.2217
CC12CC3CC(O)C1C23,0.3191
N=C1COC(=O)C(=O)O1,0.2061
CC1N(C)C1(C#C)C#C,0.2424
CC(C)C12OC1C1CC21,0.2925
C#CC1CN2C=CC=C12,0.2391
CC(C)C1C2OC(C)C12,0.3133
CC(=O)C1(C)CCC=C1,0.2168
CC(NC=O)C1(C)CC1,0.2793
CCC(=O)C1CC1,0.2347
CC1COC1CO,0.3113
C1C2OC3CN1CC23,0.2892
CC1COC2CN(C)C12,0.2926
CCOC1C2CCCC12,0.3109
OCC(O)(C=O)C1CO1,0.2077
O=C1OCOC1C1CO1,0.2707
CC1NC11COC(C)C1,0.3178
CC(C)Cc1ccno1,0.2434
CC(=O)C(O)CO,0.2253
CC1CC2COC2C1=O,0.1979
CC1C2C3C=C(C)C2C13,0.2242
c1c(=O)ncoc1O,0.2095
CC12CCC1OC2C#C,0.2634
CN(CCCC#N)C=O,0.2709
OC1C2CCC(O2)C1O,0.2901
CC1CC(=O)OC1C#C,0.2751
Cc1ccn(c1OC)C,0.238
O=C1CC2CC=CC2N1,0.2444
c1c2c(on1)NCCO2,0.2064
C#CC#CC1CCC=C1,0.2264
N=C1N=NON=N1,0.1641
CC1OC(CCO)C=C1,0.249
OC12C3CC(C1O3)C2=O,0.2128
CC#CC1CC1C#C,0.2653
OC1CN2C3C=CC2C13,0.2201
C(C(CO)C(=O)C=O)O,0.1512
NC(=O)C(O)C1CCO1,0.273
CC1C2CC(=O)C=CN12,0.1814
Cc1ccn(c1)CC=O,0.1726
CC1CCC23CCC12O3,0.3199
CCCCC(O)C1CN1,0.3167
O=C1CC2CCOCC12,0.2198
CCC1(CCOC1)C#C,0.3025
CC(=O)C(=O)NC(=O)C,0.1636
O=C1CC23COC2CC13,0.2159
NC=[NH+]C1=C([O-])C=CN1,0.1159
CC1CC=CN(C1)C=O,0.214
C1NC11COCC11CO1,0.3074
CNc1cn[nH]c1C=O,0.1583
c1c([nH]c(c1N)N)C=O,0.1616
c1(c(non1)N)C(=O)N,0.1834
COC1C(O)C1C#CC,0.2696
CC12OC3CC(C1O)C23,0.3103
CC(C)C(=O)NCCO,0.2767
CC1OC(C)C2C1N2C,0.3072
Cc1cccc(c1)C#C,0.2009
c1c(nc[nH]1)NCC#N,0.2233
CC1OCCN=C(C)O1,0.2545
C#CC1=CCOC1=O,0.199
OCC1N2CC2C1=O,0.2191
CC1=C(OC=N)N=NN1,0.2206
O=CC1(C=O)C2CN1C2,0.1834
CC1C=CCC1CC=O,0.2257
O=CCN1CC2OC2C1,0.2008
O=C1C2OC1C1CC21,0.2394
CC1C2C(=O)NC12C,0.2526
CCCOCCCOC,0.3354
NC1=CN=CC=NC1=N,0.1294
CCC(C)C(CC)OC,0.3225
CC12OCC1NC2CO,0.2994
OCC1(CC1)CC1OC1,0.3324
C1C2(CO1)C3(O2)COC3,0.3076
NC(=O)C1NC11COC1,0.2533
OC1CCC2OC12C#C,0.2699
c1c(nc(c(n1)F)O)N,0.1775
O=C1C2CC3C1CCN23,0.2061
CC1C2NC2CC1O,0.3137
CC(C#C)C1CO1,0.3085
CC1CCCC(O)C=C1,0.2541
CNc1cccc(n1)F,0.1953
C1CCN=COC(=O)C1,0.247
CC1C2CC(=O)CN12,0.2019
CC(C)(C=O)C=O,0.2149
NC(=O)CCCOC=N,0.2761
CC(=O)N1CC2CC1C2,0.2679
C1c2c(oc(=O)[nH]2)CN1,0.2379
O=CCN1CC1C1CC1,0.2141
CC1CC1(OC=N)C#C,0.2682
CC1CC(C)C1(O)CO,0.3041
C1C2C3C4C2C1N34,0.307
C#CCC1(CO1)C1CN1,0.2937
N=C1OC(=O)N2CC12,0.2591
OCCC(OC=N)C#N,0.2775
O=C1CC=CCC2CC12,0.2273
CC1C2C3CC1C23CO,0.3012
O=C1C=CC2C3CN3C12,0.1798
C1C(CO1)(CO)C#N,0.283
COC12CN(C1)C2C#C,0.2703
CC(NC(C)C#N)C#C,0.2685
c1coc(n1)C(=O)N,0.2153
C1CCC2(C1)CN=CO2,0.2716
O=C1OC(C#C)C1C#C,0.2634
COC1CC(O)C1=NO,0.2295
CC(=O)NC1=NCCO1,0.2348
N#CC1CC11OCC=C1,0.2242
CN1C(=N)CC(O)C1=O,0.2476
c1c[nH]c2c1[nH]c(c2)O,0.2073
CC#CCC(C)(C)O,0.294
COC1(CC1CO)C#C,0.2797
CCC1(CO1)C1(O)CC1,0.3245
C1CN=C(OC1=O)CO,0.239
[O-]C(=O)C[NH2+]C1CCC1,0.2668
CC1COC(=NC1)C#N,0.23
CC1C2CC1(C)OCC2,0.3137
CNCC(O)(C=O)C#N,0.2171
OCCC1CC2OC12,0.3309
Cc1c[nH]cc1NC=O,0.2131
Cc1cnc(c(n1)F)O,0.1938
C1COCCC1C=O,0.2215
C#CCC12CC1N=CO2,0.2598
CC1(O)COCC1(C)O,0.3
O=C1C2OC2C11CCO1,0.1944
C1C2C3OC22CC1CC32,0.2129
O=COC12CC3C1N3C2,0.2505
O=C1CC2OC12CC#C,0.2161
CC1C2CCC(=N)OC12,0.2787
CNc1cnon1,0.2037
CC1CC=CNC(=O)O1,0.2298
Cc1c([nH]cn1)OC=O,0.2161
OCC1CCC2COC12,0.3241
O=C1C2C3C1N=CN23,0.198
C1CC11CCC2(CO2)C1,0.3284
CC12CC3C1N2C31CC1,0.3252
C#CCC1CC2(C1)CC2,0.3097
CC1(O)COC1CC#C,0.2975
N=C(C=O)N1CCC1=N,0.1783
O=C1CCC2(CO2)CN1,0.2699
CC(C)C1C2CC1O2,0.3094
CC1CC(O)CC11CO1,0.3236
C1CC23CC(CO2)CC13,0.3117
OC1CC(=O)C2(CC2)C1,0.2215
CC1(CN1)C1COC1=O,0.2655
CCC(OC)C(C)C#C,0.2989
CC1C=CC2(CC12)C#N,0.2449
CCc1c(ncn1C)C,0.2406
CC(=O)CC(O)C1CO1,0.2306
NCC1(CN1)C#N,0.2834
O=C1OCC=CC1C#N,0.2533
OC1CCOCOC1=N,0.2656
CC1=CC(O)(CO)CC1,0.2599
N1C2C3C1C21N=COC31,0.2361
CC(C)NC(=O)CC#C,0.2758
NC(=O)C1CC2OCC12,0.2574
OC1C=CC2(CC2)C1=O,0.2056
CC(C#CC#N)C1CO1,0.2373
COC1OC(=O)C(C)=C1,0.2254
OC1(CC1C1CC1)C=O,0.2127
CCC1OC2CC12C#C,0.2641
COC1C2C=CC(O)C12,0.2344
CC1C(=O)C2C3CC12C3,0.2167
CC1=CC2(O)CCC2C1,0.2528
FC1=NNC(=N)NC1=O,0.1802
CC(NCC1CO1)C#N,0.2738
CC12C3CC1COCC23,0.315
CC1(CCC#N)CCO1,0.2988
O=CC12CC3C(C1)C3C2,0.2275
CC1C(O)C(C)C1CO,0.3093
c1nc2c(o1)CCCC2,0.2351
CC(CO)C1=NNN=C1,0.2569
CC1=NOC(OC=N)=N1,0.2406
CC(O)C1C2COCC12,0.3151
CNC1=NC2(C)CC2O1,0.2643
CC(O)(CCO)C=O,0.224
CC(C)(C(=O)N)OC=O,0.2531
OCCC12CC(CC1)O2,0.3245
N=COC12CC3C1OC23,0.2567
CC(C)C(=O)C(C)C=O,0.1992
COCC(C[NH3+])C([O-])=O,0.2732
Cc1[nH]cc(n1)C2CC2,0.2334
C1C2C3C4CC3C4N12,0.3237
CC(CC#N)C(=O)C#C,0.2063
CC1(C)COC1CC#C,0.2976
c1c(nco1)CNC=O,0.2423
COCC1CCC(=N)O1,0.2871
CCC([NH3+])(CO)C([O-])=O,0.2675
CC1N=C(C)N(C)C1=N,0.2243
CC1CCC=CC1(C)C,0.2682
ON=C1C2OC1C1OC21,0.2544
CCC1COCOC=N1,0.2573
c1(=O)nc(oc(n1)F)F,0.2344
O=C1CC2C1C21CCO1,0.2239
CN=C1C=C(N)OC=N1,0.183
CC1CCC1(C#N)C#N,0.3091
C#CCC(C#N)C1CN1,0.2805
O=CNC(C#C)C1CC1,0.2729
C#CC1(COCOC1)O,0.2733
C#CCN1CCCC1=O,0.2676
CCC(=O)OC1CCC1,0.2844
Cn1c(=O)[nH]c(n1)N,0.2408
CCOC(=O)NC(=O)C,0.2461
NC1=CNC(=O)C(=N)O1,0.1621
OCCC12CC3CC1N23,0.3157
OCC1OC(C#N)C1=O,0.2113
COC1(C)CN=C(C)O1,0.2785
CC12NC1C(=N)NC2=O,0.2293
O=C1C2COC22CNC12,0.1961
CC1CC(C1)C#CCO,0.2778
CC1NC(=O)C2CC12C,0.2648
CC1(O)CC2CC1C2O,0.3212
CN1CC1(CC#C)C#C,0.2699
NC(=O)C1NC1C#N,0.2474
CCCC1OCCC1=O,0.2166
CCc1c(oc(n1)C)N,0.2171
C1CC1C1NC11COC1,0.3023
OC1C2N3CCC2(O)C13,0.3037
CCC(COC)C(C)=O,0.2291
CC12CC1C(=O)O2,0.2766
c1cnc(nc1F)F,0.2336
CC12CC3OC1C23,0.3064
COC1=C(N)NC(=N)O1,0.2299
CC(CO)C1=NOC=N1,0.2475
CC1=CC23COC2C1O3,0.2228
c1cn2c(cn1)cnn2,0.178
CCOC1=NCC(C)N1,0.2774
C1Cn2c1c(nc2O)O,0.2413
C1COCCOC1=O,0.2666
OCCC1C2CC1C=C2,0.241
CC1=CC2CC(O)(C2)C1,0.2491
O=C1C=CCC11CO1,0.1828
OC1(CC1C#C)C1CO1,0.2795
CC12C3C1C1C(O)C3C21,0.3043
CC(=NO)C1CN1,0.2333
CCC1NC1C(N)C#N,0.2823
OCC12CC(C1)CC2,0.3359
C(=O)c1c(onn1)C#N,0.1709
CC1C2OC3C2C3C1O,0.306
CC1C2C3C1CC23CO,0.3141
CC1CC2(C)CC(C)C12,0.3274
CCC1(C)C(O)CC1=O,0.2155
CC1(O)CC11OCC=C1,0.2272
O=C1OC2(CC2)C1C#C,0.2661
CCC12CC1N=C(C)O2,0.26
OC1C2C(C#N)C1C2=O,0.2415
CC1OC(C#C)C1(C)O,0.2671
CC1=CC=CC(=O)NC1,0.1794
CCOCCC(O)C#N,0.2731
CN(C1CC1)C(=N)C=O,0.1539
CC(=O)OCC(=O)N,0.2709
COC1C2OC(C)C12O,0.2956
CCC(C)CC1CC1O,0.3319
CC(C#N)C1CC1,0.3366
CC1=CC(=N)ON=C1,0.1673
N=COC(=O)N1CC1,0.2602
CC1OC2C3CC2C3O1,0.3478
CC(=O)C(CC#N)C#C,0.2254
CCC1CC(O1)=NC,0.2795
O=CCC1CN1C1CC1,0.2114
C1C=CCOC(=O)CO1,0.2174
OC1C2OC3CC3C12O,0.2972
CCN=C1OCC1N,0.2633
CNC(=O)c1cnno1,0.2021
CCNC(C)(C#C)C#N,0.2507
c1c(c(ncn1)F)N,0.1996
C1CCOC(=NC1)C=O,0.1893
COCC(C)C(=O)C#C,0.1981
CC1CC2C3CC1CC23,0.3331
C1CC(C1)N(C=N)C=O,0.2266
CC1=CC2CC2CC1=O,0.1894
CC1OC(C)C1C1CO1,0.3237
c1nc(nn1C=O)N,0.1847
CN=C1C=NNC=C1C,0.1668
CC1CC(C)(C#N)N1C,0.2556
C12C3C4C3N3C1C2C43,0.2984
CCC1C2C3CC2(O)C13,0.3311
Cc1c(n[nH]c1NC)N,0.2408
CC(C)(C)C(C#C)C#C,0.2924
OC1CC(=O)C=C1C=O,0.1492
Cc1c(nn(n1)C=O)N,0.1862
N=C1CC23CC(C2)C3O1,0.2858
CC1(C)C2CC(C#C)C12,0.2975
OC12CC3(C=O)C1OC23,0.2037
CC12CC3C1N3C(=O)N2,0.2665
COC1(C)CCC(C)C1,0.3247
OCC1OC2CCC1O2,0.3349
C1CN=C2NC=CC2O1,0.2064
c1cc(=O)oc(c1N)O,0.1517
C1CC2(C1)COC23CC3,0.2969
OC1C2OCC3(CC3)C12,0.3084
CC1N2CC3C2C13C=O,0.2018
CC1C(O)C(N)C1C#N,0.2727
CC1CN1C1=CON=N1,0.1935
CC(C)N=C(C)OC=O,0.2403
Cc1cnc(o1)N2CC2,0.2268
C[NH2+]CC1=NOC(=N)[N-]1,0.157
OCCC1(CC#C)CO1,0.3046
CN=C1OC=NOC1=N,0.2113
Cn1c(=O)[nH]nc1O,0.2574
CC12NC1C(=O)C2C#N,0.2161
OCCCC1CC(=O)N1,0.2838
CC1(CO)CC2NC12,0.299
OCC1OCC2CC2O1,0.3374
OCC1CC2=CCOC12,0.2361
c1c(ncnn1)C2CC2,0.1701
CC12CC3CN4C1C2C34,0.2796
CC(C)(CO)C#CC=O,0.2055
OC(C=O)C1(CN1)C=O,0.2205
CC12CC3C1CCC3C2,0.3581
O=C1C2C3C2C2(CC2)C13,0.2402
C1OC11CN2CC3C2C13,0.3135
CCCC(O)CCC=O,0.2298
CN1C2COC=NCC12,0.245
CC1C2C3OC4C1C2C34,0.2861
CC#CC1N=COC1=O,0.2277
COCC1(CC1)CC#N,0.2992
COC1CC1(O)CO,0.3008
C1C=CC2C3C=CC2N13,0.2038
CCCOCC1(C)CO1,0.3365
CC1C(O)C2C(O)C12O,0.2867
CC1CC2OC2C1C=O,0.2212
CC1(CN1)C(O)C#N,0.2969
OC1CC2OCC2C=C1,0.2472
C1C2N3CC22CCCC132,0.2883
COC1C(C)C1CCO,0.314
O=CC12CCC1C1NC21,0.2076
C1CC2OC(O1)C=C2,0.2514
c1[nH]c(c(n1)C=O)C=O,0.1692
CC1(O)C2OC2C11CC1,0.3132
CC12CC3C4C1CC2N34,0.3189
C1C2C=CC11OC=NC21,0.2286
C1NC1C1=NC=NN1,0.2583
CC1CCC(O)C(C)=C1,0.2576
CC(O)C1CC(C1)C#C,0.3025
CC12C3CC(N13)C2=NO,0.24
NC(C#N)C12CC(C1)N2,0.2742
CCC1NC(C#N)C1C,0.2676
CCCCC(=O)C#N,0.2112
CC1COC2CCC12C,0.3131
O=C1CCC11CN1,0.2143
CCC12CC1OC2C#N,0.256
Cn1c(ccn1)N,0.2438
CC(CN1CCC1)C#N,0.2695
CC(C=O)C#C,0.2213
c1c(nc(n1C=O)O)N,0.1544
CCC1OC(=O)C1O,0.2629
O=CCC1OC11CCC1,0.2244
C1OCC11C2C3OC3C12,0.2833
CC(C[NH3+])C(O)C([O-])=O,0.1113
CC1OCC(O)C2CC12,0.3167
CC1C2CC(=O)CC12C,0.224
CC1OCCN(C)C1=O,0.2597
CC12CC(C)(O)C1O2,0.3139
COC1CCC1C1CC1,0.3226
COCC(O)C#CC,0.2859
ON=C1C2CC=CC1O2,0.2347
CCC12OCC1C2OC,0.3029
CCCC1NC1C1CO1,0.3185
CC1=CCOC2CC12C,0.247
CC1=NCC(O)C(=O)N1,0.2298
CC(OC1CC1)C1CN1,0.316
CC1(O)CC1C(O)C=O,0.2182
CCC1(CN=CO1)C=O,0.2164
CC1C(O)C2CC1(C)C2,0.3239
N#CC12NCC1C1OC21,0.2387
CC1OC1(C)C1(C)CC1,0.3447
Cc1c2c(cn[nH]2)on1,0.2169
C#CC1(CCOC1)C#C,0.2771
COCC#CC1NC1C,0.2692
CC1(C(=O)CN1C=O)C,0.2108
CC(C)(CC#N)CC#N,0.3303
C(=N)N(C=O)C(=N)N,0.2116
OC(C1CC1)C1CCO1,0.303
O=CC1NC2(CC12)C#N,0.2038
CCCOC1CCCO1,0.3467
OC1(CCC1C#N)C#C,0.2811
OC1C=CC2=COC=C12,0.1972
CCCC1CC1C1CC1,0.3311
CC(=NO)C1CCC1O,0.2431
CC1COC(C)C1CO,0.3117
COCC#CC(=O)C#N,0.1764
O=C1CC2CCC1C=C2,0.2132
C1CN1C12C3CC1OC23,0.2908
OC1(CNC1C#N)C=O,0.1965
COC1(COC1)C1CO1,0.3203
CC12CC1C1C2OC1=O,0.2586
c1c(nn(n1)C=O)C=O,0.1773
CC1CC11CC2(CC2)C1,0.3362
OC1(CC1C#N)C#C,0.2685
CC1CC2CC1C2C#C,0.3021
ON=C1CCC1OC=O,0.2411
C#CC(=O)c1ncon1,0.1906
C1C2C3OC22CC=CC132,0.2309
c1cc(nc(c1)F)F,0.2243
c1c[nH]c(c1N)CC=O,0.161
CCC(C)CC(C)CO,0.3407
OCC(CO)CC1CO1,0.3026
CC1(CC2CO2)COC1,0.3205
O=C1CCC1CN1CC1,0.2184
C1C2OC3CC12CCC3,0.3063
CC1(CO1)C1COC1=N,0.2852
CCOCCN1CC1C,0.316
CC12COCC3C1OC23,0.3122
c1cc([nH]c(=O)c1N)F,0.1681
OC1CCC(=O)CC1O,0.2249
CNC(CC#N)C#N,0.2554
OCCC(=O)C1CN1,0.2325
CN1N=CN(C=O)C1=N,0.1687
OC1C2(CC2)CC11CN1,0.3087
C1C2C1C1C=CCOC21,0.2559
CC1C2OC1C1NC21,0.3124
C1CN=C(C1=NO)N,0.188
Cn1c(cnc1C=O)N,0.1675
COc1cnccc1F,0.2182
CC1(OCCC(=O)O1)C,0.275
c1c([nH]cn1)C#CCO,0.2006
CC(O)C(CC=O)C=O,0.2191
CN=COc1ccc[nH]1,0.2154
CC#CCNC(=O)OC,0.2871
c1cn(cc1N)CC=O,0.1496
CC(=O)C1N=CNC1=O,0.2127
CC1=CC(O)CCC1,0.2528
CC([NH3+])C1=N[N-]C(=O)O1,0.1547
CC12C3CC1(CC23)C=O,0.2171
OCC1CN2C(C=O)C12,0.1971
Cn1ccc(cc1=O)O,0.1885
CC1=C(CCC1)C(=O)C,0.1924
N=C1C2C3NC(=O)N1C23,0.2306
Cn1c(nc(=O)cn1)O,0.1904
OC12CC3(O)C1CC23O,0.3003
O=C1C2CC3CCC1C23,0.2155
CC1=CC(=O)O[C-]1C[NH3+],0.1771
CC1C(O)C(C#N)N1C,0.2582
CC1CC1C1OCC1O,0.3067
CC12OC1COCC=C2,0.2369
CC(C)C#CC(=O)N,0.2337
O=C1NCCC2CCC12,0.264
CN1C2(C)CCC12CO,0.3249
COC1C(=O)CC=C1C,0.2007
C#CC12CC3=NCC1N23,0.1934
CC(C=O)C1(C)CCC1,0.22
CC1CCC(=O)N2CC12,0.244
CCCC(=O)NCC#C,0.2711
CCCC1OC1C(C)C,0.3434
CC1OC=NC1(C)C#C,0.2667
OCCC1CC2CC2C1,0.3389
C1CCC(CC1)OC=O,0.2857
COC1CC=CC=CC1,0.1931
N=C1NC2C1OC21CC1,0.2469
O=C1CN2CC2C2NC12,0.2038
CCOC(CC=O)C=O,0.2032
CCCCC1C2CC1O2,0.3146
OCCC1CN1C=O,0.2533
CC#CC1(CC1O)C#C,0.2581
c1c(nno1)NC(=O)N,0.2023
COC1CC(CO)C=C1,0.2624
OCC1C2C3N2C1C3=O,0.2298
c1cncnc1F,0.2269
CCC12C3CC(C1C)N23,0.3176
NC(=[NH2+])C1=CN=C(O)[N-]1,0.154
CC12CC(C#N)C1(C)N2,0.2701
ON=C1CC2CN2C1=O,0.1774
COC12C3C1N1C3CC21,0.2916
CC1(CO1)C1OCC=C1,0.2478
CC1=C(N)CCOC1=N,0.1981
C1C2CC3OCC1C23,0.3134
CC12C3C4C(C)(N13)C24C,0.2791
CCC1CN2CC2C1O,0.2867
C1CC(O1)C12CN(C1)C2,0.2955
CC1NC(=O)NC=C1C,0.223
CC(O)C1(O)CCCC1,0.3125
OCC1C2C3N2CC13O,0.2784
COC(C=O)C1CC1O,0.2114
CC(C)(C#N)O,0.3148
OC12C=CC34CC(C13)C24,0.2224
CCOCCC#N,0.3056
N#CCC12OC3CC1C23,0.2762
C1C2CC11CC=CC1O2,0.2494
OC12C3CC4CC1N4C23,0.2904
CC(O)C1=NC(N)=NO1,0.2294
NC(=O)C(CC#C)C#N,0.2683
CC1(CCC1=O)C(N)=O,0.2054
CC1CCC(=O)OC1,0.2707
OC1(CC=CC1)C=O,0.2145
OCC(=O)N1CC2CC12,0.2611
CC12CC(CC1N2)=NO,0.2454
C1C2CC3OCCCC123,0.3327
OCC1NC1CNC=O,0.2812
CN1C2C(O)C1C2O,0.2826
c1cnn2c1C(=O)C=C2,0.1464
CC1CC2NC2C(=O)C1,0.2203
OC1CC2C(OC=O)C12,0.2557
OCC1=NC(=N)N=CO1,0.2181
CCC(C#C)C(C)=O,0.2255
CC12C3N4CC1C4C23O,0.2816
OC1COCC2NC12,0.301
C1OC2C3OCC12C=C3,0.2506
CC1C(O)C1(C)C(N)=O,0.2757
CNC(C#N)C(=O)OC,0.2321
CCC1CC(O)C(O)C1,0.3165
C1C2CC3CCOCC123,0.3381
OC(C1CO1)C1(O)CC1,0.3192
C1C2OCC3N=CN1C23,0.2373
C#CCC1OCCCO1,0.3147
c1cn(nn1)CC(=O)N,0.236
CC1CNC(=O)C1C,0.2693
C(CO)C(CCO)CO,0.332
CC1COCC=C1CO,0.2595
CC(CO)CC1CC1,0.3401
CC1(O)CCC=CCC1,0.2572
C1CC2OCC1CCO2,0.3109
C#Cc1ccc2n1CC2,0.2004
O=CNC(=O)CC1CO1,0.2165
CC12C3CN1C2(C3)C=O,0.2181
c1cn[nH]c(=O)c1CO,0.18
CCC1(C)OC2(C)CC12,0.3116
C(C1CN1)C1=CNC=N1,0.2502
CC1=CNC=C1C1CO1,0.2445
NC1=NC(CC1=O)C=O,0.177
OCC1(COC=N1)C#N,0.2613
CC(C#C)C1CC1C,0.3117
ON=C1CC2OCC1O2,0.2516
N=C1C=CNN=C1C#N,0.1553
CCC1C2C=CCC12O,0.2392
Cc1c[nH]c(=O)nc1F,0.1877
COCC(O)C(C)C#N,0.3172
COC1C2COC12C#C,0.236
N=C1OC(=O)CCC=C1,0.2144
CCC1CC(O)CC1=O,0.2174
NC1=CC(=O)NC(=N)N1,0.2069
C#CCC1CCOC=N1,0.2682
CC(C)CCC(C)(C)C,0.3692
c1cc-2n[nH]nnc2c1,0.1397
C1C2CC34CC3(OC4)C12,0.2718
CC1CCC(O)C(C)C1,0.3172
C#CC(CNC=O)C#C,0.272
c1cc(ccc1CO)F,0.2262
CC1CC2(CC2)C=C1,0.246
c1c(c(n[nH]1)O)N=CN,0.1878
CC1CCC2=CCOC12,0.2427
CCC1(C)CC1(C)OC,0.3236
CCc1c(c[nH]n1)NC,0.2209
N#CC1=CC2CC3C1N23,0.1814
CC#CC1(C)NC1CO,0.2785
CNC(C)(CCO)C#N,0.2717
CC1CC1C#CC1CO1,0.2627
CC(O)C1=CCCCC1,0.2587
C1C=Cc2c1[nH]nc2O,0.1989
COc1cnc(o1)C#C,0.1829
C(=O)c1c(oc(=O)o1)O,0.1925
O=CC#CC1CN1C=O,0.1942
COCc1cccnc1,0.2297
CC12CCC(CC1)C2,0.3561
CC1OC2C(C#N)C12N,0.2696
OCC1(O)C2CC1N2,0.287
CCC1=CC2(C)CC1O2,0.2319
CCC(OC)C1CC1C,0.3324
CC1CC(=O)CC11CC1,0.221
N=C1NC(=O)OC2CC12,0.2581
C#CCC1(CO1)CC#C,0.3007
CC1=CN(CC1)C(=O)C,0.205
C#CC1C2C=CCN12,0.2238
CC(CC(F)(F)F)C#N,0.3538
O=C1C2C3C4C(CN13)N24,0.219
CC1(C)C2C(=N)OC12C,0.2739
CC1COC(C#N)C1O,0.2828
OCCC1OCCC1=O,0.2177
CCCC1(CO)CN1C,0.3099
CC12C3CC(CN13)C2=O,0.2182
CC1=CNC(=C1)C1CN1,0.2329
CCC1(O)CCC(=O)C1,0.2236
CCC1(CC1O)OC=N,0.2784
CC12CC(O1)C2(O)C#N,0.2896
CC12CN(C1)C2CC#N,0.2734
CC1=CC(OC=N)=CN1,0.2296
CCC1C2CC2(O)C1C,0.3052
O=C1CC2NC2CC1=O,0.1598
N=C1CC2CC2O1,0.274
CC(=O)NC(=O)NC=N,0.2238
C#CCC1=CCC2CC12,0.2446
c1(nc(=O)nc(o1)N)N,0.233
c1c(c(n[nH]1)N)C(=O)N,0.1918
OC1C2C3OC2C13C#N,0.2656
CCCC1CC1(O)CC,0.3203
CC1(CCO1)C(N)C#N,0.29
CC1C2OC2CC1C#N,0.3105
O=CC(CN1CC1)C#N,0.1996
COC(C#C)C(O)C#N,0.2975
N=C1NC2CN=COC12,0.2487
OC1C2CC3N2C13C#N,0.2711
CC#CC1(CN(C1)C)O,0.2492
CC(=O)C(=O)COC,0.1576
CC1N(CC11CN1)C=O,0.2639
CCC(CCO)C(C)C,0.3368
CC1N=COCOC1=N,0.2648
CC1CC2CC1(O2)C#N,0.2706
CC#CC1(CO1)C1CO1,0.2763
CC(C)(CO)C#CC#C,0.2302
CC1(CC1)C1OCC1O,0.306
C1C(CO1)NC2COC2,0.2909
OCCCC1OC1C#N,0.2692
NC1=NC(=N)NC(=O)O1,0.2332
C1CC1OCCN2CC2,0.3258
C1C2CC=C3COC1C23,0.2396
CCc1c(cc([nH]1)O)C,0.234
CCC(C)(CC)C#CC,0.3047
CCC#CC1COCO1,0.2801
COC(C)CCC#N,0.3089
Cc1cc(oc(=O)n1)N,0.1856
CC1(O)CC(C=C1)=NO,0.1932
C1CC(C1)C(=N)NC=O,0.2412
COCC1NC(=N)C1O,0.2646
CC1OC1C1(O)CC1,0.3269
O=C1OC2CC2CC=C1,0.2158
C1OC23CC4C(C12)N4C3,0.2945
C#CCC12COCC1O2,0.2989
CN(CC1CO1)C=O,0.272
CN1C2C=CC1(C)C2O,0.2082
c1coc2c1C(=O)CN2,0.1915
CC12CC3C1OC2C3O,0.3099
CCC1=NC(CO1)(C)C,0.2739
CC1CN2N=CC=C12,0.2665
N#CC12CC3C(CC13)N2,0.2683
COCC(C)C#CC#C,0.2309
CC1OC2=C(O1)N=CO2,0.1937
NC1=NC2=C(C1)ON=N2,0.1369
CC12CCC(C#N)C1N2,0.2883
CCc1c[nH]cc1C#N,0.2257
OCC1CC2CCC2=C1,0.2459
CNC12C3OC1C(O)C23,0.2912
CC1CC2(CN2)C(=O)N1,0.2577
CC1C2CC1C(=O)C2O,0.2195
CC1NC1C1OCC=C1,0.2478
CN1C(=O)COCC1=O,0.2314
Cc1c(ocn1)C,0.2382
CC1(C)CC(=O)C1C#C,0.2158
CCC#CCNCC=O,0.2161
CC1C(CO)CC1(C)O,0.3227
CC(C)C1OC1(C)CO,0.3375
CC(=O)CCC#N,0.2356
COC1C(O)C1OC=O,0.2461
COC(C)C(C)C(N)=O,0.2761
CC1C(O)C(C)C1(C)O,0.3076
CC12CCCC3C1CC23,0.3656
CC(C)(C1(CC1)OC)O,0.3196
O=CC(=O)N1CC1C#N,0.1705
CC1(C)CC(O)C(=N)O1,0.2864
CC1(CC=C(C1)CO)C,0.26
CC(=O)CC(=O)OC=N,0.2192
CCC1C2CC1(CO)O2,0.3113
CC1(CC1)OCCC#N,0.2965
Cc1c2n(cn1)CCO2,0.23
OCC1OC=NCC1O,0.263
c1cc(=O)[nH]c(c1O)F,0.1634
CC(=O)C#CC1CC1,0.2072
CC12CCC3C1CC23,0.374
CC1C2CC=C(C#N)C12,0.207
CC1C2C=CC3CC3C12,0.2447
CC(NC=O)(C=O)C#C,0.2203
CCN(C)C(=O)NC=O,0.2397
CN=c1[nH]c(c(o1)N)N,0.2268
CC1C2COC1C2=NO,0.2458
C(C#N)n1c(=O)onn1,0.2343
OC(C#C)C12CC(C1)C2,0.2915
CC12C3OC1(C)C(=O)C23,0.2249
O=C1C2CCC2C1C#C,0.2096
OCCCC1(CN1)C=O,0.2235
CC1CCCCCOC1,0.3189
c1c[nH]c2c1NCC2,0.2134
CC1NC1(C)C#N,0.2858
C1CC2CCCC(C1)O2,0.3074
CCC1(CC1)C=O,0.2329
NC1COC2=NON=C12,0.219
COC(=O)C1CC1(C)C,0.278
OC1CN2N=CN=C12,0.266
C1OC11COC2COC12,0.3003
CCN1CC11CCC1=O,0.2023
CC1(OCC=C1)C(N)=O,0.23
OC1C2CC1C(=O)NC2,0.2711
CC#CC12COC1CO2,0.2569
COC1=CN=CC(=N)N1,0.1549
CC1CCC2CC1(C)O2,0.3107
C1CC1NCC#N,0.2622
N#CC12NC1C1NC21,0.2296
OCC12CC(C1)(O2)C=O,0.2131
c1c(c[nH]c1N)C(=O)N,0.2018
O=CC12C3C4CC1N2C34,0.2
CC1C(O)C2C(CO)N12,0.2774
CC(C=O)N1CC1CO,0.1895
C#Cc1cc(no1)N,0.1955
CC1CC2CC1COC2,0.3203
OCC1CC(CO1)=NO,0.249
CCCN=c1[nH]cno1,0.2196
C(c1c(nno1)CO)N,0.2168
CC(C)(CC#N)C1CN1,0.2844
CC1C2OC(=N)C(=O)C12,0.187
C(C1CC1)C1CCCO1,0.3238
CCn1c(cnn1)C#C,0.2128
CCC1CC(C=O)=CN1,0.1788
CCC(C)(C)C#C,0.3192
C1C(CO1)(CO)O,0.298
CC(=O)Oc1cnoc1,0.231
OC(C=O)C1(CN1)C#N,0.2156
OCC1NC(CO)C1=O,0.2132
CC#CC(C)(C)N1CC1,0.2821
OC1C2CC1C(=N)O2,0.2778
OC1CC1CCC#N,0.3086
CC1C2NC2C2OC12,0.3076
OC12C3CC1CC23,0.3071
CC1(N)C(NC1=N)C#N,0.2519
CCC1C(O)C11CCO1,0.2745
Cn1cnc(n1)C#N,0.2396
CCCCC(OC)C=O,0.2132
OC1C2CC1(C#N)C2=O,0.2415
O=C1CC2N=CN3C2C13,0.2089
ON=C1C2CC1(O)C2O,0.2663
CC1(C#C)C2CC=CC12,0.2304
CCC(O)C(NC)C#N,0.2639
c1cnc([nH]1)CCO,0.249
Cc1[nH]c2c(n1)cc[nH]2,0.2177
C#CC#CC1CC(=O)C1,0.2126
CC1OC1C(=O)OC=N,0.2408
CCn1cnc(c1O)C,0.2377
OC1C2C3C(C#N)C2C13,0.2993
CC1OCC=CC=C1C,0.1884
c1c(nc[nH]1)C(=O)CO,0.2074
CCCc1nc([nH]n1)N,0.2543
CC[NH2+]C(CC)C([O-])=O,0.2679
CNCC(OC=O)C#N,0.2336
c1c(c(n[nH]1)CCO)N,0.2183
OC1CC(=O)C2OC12,0.2142
CNC(C)C1=NON=N1,0.173
O=C1NCC1C1CO1,0.2793
O=C1C=CCN2CC12,0.1813
N=C1C=NOC(=C1)C#C,0.1742
c1nc2n(n1)C(=O)NC2,0.2463
COC1(CC2NC12)C#C,0.2693
CCCC1(OC1C)C#C,0.2854
NC(CC#N)C#C,0.2727
COC1C2CCC(O)C12,0.3139
c1c(n[nH]n1)C#CC#N,0.1979
N#CC1(CC1)C1NC1,0.2992
CC(=O)C(=N)N(C)C=O,0.1718
c12c(nn[nH]1)nn[nH]2,0.2183
CC1CCC1=NO,0.2499
CCC(=O)OC,0.2871
CC1CCC(C=O)=CC1,0.1982
CC(C)C1OCC(=N)O1,0.2896
Cn1cc2c(n1)[nH]nn2,0.2002
O1CC2(C1)C1CC2C1,0.3198
c1cc(c(cc1F)O)F,0.2175
NC(=O)C1C2C3CN3C12,0.2483
O=C1CC2OC3COC123,0.2077
C1C2CCN=COC12,0.2603
CCC(C)COCCO,0.3332
C1C=C2C3OC3C3C2N13,0.1994
O=C1NC2CNC12C#C,0.233
C1CC2=CCOCOC12,0.2504
CN1C2CC3CC(O3)C12,0.2868
C1CC23C=CC4C(C12)N34,0.2082
CC1CN(C)C1C#N,0.2521
OC(CCC#C)CC=O,0.2219
CC(C=O)N=C(N)CO,0.1999
CC(CC#N)C(O)C#C,0.2954
CC1CCC2NC1C2=O,0.2228
O=C1CNC2(CC12)C#N,0.197
C1CC(=O)CNC1,0.1973
C1C2CCCOCCC12,0.3225
O=C1CC2CN2CCO1,0.2521
c1cnn(c1C=O)C=O,0.184
COC(C)(C=O)C1CC1,0.2112
OC1C2CC=CC1C2=O,0.2092
N=CN1C=CCOC1=N,0.2134
OC1C2N=CNC=NC12,0.1995
c1cnc(c(n1)C#N)N,0.1671
CC12OC3C4C1N4C23C,0.3116
OC1CC=CC2CC1O2,0.2366
CC#CC(C)C(=O)C=O,0.1461
CC1CC(=O)CC1C,0.222
NC(CCCO)C#N,0.2868
CCC1CCC1(C)CC,0.3528
N#CC1NC1C1CO1,0.2813
NC1=C(OC(=N)O1)C#N,0.1955
COC1CC1C(=O)C#N,0.1947
C1C(CO1)C#CCCO,0.2928
C(c1nc(on1)N)O,0.2499
OCC12CC(CC=C1)O2,0.2426
CC1COC(=N)C1=NO,0.2069
CC1CN=COCC1=O,0.2156
O=CC12CC3C(C=C1)N23,0.1918
CCC1(C)C(O)C1CO,0.2787
CC12CN3C(CO1)C23,0.3182
C1CC(=O)C(=C1C=O)N,0.1516
OCC1C2COC=NC12,0.253
C#Cc1[nH]cc(n1)N,0.1777
CC12CC(CO1)C(=O)O2,0.275
CCC1=CC2OC1C2O,0.2402
c1nc(on1)C(F)(F)F,0.2626
COC(=O)C1OC1C,0.2654
CCC1(CC1C=O)C=O,0.21
OC1(CC1)C1(CN1)C=O,0.2186
COCCC1(CC1)CO,0.3242
N#CC1NCCCC=C1,0.2374
CN1CC2(C1)C(O)C2O,0.2567
CN=C1CC=CC(=O)O1,0.2016
CC(O)C1(COC1)C=O,0.219
OCC1(COC1=N)C#C,0.2685
CC12CN1CC1COC21,0.2913
CC1(CCC11CN1)C#N,0.2748
CC1CC(C2CO2)C1=O,0.2168
CC1C2NC2C1OC=N,0.2627
O=C1OC(C#N)C2CC12,0.2729
OC1C=CC2C3CC2C13,0.2427
CCC(C)(C)O,0.3259
CCN1C2CC(CO)C12,0.3021
C1CC23CCC2CC13,0.3382
C(=O)C(C=O)(C(=O)N)O,0.1947
c1cnc(c(c1O)N)N,0.2048
CC1OC11COC1C#C,0.2683
CCC(C)CCC#C,0.316
CCOCCCC1CO1,0.3403
CN1N=COC(=N)C1=N,0.1802
CC12CN1CC2C#N,0.2739
C1C(CN1CC#N)CO,0.2606
O=COC12CC1OCC2,0.2451
C#CC1=CCC(=O)N1,0.1836
C1OC2CC1CC1NC21,0.3085
CC1=C(O)OC=CC1=N,0.1904
CCC(C)NC(=O)C#C,0.232
CCC1OC2CCC2O1,0.3209
COC1CCCC(C)O1,0.3352
c1nc2n(n1)C(=O)CN2,0.201
COCC1NC1C1CO1,0.3126
C1C(=O)OC(=N1)C(=N)N,0.191
C[NH+](C)CC(N)C([O-])=O,0.2505
OC1C2CC3C(O)C1C23,0.2978
CC(=O)Oc1conn1,0.2214
CC1C=CCC1C1CC1,0.2637
CC(C)OC(C)C1CC1,0.3204
CC1OC=NCC1C#N,0.271
CC1(C)N=COC1C=O,0.2175
ON=C1CC=CCC1O,0.2435
c1nnc2n1c(n[nH]2)O,0.2155
CC1C2CC1C1C2N1C,0.3106
CC1OC2CC1(O)C2,0.3026
c1c(nnn1CC#N)N,0.2064
CCC1(CO)C(C)C1O,0.3139
COC(C)CC(=O)C#N,0.1796
CCC(=O)C1CC(=O)O1,0.2272
N=C1OC2C1OCC2=O,0.1978
O=CC12CCC1OCO2,0.2194
OC1C2C1C1OCC2O1,0.3257
COc1cncnc1F,0.2138
CC1OC(=O)C(C)C1=O,0.2112
N=C1CC2(CN2)C(=O)O1,0.2485
CC1CC(=O)CCCO1,0.2246
C1C2C3CCCC2C13,0.3701
COC12CC1OC2C#N,0.2524
COCc1c(n[nH]n1)N,0.2179
CC1(C)CC1(O)C1CC1,0.3227
COc1ccoc1OC,0.2211
NC1=C(NC=N1)OC=N,0.2056
CC1(C=CCCC=C1)C,0.2593
c1c[nH]c(c1O)N,0.2349
C#CC1CC11CCCC1,0.2848
CC1COC11CCC1O,0.2999
CC1CCC2OC12C,0.336
CC1(CCCO)CC1O,0.3291
CC12C3C4C3C1(O)CC24,0.3066
CC1NC(=O)C(=C1)C#C,0.1996
NC1=CC(=N)OCC=C1,0.1612
CC(O)C1=C(O)C=CO1,0.2201
OC1C=CC(=N)NC1=O,0.2079
CC1OC1C1CN1C=O,0.2607
CC12CC3CC1C2(O)C3,0.314
CNC(=N)C(=O)OC=N,0.1729
C1NC11CC2(CO2)C1,0.3063
C#Cc1c[nH]nc1CO,0.2243
Cc1c[nH]c(c1C)N,0.2471
C1CC2=CC3NC3C2O1,0.2302
CC1[NH2+]CC1(C)C([O-])=O,0.2764
OCC12CC3CC(C1)C23,0.3245
N=C1NCC(=O)OCO1,0.2305
c1nc2c(o1)[nH]c(=O)o2,0.2003
CC1(O)COC1CCO,0.3101
CCC1CC2(CO)CN12,0.2878
Cn1c(nc(n1)O)OC,0.2515
CCC(O)C1=CNC=N1,0.2502
CCC1OC1(C)C=O,0.2198
C(C1CO1)C1=NON=N1,0.2122
CC(C)C(CC#N)C#N,0.3408
c1(nc(on1)N(=O)=O)N,0.1553
CC1CC2OCCC2=C1,0.2535
CCCC1CC2(CC2)O1,0.3074
C#CCC#CC(=O)C#C,0.1894
CCc1cn[nH]c1C=O,0.194
CCC1(COC1)OC=N,0.279
OC12C3C=C4CN(C13)C24,0.1857
COC1CCC(C)=C1C,0.2538
COC1CN(C)C1CO,0.2928
COCC1OCC2OC12,0.3359
CC1=CC2CC3N2C13C,0.2192
c1cc(oc1C(=O)N)N,0.1846
C1C23CCC12OCCO3,0.3021
CCC(CC#C)C#C,0.2978
C#CC#CC1COCO1,0.2204
C1C(=O)CC12COC2,0.2167
CC(CC=O)OC(C)=N,0.2249
CC(O)(C=O)C#CC#C,0.1951
C#CCCN=C1CCO1,0.2727
c1c(c([nH]c1O)CO)N,0.2195
COCCC1CC=CC1,0.2649
OC12COC(C=C1)C=C2,0.2204
Cc1nc(on1)C(=O)C,0.191
C#CCc1cnco1,0.2436
CNc1cnccc1F,0.198
O=C1OCC11CC1C#C,0.2544
CC1C2OC2C1(C)C#N,0.3009
CC1C2C3CC1C23C,0.3318
CC1C2CN2C2CC12C,0.3024
CC1CCC2C3CC12C3,0.3422
CC1C2CC2(C)CC1=O,0.2227
O=C1CN=CNC1C#C,0.1999
CC12C3NC3C1CC2O,0.2932
C(=O)C#CC(=N)NC=O,0.1597
Cc1nnc2n1cc[nH]2,0.2147
CC1C2CCC1COC2,0.3238
CC1(CC1)CCN2CC2,0.3148
C1CC1(CO)NC(=O)N,0.2934
CC12CC(N)(C#N)C1N2,0.2859
CC1C2N3CC2(C=O)C13,0.1916
CC12CN(C1)C2C#N,0.2561
CCN1CC1CO,0.2819
CC1(CC1)C(O)CC#N,0.3127
CC#Cc1cn[nH]c1C,0.2205
CC1(CC#C)CCOC1,0.2971
COC1(CCOC1)C#C,0.2786
CC(CCC#N)C=O,0.2257
OCCCC1(CO)CN1,0.3114
CC1(C)C2C(O)CCN12,0.2811
N=C1OC2C3CCN3C12,0.2331
C#CC1CCC2CCC12,0.3112
OCC12CC1CCC2,0.3343
CN=C(C#C)OCC=O,0.2251
CC1CC2(C1)OC1CC21,0.3024
c1c(cc(nc1O)O)F,0.2213
CC1=CC2(C)C3CC1N23,0.218
C1C2N=COC3COC123,0.2372
CC1OCC(=O)CO1,0.206
CC1(O)C2OC3C2C13O,0.2821
O=CC12CCC(C1)OC2,0.2228
CC(O)C(O)C(C)=O,0.2318
N=C1NC(=CO1)C1CC1,0.2183
CC1C2C3C4C2CC1N34,0.3281
CCC1(OCC1O)C=O,0.2133
OC1CC(=N)OC1=O,0.2575
C#CC(=O)NC(=O)C#C,0.1939
COCCC12CC1CC2,0.3347
C(c1[nH]nc(n1)N)O,0.2329
CC1C2C3CN3C1C2=O,0.2246
Cn1c(=O)ncc(n1)F,0.1599
COC1C[NH2+]C1C([O-])=O,0.2611
OCC12CCC(=O)C1N2,0.2194
OC1CN=CN(C1)C=O,0.2237
OC1C2NC2C1CC=O,0.2239
Cc1ccc(cc1)C#C,0.1991
CCCC1(C)CNC1=O,0.2804
CC12CC(=O)N1C=NC2,0.2332
CN1C2CC2C1C(N)=O,0.2307
CC1CC2(CCC12)C=O,0.2196
CC(=O)C12CN1C=NC2,0.2204
c1cn2c([nH]1)nnn2,0.2275
NC1C2N=CNC12C#C,0.2217
CC1NC1(C#C)C1CN1,0.2667
CC1N2C3C4COC13C24,0.3156
COC1CN2CC2C1O,0.2934
CC1NC2CC2OC1=O,0.245
CC1(O)CCC2NC12,0.3117
CCC1C(C)C2OC12C,0.3254
c1c(coc1CO)C=O,0.1881
C1C=CC2C3OC12C=C3,0.2312
COC1(C=O)C(C)C1C,0.2175
CC1N=CN(C=N)C1=O,0.2259
c1c2c(n[nH]1)N=CNC2,0.2031
CCC(CC)C(C)C,0.3695
CCC1CC2C1OC2=O,0.2795
OC12CC3(O)C4C1N4C23,0.2853
Cc1c(nc(o1)C)OC,0.2091
CCC1OCCC1CO,0.3209
CC1CCC2(CN2)C1O,0.3103
CC1CCC2C(O)CC12,0.3132
COc1c[nH]cc1O,0.2407
CCOC(=O)C1CCC1,0.276
CCCN(C=O)C=O,0.2155
CN=C1NC2C(O)C12O,0.2448
CCC12CC(O1)C=C2,0.235
OC1CC11COC1=N,0.2799
CC1C(C)C1C1CC1O,0.3092
CC12CN1CCC2(C)O,0.2884
OCC1OCOC1CO,0.3358
OC1C2CCC3CN2C13,0.2696
OCC1=CC(O)CCC1,0.2522
c1conc1CCCO,0.2552
CC1(CO1)C(O)CC#N,0.3161
Cc1[nH]c(cc(=O)n1)O,0.2107
CC1CC1OCC=O,0.2241
CC12OC3C1C2(C)C3=O,0.2251
COCC(=O)NCC#C,0.2684
CCCC(=O)C1CCO1,0.2187
CC1CC2CC2C(=O)C1,0.2259
CC1C2N1CC=C2C#C,0.1929
CC1NC=CC(=O)C1C,0.1879
CC12OC3(CC1C23)C#N,0.251
CCC1COC(C=O)=N1,0.1854
c1nnnn1CCO,0.2663
CC1CCC(C)(C)OC1,0.3187
CC(C)CNCC#N,0.2697
COC1CC2OCC12O,0.3039
N=C1OCC2=NCCN12,0.2336
C1CN2C1C21CC2NC12,0.3034
CC1C2CC(CO)CC12,0.3291
CC(C)C12CC(C)C1O2,0.3259
CCC12C(C)C1OC2C,0.3011
CCOC1COC(=O)O1,0.3289
C#CCC1C2OC=NC12,0.2538
O=C1CC2C3CC12CO3,0.2256
OCC1C=CCC2NC12,0.2531
OC12C3CC1N(C=O)C23,0.2481
C1C2C3CCC(CO3)N12,0.3084
CC(C#N)C#CCC=O,0.2236
c1coc(=O)nc1N,0.2037
C1CC2(C1)CC=CC2=O,0.1898
CC(=O)C12CC3CN1C23,0.2224
NC1(CC2(CO2)C1)C#N,0.2926
CCC1CC1(OC)C=O,0.2175
O=CC1COCC2CN12,0.203
O=C1NC2COCC12,0.2759
CC1(O)C2C3CN3C12,0.2823
FC1=CON=C(F)C1=N,0.1807
c1c2c(cn[nH]2)on1,0.2148
O=C1OCC1C1CO1,0.2756
C1OC2CC11OC1C=C2,0.2332
CC#CCC1=CCOC1,0.2455
CC1COC2(C)CN1C2,0.2899
CCc1cc([nH]c1N)O,0.2364
CC1CC2(CO)C1N2C,0.3261
CC(C)OC1CC(C)C1,0.321
CCC(=O)C12CC(C1)C2,0.2219
C1C2C3CC22CCCC132,0.334
CC1C(C)C11OCC=C1,0.2229
CC1C2CC3(CC3)C12O,0.3044
CN=C1OC2C3CC2C13,0.2671
OC12CC3(O)C(C1)OC23,0.3039
CC(=O)C1C2C3CC2C13,0.2238
OCC12CC(CO1)C2=O,0.2065
CCC1(C)CC1CC=O,0.2245
COC1CC=CCC1C,0.2687
CN=C(C(=N)N)OC=O,0.2043
CC1(O)C2C3N2CC=C13,0.168
CC12CC1C1OCC2O1,0.3403
CC1C2COC1C2CO,0.3074
OCC1=NCC(O1)C#C,0.2707
CCC1(O)CC(O)C=C1,0.2523
CC1(CCC=C1C#C)C,0.2094
CC1OC11CC2COC12,0.2936
CNC1C(C#N)C1(C)O,0.2565
C1C=CC2COC=NC12,0.2562
c1c(cn(n1)CC#N)N,0.2112
Cn1c(ccn1)CO,0.2564
CCOCC1OC1C#C,0.2731
C#CC#CC1(CC1)C=O,0.2037
O=CC1CC=CC11CO1,0.2251
C1c2c(onn2)CC1=O,0.2077
O=C1NC23CN(C2)CC13,0.2473
CC12OC3C4OC1C4C23,0.2645
OC1CC2OC3C2C13O,0.2948
CC1(CC1)C(=O)NC,0.2786
CCC1C2OC(=O)C12,0.277
C1NC2=NC3CN(C3)C12,0.218
OCC1=NOC(=N)C=C1,0.167
CC1CC2CC2C=C1,0.2508
CC12CC(COCC1)O2,0.3204
CC1(O)C(O)C2CC12O,0.2925
OC1COC2C3OC1C23,0.2816
OC1=CC=NOC1=N,0.1752
CC1OCC2(CO2)C1C,0.3217
OCCCN1CC1C#C,0.2632
CCOC(C)CC1CC1,0.3341
CC(=N)OC1=CN=NO1,0.1793
O=CC12CN(C1)CCN2,0.1741
c1nc(nnn1)N,0.1683
CC12CC3C1OC(=O)C23,0.2658
CC(=NO)CC#C,0.2556
CCCN1CC1C(N)=O,0.2389
CN=C1OCC2(C)CC12,0.2683
O=C1NC2CC12C1CO1,0.2541
CC1(NC2COC12)C#N,0.2677
N#CC1C2CCC1N2C,0.2611
N=C1CNCCN1C=O,0.2097
CCc1c(n[nH]c1O)C,0.2516
CC12CC1C(=O)C=CN2,0.1851
Cc1ccc([nH]1)C(=O)N,0.196
COC1CCCC(=O)O1,0.2736
OC1C2CCC2OC1=O,0.2706
ON=C1CCC1CC=O,0.2253
C#CC(C#C)C#CC=O,0.203
CC1OC(OC1C)C#N,0.3023
CC1=CC2CC2C1(C)C,0.2455
CC(=O)NC1C(O)C1O,0.2504
C1NC1C1C2CCCN12,0.2857
CN=C1NCC(=O)N1C,0.235
CC1=CCC(=O)C1=O,0.1401
CC1=CC(CO)OC1=N,0.2168
CC1=C2CC3C(OC1)C23,0.2097
OC12CC3C1C3(C2)C#N,0.286
OC1CC23OC4C2NC134,0.2573
OC1C2CC1(O2)C#C,0.2523
CCOc1ccc([nH]1)N,0.2359
CC1CC1N1CC(=O)C1,0.1913
COC1C2OC2CC1=O,0.2046
CC1=CCOCC12CC2,0.2495
COC1C2CC1(N2)C#N,0.2647
NC(=O)C1NC(=O)C=C1,0.2082
C1C2CC3(CCO3)CC12,0.3168
c1c([nH]nc1O)CO,0.2374
CCC1COC2CCC12,0.315
CC(C)CC#CC(C)O,0.29
CCCC1(C)CCCO1,0.3179
ON=C1CNC2CNC12,0.224
CC(CC=O)(CC=O)O,0.2061
CCC#CCOC(=O)N,0.2867
CC(=O)C1C2CC1OC2,0.2217
CC12C(O)C1C(O)C2=O,0.2133
CC12COC(C1)C1OC21,0.3279
C#CC1=CC(=O)NC1=O,0.167
CC12NC1C1OC21C=O,0.1874
COCC(C)OC(C)C,0.3272
CC1(C)OC(=N)CC=C1,0.257
Cc1c(nco1)OC,0.2118
CNC1(C#N)C2CNC12,0.2576
CC#CC1C2CN1C2C,0.2574
CCC12CC3C4C(C14)N23,0.3047
CC1(O)C(C=O)C1C#N,0.2194
CC(C)(C)c1ccn[nH]1,0.2591
CCn1c(c(nn1)C)N,0.2292
ON=C1CC2COC12,0.2369
C1C2N1CC1=C2ON=C1,0.2174
CCC1CC2(O)CC12,0.3282
CC12OCOC1C2C#C,0.2716
CC1(O)CC(CO)C=C1,0.2595
CC12CC3C4CC(C14)C23,0.343
CC1(OCC1C=O)C#C,0.2237
CC12CC3C(O)C(C1)C23,0.3162
CC(O)C1C(C)CC1C,0.3183
OCC1=CC2(CO2)CC1,0.2473
CCOCC1CC(O)C1,0.3266
C1CC1(C#N)C2COC2,0.2796
C#CCc1ccccn1,0.2274
CCC1C2C1C(O)C2C,0.3125
OC1C2OCC2C11CN1,0.2922
C1CC1OC1CC2NC12,0.3015
CCN(C=N)C=O,0.2232
C1CC1C1C2C3CC3N12,0.274
Cc1c([nH]cn1)C2CC2,0.2344
O=CC12CC(C1)OCC2,0.2169
CC1=NC=C(O)C(=N)N1,0.1768
NC1=C(N)C(=O)NN=N1,0.1574
OC1CC2(O)CC2C1O,0.3026
Cc1nc(co1)C2CC2,0.2361
N=C1NC(=N)C2(CC2)O1,0.2493
OCC(=O)C(O)CC=O,0.2046
c1c(nc(o1)C(=N)N)N,0.1784
ON=C1C2CC1(C2)C=O,0.207
c1nnnn1CCCO,0.2667
COc1[nH]ccn1,0.2522
CC(O)C1C(C)OC1=O,0.2806
CCOC1CN2CCC12,0.2785
CC1(C)CN2CC2CO1,0.2995
N#CCC1OCC2OC12,0.311
COC1C2N(C)CC12O,0.2663
CC1(CC1)OC(=O)C#C,0.2318
COCC1C2C3CC1C23,0.3375
CC(CO)(CO)OC=O,0.2816
CCCN1CCNC1=O,0.2932
C(CC#N)COCC#N,0.2968
N=C1ON=NC(=O)O1,0.1744
O=CC1NCC11CO1,0.211
CC1COC2=NON=C12,0.2216
CC1OCCC=C1C#C,0.2118
CC#CC1=CC2CN2C1,0.1906
CC1CCOC2CC1C2,0.3164
CC#CC(C)C#C,0.2883
CCC1C=CC2CC1C2,0.2506
CC(O)CC1(O)COC1,0.3053
O=C1C2CC2CN2CC12,0.2103
CC12NC3C1OC(=N)C23,0.256
NC(=[NH2+])O[C-](C#N)C#N,0.166
C(C(=N)NC(=N)CO)O,0.2359
CC(=O)N(C=O)C(=O)N,0.2253
Cn1cc(nn1)N(C)C,0.2004
CC12CC1(O)C1OCC21,0.2969
c1c2c([nH]c1O)nn[nH]2,0.2026
CCOCc1cnno1,0.2326
O=C1OCCNC1C#C,0.232
CC1(CO1)C(=N)OC=O,0.2534
CN=COCC1(C)CN1,0.2515
O=CC1=NC2C3CN1C23,0.1668
C1OC1C1CO1,0.3373
N#CC12CN1C1CNC21,0.2416
c1c(nc(o1)N)C=O,0.176
COC1CC2(CO)OC12,0.3187
c1nc(=O)ncn1C=O,0.1819
Cc1c[nH]c(c1N)C#C,0.1893
C1COCC2(CC2)C=C1,0.249
COCCC(C=O)C#N,0.2163
OCC1=NNC(=N)C=C1,0.1581
CC1C2OC(C1O)C2=O,0.2298
OCC12CC1C(O)CO2,0.2978
CC1CCNC(=O)CO1,0.2546
CC1OC(CO)C1C#N,0.2786
CC1(O)CC(=O)CC1=O,0.1992
CC12CC3C=CC1C23O,0.2351
CCC1C(O)C1C(N)=O,0.2483
CC(O)C#CC1CN1C,0.251
OC1COCC11COC1,0.3074
CC1=CC2CC1C(=N)O2,0.2366
CC(C)NC(=N)C(=O)N,0.2011
Cn1cc(c(n1)O)CO,0.2402
COC12CC3C1C3(O)C2,0.3164
CC(O)C12CC3CN1C23,0.3084
CC1NC1(CO)CO,0.3188
CCCC1C2C3C1CN23,0.3163
O=C1NC=C2C3CN3C12,0.192
N=C(C=O)N1CC1,0.1874
CN=CNc1ncon1,0.2135
COC1(C)CNCC1=O,0.1877
O=C1NC=C2COC12,0.1907
N#CC12OC1C1NC21,0.2342
CCC1C(C#N)N1C,0.2603
CC12NC3C(C1=O)C23O,0.2275
CC1C2CCC1(O2)C#C,0.2688
CCC(=O)C(C)(C)O,0.2308
NC(=O)N1CC1CO,0.2751
N=C1NC2COC12C=O,0.2036
C1CC12COC(=O)CN2,0.2447
CC(=NO)C1CC2NC12,0.2429
OC1C2COC1OC2,0.3288
c1c2c([nH]c1O)nco2,0.1948
COC12CC3C1OC23,0.3054
OC(C=O)C1CO1,0.231
CCC(C)C(C=O)C=O,0.1949
CC1C2CC(C)C(O)C12,0.3143
CC1OC2C3OC1C23,0.2873
CNc1c(nn[nH]1)CO,0.2237
OC12COC3C=CC1C23,0.2304
C#Cc1cc[nH]c(=O)c1,0.1615
CCC(C=O)C(F)(F)F,0.2262
CC(C)(CC#CC#N)O,0.2394
COC1(CC1)CC#C,0.2986
Cc1nc(on1)C,0.2623
OC1CCC(C=O)=C1,0.1914
CCCCC(=O)NC=N,0.2428
O=CCC1NC1C1CC1,0.2193
C1OC11C2NC3C2NC13,0.2823
N#CC12CC1CCOC2,0.2978
CC(CC=O)OC(C)=O,0.2256
CCCC1CC(C)CO1,0.3218
CCC#CC#CCO,0.2142
CNc1conc1OC,0.215
CCC12OC1C1NC21,0.2791
CC(C)(C#CCCO)O,0.2947
Cn1cc(nn1)OC=O,0.2371
O=CC1C2C3C2C(=O)N13,0.2046
COCC1C2C(C)CN12,0.2993
CCc1c(nc[nH]1)OC,0.2198
C1C2CCCN=COC12,0.2604
CC1CCNC(=O)N1,0.2941
C[NH2+]CC(=N[O-])C(C)O,0.1523
OCC1(O)CCC1O,0.3093
CC12C3C1C1=CC2OC31,0.1946
CC12CC3COC1CC23,0.3203
Cn1ccnc1CO,0.237
Cc1conc(c1=O)O,0.19
CC1=C2C3C(C1)C3C2O,0.1746
OC1CC11C(O)CC1O,0.309
OC1C(COC1=N)C#N,0.285
O=C1CC2CNC(=O)C12,0.2137
CC12C3CN1CC3C2=O,0.22
C1CC12C=CNC(=O)N2,0.2123
CC#CCC#CCO,0.2744
NC1(C#N)C2CCC1O2,0.292
CCC1CC(C)CC=C1,0.2643
c1c(oc(=O)[nH]1)CC#N,0.2367
CNC(=O)C1(CC1)OC,0.2695
CN1N=NC(N)=CC1=O,0.1759
CC1C2CN1C2C1CN1,0.3081
COCCC(O)C(C)O,0.3044
N=C1OCCC11CCC1,0.2805
NC=[NH+]C1=N[N-]C(=N)O1,0.0821
N=COC1=COC(=N)O1,0.2139
OCC1OCC(O1)C#N,0.2727
CC1OC2C(O)C12C#C,0.2617
CN(C)c1cc(c[nH]1)N,0.2175
CC1CCOCC(C)O1,0.324
NC12CC1OCOC2=O,0.2329
N=C1NC=NC2CC2O1,0.2292
CC1COCC2CC2C1,0.3257
CN=CNC(=O)C=O,0.1668
CC#CC#CC(=O)C,0.1802
COC1C(C)C1CC=O,0.2255
CNc1cc(n[nH]1)OC,0.2404
c1c(onc1N)CCO,0.2338
CC(C)C(CO)CCO,0.3253
CC(CC1CN1C)C#N,0.2699
C1CC2C3OC3CC2=C1,0.2548
CC12CC1C(O2)C1CC1,0.3143
CC1C(O)C2=NC=NN12,0.2652
OC12CC1C(=O)CC2=O,0.2131
C1C2OC3COCC3C12,0.313
CC1CN2CC(=O)C12C,0.2027
COC1C2C3CN3C12C,0.2816
NC1C=CC(=O)NC1=O,0.1937
CN1C2COC2(C)C1=O,0.2521
OC1COCC1OC=N,0.2704
N=C1OC2C3C=CN1C23,0.217
CC12N=COC1C1CC21,0.2672
CC1C2N1C(C)CC2=O,0.2129
CCC1N2CC2C1(C)C,0.3065
O=C1OCC2C(C#N)C12,0.2653
O=C1C2C3CC1CCN23,0.2114
N#CCCC12CN1CC2,0.2799
c1c(coc(=O)c1F)F,0.1693
O1C2C3OC4C1C2C34,0.2593
CCC12CC(O1)C=C2C,0.2346
CC1CN2CC12C1CO1,0.3074
CC1(O)C2OC3CC3C12,0.3069
C#CC1COC1C1CC1,0.2897
CCC(CO)C(C)OC,0.3185
NC1COC1(C#C)C#N,0.2361
CC(O)C(C)C(C)O,0.321
CC1=C(C)CC(C1)C#N,0.2545
O=C1C2CC1C1OCC21,0.23
CC(O)C1NC1CC=O,0.2218
C(CO)C(=O)C#CC=O,0.1963
OCC1OC(=O)C11CO1,0.2528
CC12COC(CO1)C=C2,0.2449
CCC(C)OCC1CO1,0.331
CC(C#N)C(=O)C1CO1,0.2178
CC1(O)C2C3CC1(O)C23,0.317
CC(C#C)N1C=NC=N1,0.2712
CN(C=O)C(=O)CO,0.231
Cc1ncc(c(=O)o1)N,0.1679
COC1C(C)N(C)C1=O,0.2562
O=CC1(CCC=C1)C#C,0.2162
COC1C2OC3(CC3)C12,0.2948
NC1=NNC(=N)C(F)=N1,0.1399
CC1COC(C)=NC1C,0.2679
CC1(CC=O)OCC=C1,0.2178
C1=C(C(=O)NC1=O)N,0.1687
CC1OC2(CC2O)C1O,0.2943
N=C1OC2C1COC2=N,0.2642
CC1C2OC2(CO)C1=O,0.2097
CC1C2C1C1=NC=NN21,0.2395
N=C1ON=COC1=O,0.2028
O=COCC1CC(=O)O1,0.278
OCC12CN3C1C(=O)C23,0.2316
CC(O)C1(CC1)OC=N,0.2757
C(#N)c1c(nc([nH]1)N)O,0.1993
CC12OC1C(O)C1OC21,0.2998
Cn1c(c(cn1)N)C#N,0.1871
CC(C=O)C(C)=O,0.2013
CCC1C2C3N1CC23C,0.3019
CCOCC(O)C(C)=O,0.2298
CC1CC(O)CN1C=O,0.2652
CCOC1(C)CN=CO1,0.2789
CC1(CO)C2OC1C2O,0.2888
CC1C2CCC(O)C12,0.322
CCN1C=C(CC1=O)C,0.2036
CCc1c(c[nH]c1N)O,0.2325
COC12CC3C(C1)C3O2,0.3231
C1OC1C1=CN=NO1,0.2241
NC(=O)C1NC1C(N)=O,0.2344
CC1=CNC(=O)C12CC2,0.2019
CC1(C)C2C3CC=C1C23,0.1786
C1CNc2c1onn2,0.1765
CC1(O)C2CC3(CC3)C12,0.3146
OC1CC(=CC1O)C#N,0.2188
CC1=CC2CC3C1CN23,0.2273
CCC1(CO)CC1C=O,0.2272
CC(O)CC1OC1CO,0.3187
CN=CN(C)C(=O)C#N,0.1943
C(c1c(nn[nH]1)O)O,0.2242
CC1=C(CNC(=O)C1)C,0.2548
N=C1C2OC3C=CN1C23,0.2073
CC1CC=CC(O)C1,0.2582
O=CC12CC(C1)CCO2,0.2141
CCc1c(cc[nH]1)O,0.2274
CC(C)C12C3CC1CC23,0.3166
O=C1OCC2CCC1N2,0.2596
NC1CC2CC2OC1=O,0.2553
COC1C(O)C=CC1=O,0.1784
C1CC2OCOC3C1C23,0.2992
CC12C=CCN1CC2O,0.2371
Cc1cnoc(=O)n1,0.1701
CCC1COC(C)OC1,0.3291
C1CN(CCC1O)C=O,0.271
O=COC1C2COCC12,0.2588
C(#N)C(C#N)O,0.3
Cc1ccnc(n1)C#C,0.2016
CC#CC1C=CCC1O,0.2629
CCC1OCOC1C=O,0.2166
CC(C=O)C1COC1,0.2196
CC1(O)CC2NC2C1=O,0.2099
c1cc(ncc1N)CO,0.1932
CCC(C)C(N)C#N,0.2849
COC1C=C(C)CC1C,0.2552
OC1(CC1C1CC1)C#N,0.2846
CC1CCC11CC(=O)O1,0.2854
CN=C1N=CNC=C1N,0.1778
CCC1CC1C1COC1,0.3242
c1c(cncn1)C2CC2,0.2091
CCC1(CO1)C(C)OC,0.3377
CC12CC1CCOC2=N,0.274
CC1NC1C1=NC=CO1,0.2332
CC12CC(C1N2)C(N)=O,0.2672
CN1CCC(O)CC1=O,0.2653
C1CC1N=COC=O,0.2272
CC1OC(C)C2CCC12,0.3235
OC1CCCCC(O)C1,0.326
N=C1OC=C(CC#N)O1,0.235
OC1CCC2(O)CCC12,0.3153
CC(C)(C1CC1)NC=O,0.277
N=COC1OC2CC1C2,0.2829
CCC(=O)C#CCC=O,0.2053
COC1=NC=CC(=N)N1,0.186
CC(=O)C1(CN1)C1CN1,0.2147
COCC12OC1CC2=O,0.2175
CCC(C)(OC)C(C)=O,0.2285
c1nnn(n1)CCC=O,0.2239
CCCC1OC2CC2O1,0.3378
CC(C)C1C2CCC12,0.3325
CC(O)C(C)C(O)C#C,0.2699
CC12CCOC1(C)C2O,0.2827
OC1C2C3OC4C3C1C24,0.3072
CC(C)C(CC=O)C#N,0.2251
C1C2COC3=CN=C1N23,0.1689
OCC12OC1CC21CO1,0.3175
c1nc2c(o1)C(=NC2)N,0.1975
CC(O)(C#C)C1(C)CN1,0.2712
C(CC(=O)CCO)C#N,0.2356
CC(C#C)C1OCCO1,0.3041
COC(C=O)C1CO1,0.2152
O=C1COC2CNC2=C1,0.1919
CC12CCC1(CC#C)N2,0.2692
O=C1CC(NC=C1)C#C,0.1895
CC1OCC11CCC1=O,0.2109
CCC1C2OC1C2=O,0.2459
COC1C(C)C1(C)C,0.3152
CC(C#C)C1CC1(C)C,0.3097
Cc1c[nH]c(n1)C(=O)N,0.2055
OCC1C2C3C=CC2C13,0.2261
CN1CC11COC11CC1,0.2952
NC1C(=O)OC11CC1,0.256
CC12CC(O)(C1)C1CN21,0.2997
c1c(n[nH]n1)NCC#N,0.2202
NC1C(COC1=O)C#C,0.2482
N=C(NCC1CO1)C#N,0.2116
CCC1OC(C)(C)C1C,0.3134
O=C1CCC2(CO2)CO1,0.2756
N#CC1CC1C1CCC1,0.3118
O=CC12C3CC1COC23,0.2185
CCC(CO)C(=O)CO,0.2361
COC(=O)C(C)(N)CO,0.2514
CC1C2C=CC3(CN3)C12,0.2212
COCC1CCCC1,0.3356
C#CCc1cc(no1)N,0.2324
CCCCC(=O)C1CC1,0.234
OC1C2CC1C2C#C,0.2986
C1OC23CC4C(OC24)C13,0.2844
CN1C(=O)C2C3CC12C3,0.2485
C1C2OC11C=CCOC21,0.2296
CC12CC1C1OC1C2O,0.3157
CC1CC2(CO)CC1O2,0.3321
CC1CC2OC12C,0.3325
CC1C(O)C1CNC=O,0.283
CC(=O)C(O)CCC=O,0.2124
CC1=C(C(=O)NC1)C#C,0.1983
CC1C2C3C1CC23C,0.3357
O=CNC(C#N)C1CC1,0.2758
CC1(CO)COC(=N)O1,0.308
CC1OC(=O)C1(C)CO,0.2767
C#CC(=O)N1CC1,0.2164
CC(=NC)OC(=O)C#N,0.2098
Cc1coc(nc1=O)N,0.2135
CCC1OCC(C)O1,0.3394
CC1(NC1CC#C)C#C,0.2709
CC#CC1COC=N1,0.2678
Cc1ccnoc1=O,0.1843
CC1NC1C(=O)C(C)=O,0.1803
CCN1C2C1C1OCC21,0.2814
CC1(C(=O)C=CC1=O)C,0.1524
COC1C(O)C2NC12C,0.2966
CCC(C=O)C(C)(C)O,0.2204
c1c(c(no1)C=O)C=O,0.186
O=CC1(CC#C)CCO1,0.2093
OCC1CC1CC1CC1,0.3346
CC1(O)CC1C1COC1,0.3114
CC1=COC=C(F)C1=N,0.1936
O=COC1C=CC2NC12,0.2255
CCC1C2COC1C2O,0.2973
O=C1OC2C3CC(O1)C23,0.3141
COCC1(C)OCC=C1,0.2508
O=C1C2CN2CC11CN1,0.2088
CCCCC(O)CCO,0.3286
C1C2COCCCN12,0.3119
CC1NC(C#N)C11CC1,0.2638
C1OC1C1=CCCCC1,0.2462
C#CC1=CNCCC1=O,0.1679
CC1N=COC1(C)CO,0.2678
C1C2C3CC=C4C1C2C34,0.1851
c1c(cnnc1F)N,0.1964
CC1OC1CC#N,0.3121
CC(CNCC#N)C#N,0.2752
CC1C2CN1C1CC1O2,0.2959
C#CCOC1(CC1)C=O,0.2192
O=C1CC2OC(=O)NC12,0.1974
C1CC12C=CCC2=O,0.2221
CC(=O)CCCCO,0.2346
COC1OCC(C)C1=O,0.2132
OCC1CC11CC(=O)C1,0.2215
CC(C)C1=NCC(=O)N1,0.2334
CCN1C(=N)CCC1=O,0.2463
O=C1CC2NCC12C#N,0.2063
c1[nH]ncn1,0.2764
C#CC1=CCC=CC=C1,0.1804
CC1C(O)C1C1CCO1,0.2842
CC1CC2COC2=N1,0.2664
CCNC(=O)C(=O)OC,0.2063
CC1=CC2CC3C(C2)C13,0.2468
CC12C3CCC(C1O)N23,0.2934
c1c[nH]cc1OCC=O,0.1735
CC1C(C)C1(O)C1CC1,0.3008
CC(=O)Cc1ccon1,0.2183
OC12C=CC3C4C3C1C24,0.235
OC1C2C3NC3C(O)C12,0.292
CC1CC2CC3(CC3)C12,0.3308
N#CCOC12CC(C1)C2,0.2877
OC12CC1COC2C#N,0.2899
C(C(=O)C#N)O,0.2122
CCC1CC1C1CN1C,0.3013
CCC1(CC1C)C1CC1,0.3447
OCC1C2CC1C2C#C,0.2981
CC1C(O)CCOC1=O,0.2724
CCC1(CC(=O)N1)C=O,0.2155
CCC1OC(=O)N2CC12,0.2888
Cn1cc(nc1O)C=O,0.192
CC1(C)C2CC1OC2,0.3217
CC1CC1(C#N)C1CC1,0.3086
CCOC1CC1O,0.3016
CCC1(C)CC1C#C,0.2881
OC1CC2OC2(C1)C=O,0.2199
CC1(COC1)OC=NC,0.27
COC1CC(CC=O)C1,0.2238
CCN(C=O)C(C)(C)C,0.2695
CC1C2C3C(C2=O)C13O,0.2426
CN=C1CC2CC2(C)O1,0.265
N#CCCCCC1CO1,0.309
C1OC11C2C3CC1N23,0.3163
CC12CC1(O)CO2,0.2989
O=C1OC23CN(C2)C13,0.2184
CCC12CC1C(C2)=NO,0.2448
CC(C)(O)C1NC1(C)C,0.3104
CCOC1C2C3CC2C13,0.3378
CC(O)(CC=O)CC#C,0.2232
c1cc(c(nc1)CO)N,0.1925
O=C1COC(=O)C2CC12,0.2218
CN1CC2OCC(O)C12,0.2968
CC12CCCC=C1CO2,0.2536
CC(C)N1CC1,0.3196
OCC1=CC(O)C(O)C1,0.2549
CC1(CC1)C(C)(C)C#C,0.3178
C(CNC(=O)CO)C#N,0.2714
N#CC12CC(C1)CO2,0.2772
CC12CC1CC2CC#N,0.2999
CC1CC=CC(C)O1,0.2651
COC1C2OC2CC1O,0.3187
OC1C2C3OC1(C#N)C23,0.2536
CN=CN1C=NC2CC12,0.2021
CC1(OCC1CO)C#C,0.2801
O=C1NC2CC1C21CN1,0.2528
OC(CC#CC#N)C=O,0.2193
OC12CC1N=COC2,0.2481
CC1C2COC(=O)C12,0.2716
CC1C2C3CC(C3)C12C,0.3264
CC1CC(CCO1)C#N,0.2915
Cn1cccc1N(C)C,0.233
CC1CN2C3CC2C13O,0.2922
CC12CC=CC1C1NC21,0.2562
CCc1c([nH]cn1)C#C,0.2049
C1C2OC22COC3C1C23,0.3118
C1OCC2N=COCC12,0.2643
c1(n[nH]nn1)O,0.2378
O=CC1C=CCCC=C1,0.1993
c1conn1,0.2422
ON=C1C2CCC1N2,0.2489
C(C#N)c1nc(on1)N,0.2449
COc1c([nH]cn1)O,0.2173
CCc1cc(=O)nc[nH]1,0.2055
CC#CC1(C)CC1(C)C,0.2835
C1OC2CN=CN3C1C23,0.2398
COC1C=CC2CCC12,0.2579
CC#CC1(CCCC1)C,0.302
CNC(=O)OCCOC,0.3151
C1C2CC11CCOC21,0.3384
C#CCOC12CC(C1)C2,0.288
C(C#CCOCC#N)O,0.2616
CC1(OC11COC1)C#C,0.2704
CC(C1CN1)C(N)=O,0.2657
CCC12CC1(CC2)C#C,0.265
N#CC12CNC1=NCC2,0.2464
CC1OCCC11COC1,0.3138
COCC1CCC1C#C,0.2972
NC(=O)C1(CN1)C=O,0.2203
CCC1CC(O)(C1)C#C,0.2875
CCCCC#CCC#C,0.2874
CC12CC1CC(=O)C2=O,0.1495
CCC12C(C)C1C1NC21,0.2735
CC(C#N)C(O)C=O,0.2342
COCC12CC1COC2,0.3301
O=CC1C2CNC(=O)C12,0.2035
OCC1C2NC2C1=O,0.2141
CC1=CC(O)C2CC12C,0.2396
CCCC1CC(CO)O1,0.3187
OC1C2C=CCC12C#C,0.2279
COC1=NCCC(=O)N1,0.2426
C#Cc1c(c([nH]n1)N)N,0.2056
CCC1CCC(=N)O1,0.2852
O=CC1=C2NC3C(C1)C23,0.1426
CC1(OCCO1)C#N,0.312
OC12CC1(CC#C)OC2,0.2625
COC(=O)C1CC1C,0.2798
CC1COC1,0.3233
Cc1cc(oc1)CCO,0.2354
CCC1CC(C)C2CC12,0.3428
CC(=O)CC#CCO,0.2282
COC1CC(=O)CC=C1,0.2265
CC(CC(C)C#N)C#N,0.3374
CC1C(=O)NC1(C)C,0.2789
CNCc1ncco1,0.2315
CC1(CO)NC1C(N)=O,0.2583
N#CCC1CC2CC2O1,0.2885
CC(C)(c1c[nH]cn1)O,0.2522
CCn1c(c(nn1)O)N,0.22
CC1C(=O)OC11CC1O,0.2813
CNC(=O)C1C(C)C1O,0.2494
CC1COC23CN(C2)C13,0.2903
C1CC2C3NC3C=C2C1,0.2376
CC1OC2(CC12)C(C)=O,0.2179
CN(C)Cc1conn1,0.1919
COC(C)C1(C)CC1,0.3316
COCC(C)(OC)C=O,0.2137
CNc1c([nH]nc1N)N,0.2407
CC1(O)CCC1(C)O,0.3085
OCC(C#N)C(F)(F)F,0.3131
CN=C1OC(=O)N2CC12,0.2503
C1C2OCCC3COC123,0.2943
CC(=O)N1CC1C1CO1,0.2533
CC(=O)C#CC1CN1,0.2012
CC(C)N1C2CC1C2O,0.2706
CCC#CC(C)CC#C,0.289
CC1N(CC1=O)C(C)=O,0.2098
CC1=CC=C(F)C(=N)O1,0.1675
CC(C)C1=NCCO1,0.2708
OC1CCNCC(=O)C1,0.2117
CC1=CC2(O)CC1C2=O,0.2324
CC1CCCCC11CO1,0.3323
Cc1ccoc1OC,0.2289
CC#Cc1cncnc1,0.1983
C12C3C4C5C(C1N25)N34,0.2604
N=C1OCC2NC2CO1,0.2857
CC12OC1CC21CN1,0.3091
CC12CC1C1C(O)C1O2,0.3046
O=C1NCC=CC2CC12,0.232
CN(C)c1c(non1)N,0.2064
OCC(C#N)C#CC=O,0.2017
CN1CC=CC(=O)C1=O,0.1656
COC12C3C4C3C1(C)C24,0.2991
CC(C)C12CCC1CC2,0.3306
COC1=CNC(=N)O1,0.2275
OC1CC2(CO2)C11CC1,0.3189
OC(C#N)C1C2CCN12,0.252
OC1C2CCC1(N2)C#N,0.2652
CCC(C)(O)C(=O)C#C,0.1882
CC#CCC([NH3+])C([O-])=O,0.2666
Cc1ccc(n1C=O)O,0.1539
CC1=CC2C(C=O)N2C1,0.1941
OC1C2C=CCN2C1=N,0.2329
CC12CC1CCOC2=O,0.2654
OCC1OC11C2CC1N2,0.3115
Cc1ccn(n1)CCO,0.2565
CN1CC2OC2(C1)C=O,0.1789
CC1CC2C1C=CC2=O,0.1885
CC(=O)C12CC(N1)C2=O,0.2131
CC(C)(C)C(O)C=O,0.2321
CC1C2C1C1(CN1)C2=O,0.2167
CNC(=O)NC(C)C#C,0.2863
CCCOC(C)CC=O,0.2232
CC1(O)CC1(O)CC#N,0.2942
CCC1=C(C)C2CC2C1,0.2404
CC12CC3CC1C23C=O,0.2191
CC1CC1(C)N1CC1,0.309
CCC(C)CC#N,0.3493
[NH3+]C(CO)C([O-])=O,0.2719
C(C#CCOC=O)C#N,0.2735
c1c(=O)c(non1)N,0.1633
CC(N(C)C)C(=O)CO,0.1966
c1c(cnc(n1)O)N,0.1751
CC(C)C12C3CC1OC23,0.3054
CCN1C2C3C1CC23C,0.2936
CC(=O)C1OCC1CO,0.2182
COCC1OC(C)C1=O,0.222
CCNc1c(cc[nH]1)C,0.2329
CC(=O)CC(O)C1CC1,0.2297
OC1C=CC2C3CC1N23,0.2261
CCC1CN(C)C(=O)O1,0.3017
CC1C(=O)OC1(C)C#N,0.2786
CC1C(C)(O)C1(N)C#N,0.2686
c1c(non1)OC2CC2,0.2264
C(C=O)NC(=O)C(=N)N,0.2108
OCCC1OC(=O)C1O,0.2623
C1CC2(CC3CC2C3)O1,0.3241
OC1C2C=CC1N2C=O,0.2295
c1c(n2cnnc2[nH]1)N,0.2133
CN1C2CNC2=CC1=O,0.2078
COC1=NN(C)C(=N)N1,0.2331
NC1C=CCOC1=O,0.2412
CC1CC2C1C2(O)CO,0.3005
c1cc(oc1)CCC#N,0.2328
OCCCC1C(O)C1O,0.2819
CC(O)C1CC=CC1C,0.2642
CC1C(C#N)N1C=O,0.2536
CC1C2COC(=O)CC12,0.2746
O=CC1CCC=CC=C1,0.184
CC(N)C(OC=N)C#N,0.2645
CC1(CCC1C=O)C=O,0.2178
COC1C2CCC12C=O,0.2229
C1C(=NO)CO1,0.2452
c1c(nc([nH]1)O)CC=O,0.1962
Cc1n[nH]c(=O)n1C=O,0.198
CC12NC1C(=O)C=C2N,0.1917
CC#CC1CC1(C)C=O,0.2073
ON=C(CC1CO1)C#C,0.2051
OC1(CC1)C12CN(C1)C2,0.2874
COC1(C=O)C2COC12,0.2052
OC1CC23CC(C2O)C13,0.2948
CCC1C2CCCC12C,0.3268
CCCOC(=O)C#CC,0.2341
CCC1C(CO)C1(C)C,0.3133
CC12C3C1C1CC3C21C,0.3181
C1CC1NCC(=O)C#N,0.1425
OC1COC(=N)C(=O)C1,0.192
OC1C2CN3C2C13C#N,0.2748
CC1C2C(C)CC12O,0.321
CCC(O)C1CC1C#N,0.3049
CC1(C)C2OC1C21CN1,0.3124
CC12CC(O1)C21CCC1,0.3106
CC12COC(CO1)C2,0.3246
CCC1CCC(N1)C#N,0.2733
CC1C2C3C(O)C2C13O,0.3079
OC1CCC=C1C1CC1,0.2441
C1CN(CC1=O)C(=O)N,0.2101
c1[nH]c2c(n1)nc([nH]2)N,0.2159
CCCOCC(=O)C=O,0.1562
C1OC2C3OCC=C1C23,0.2072
CC(C)C1CC1N1CC1,0.3174
CC1C2N1CC(O)C2=O,0.2046
CC1OC2C3NC2C13C,0.3042
Cc1c(=O)cc([nH]n1)N,0.1916
OC12C3CC1C(=O)C23O,0.2344
O=CC12CC3C(CC1)N23,0.2169
CC1C(O)CCC11CC1,0.3293
CC12CC1C(O)C=C2,0.2398
CC1=NCC(=N)N1C=N,0.2166
OC1(CNC(=O)C1)C#C,0.2652
CC1CC2CC3C2C13O,0.314
CC1OC11COC1,0.3221
CC1(O)CCC1CO,0.3252
CC(=O)C1CC(O1)C#N,0.2207
CC(C)C1OCC1CO,0.307
CC1C(O)C(=O)NC1=N,0.2469
CC(=O)OCC#CC#N,0.2306
C1CC1C12C3C4C1N4C23,0.2756
Cc1c(onn1)N=CN,0.1775
CC(=O)C1CCNC1=O,0.2326
CC1CC2CC1CCC2,0.3575
C1C2C1C13COC1C2O3,0.309
COC1C2NC2C11CC1,0.3004
CCCC1=C(COC1)C,0.2465
CCC1C(C2CO2)N1C,0.2942
CC1(C=O)C2C3CC3C12,0.2032
CC1C(CC#N)NC1=O,0.2773
O=C1NCC23CCC12O3,0.2532
CC1C2C3CN2C3C1=O,0.2146
CC#CC1(CC1)OC=N,0.2635
OCC(CN1CC1)C=O,0.211
CC12CC1N1N=CN=C21,0.2381
COC12CC(C1)C(=O)C2,0.2297
CC12C3C4C(CC=C14)N23,0.1614
C1CN1c2c(n[nH]n2)O,0.2235
CC(C)C(O)(CO)C=O,0.2089
OC1CC1C1=NNN=N1,0.2065
N=COC1CNC1C#C,0.2567
CCc1cncnc1F,0.2276
C#CC(=O)c1cnno1,0.185
CCC(=O)NC(=N)OC,0.2477
COC1CC2OC(=N)C12,0.2811
COC1(CC1(C)C)C=O,0.2174
CC1CC(O)C=C1C=O,0.1903
CC1C2C(=O)CC12C=O,0.2065
CC1C(C)C2(CC2)C1O,0.3136
O=CC(=O)C12CN(C1)C2,0.1257
CC(C)OC1COC1=N,0.2713
Cc1ncc(o1)C(=O)N,0.211
CC1C2C(C)C1C21CO1,0.3455
CC1CC1(O)C#CCO,0.2634
C1COCCC1(C#N)O,0.2785
CC12CC3C1CCC23C,0.3533
Cc1c([nH]ccc1=O)C,0.2007
CN=C1NN=NC(F)=C1,0.1544
CC12CC1C1(CC1)O2,0.3046
CCC(O)C(=O)CC=O,0.2075
C1CC2C3C=CCC23O1,0.2375
CC(=O)C#C,0.2079
NC(CCC#C)C#N,0.2872
NC(=[NH2+])C1=CNC(=O)[N-]1,0.11
CC12OC3C=CC1OC23,0.2292
CCC(C=O)(C#C)C#C,0.2155
NC(C#C)C(N)=O,0.2595
COC(C)C1OCC1=O,0.2268
COC1(CO)CC1C#C,0.2802
CCC(O)C#CC(C)O,0.2869
CC1(CCC2CC12)C#N,0.3273
CC1C(=O)C2CC1(C)C2,0.2261
CC1(C=CC2CC12)C#C,0.2442
CC(CC(O)C#N)C#C,0.2849
OC1C2CN=C3OC1C23,0.2163
c1c2c(c([nH]1)N)CC=C2,0.1936
CC(O)C1=C(C)NC=C1,0.2349
c1cc-2cnn[nH]c2c1,0.1334
C#CC12C3C1N1C3CC21,0.2519
CC12CN1C(=O)C=C2,0.1978
C1C(CO1)N=C(C#N)N,0.2049
CC1(OC1C1CN1)C#C,0.2681
CC1(CC1CC#N)C=O,0.2316
CCC(C)(C)C(=O)OC,0.2802
CC(N)=[NH+]C1=NC=N[N-]1,0.1632
N=C1OC2(CC12)C1CN1,0.2591
CC12CC1COC=NC2,0.2567
CC1C2C3OC1(C)C23C,0.3092
CCC(O)C(=N)NC=O,0.2257
N#CC12CC(CNC1)N2,0.2569
CCC1C=CC(C)C1O,0.2616
O=CC1OC1(C=O)C#C,0.187
OC1C2CC1C(O2)C#C,0.2707
C1C2CC3C4C=CC13N24,0.2236
C1C2N1CC1=C2ON=N1,0.1692
CC1OC2C3OC12C=C3,0.2252
CC1C(O)C1NC(N)=O,0.2758
c1cnc(nc1O)CN,0.2097
COC(=O)c1cnno1,0.2127
CCc1c(n[nH]n1)CC,0.2495
CC1(CC1O)C(=O)CO,0.2389
CC1CC1C#CC1CN1,0.2629
C#CC12CC3C1C1C2N31,0.2596
CC1CCN=COC1C,0.2582
Cc1ccc(cc1O)O,0.2159
C#CCCc1cn[nH]n1,0.25
Cc1c(noc1C=O)C,0.191
N#CCCN1C2CC1C2,0.2722
CC12CC1(CO)COC2,0.3164
CC1C(CO)CC1=NO,0.2496
CC1C2C(C#C)C1N2C,0.2562
C1CC=CCOC(=O)C1,0.2555
O=CCCN1CC1C#C,0.2161
CC12CC3(O)C(CC13)O2,0.3094
OCC1CCOC1C=O,0.2159
CC1CCC11CO1,0.3322
C#CC#CC(=O)N,0.1977
CC1(N)C(O)COC1=O,0.2567
CC1(O)CCC(C=O)=C1,0.1919
OC(C#N)C1=NCCN1,0.2404
CN(C)c1nc([nH]n1)O,0.2365
CN1C=CCC(O)C1=O,0.2099
CCC(C)(COC)C=O,0.224
CC12CN3C1C1(CO1)C23,0.3034
OCC1=CCC2CC2C1,0.2606
C#CC(=NO)C1CCC1,0.2061
OC1C2C3CN2CC1O3,0.2881
O=C1C2CC3C=CC1N23,0.1991
[O-]C1=CC(F)=CNC1=[NH2+],0.1484
CC1=CC2CC2C11CC1,0.2345
CC(NC=O)C(O)C=O,0.2069
CC12CC1CC(CO)C2,0.3305
CC(=O)c1ncnnn1,0.1491
CCC(C#CC)C(C)C,0.3022
C1CC1CCC(F)(F)F,0.3746
CC(C)C#CC#CC=O,0.1759
COC1C2CCC(=O)C12,0.225
N#CC1C2C3NC1C23,0.2579
C1N2CC11OC=NC1C2,0.2494
OC1C=CCCC=C1,0.2526
OCCN1CC(O)C1=N,0.2484
CCc1c(c([nH]n1)O)N,0.2501
CCOC(=O)COC=N,0.2589
CC(C)C1C=CC2NC12,0.2442
CCN=C1NC=NC1C,0.2211
CCC1OC(C)C1C#C,0.2886
O=C1C2CC3OC1C23,0.2006
CC1NC(=O)OC1C#N,0.2735
CC(COC=O)C=O,0.2289
CC(C=O)C1NC1C,0.2251
CC1C2OC1C1C2N1C,0.3107
CCCc1c(n[nH]n1)N,0.2226
CC(=O)COCCO,0.2025
COC1CC(O)(CO)C1,0.3021
CC12CC34CCC(C13)C24,0.364
CC(=O)OC(CO)CO,0.2694
Cn1cc(c(=O)cn1)F,0.1853
CC1CC(O)C=CC1O,0.2596
CC1CN2CC2C1=O,0.2153
CCC1COC=N1,0.2697
COC12C3CC(C13)C2=O,0.2316
CNc1nc(no1)OC,0.2497
CC(=O)C(O)C(C)(C)C,0.2177
CCC1(CN1)C(N)C#N,0.2828
N#CC12COC(CN1)C2,0.262
CCOc1ncccn1,0.2121
O=C1C2CCC1(N2)C#N,0.2352
C(CO)C(=O)NC=N,0.2287
C1CC=C(C1)C2(CC2)O,0.2459
Cc1c(c(ncn1)O)N,0.1985
CC12C3CC1OC23CO,0.2995
CC1N=CN2CC12CO,0.2466
CC(C)C(O)C(O)C=O,0.2251
O=CC1(CC=CC1)C#N,0.2155
NC(=O)C12OC1C1OC21,0.2482
COC1CN2C(C)C12C,0.2954
CC1(CO1)C1OC1C=O,0.2245
CC12CC3C(C13)C(=O)N2,0.258
NC1C2NC3C2C13C#N,0.246
CC#CC1CC(=O)C1,0.2173
CCOC(=O)C(=O)N,0.2059
CC1C2CC1C(O)C2,0.3392
CC1=C(F)OC(=N)N=C1,0.1684
OC1C2C(CC12O)C#N,0.2962
N#CCNC12CN(C1)C2,0.2632
C(C=O)NC(=O)N,0.2221
CC1CC(O1)C(N)C#N,0.2877
CC1(O)C2CCC12C=O,0.2196
CC(=O)C(=O)NCC=O,0.1797
NC1=C(OC(=N)N1)C#C,0.1823
O=CC1C2CCC12C#N,0.208
CN1C2C(CO)C2C1=O,0.2459
C1COC=NCC=C1,0.233
COCC1(O)CNC1=O,0.2627
CC1N2C3CC(C3)C12C,0.3041
CC#CCC(=O)C(=N)N,0.1866
CN(C=O)C1(C)CC1O,0.2624
CC1=NC(=N)OC(F)=C1,0.1799
COc1nccn1C=O,0.1863
OCCC1CN=CO1,0.272
OC1C2OC(C1O)C2=O,0.2267
CCC1C(C)C1(C)CC,0.3274
OC12CC3(C#N)C1OC23,0.2653
CN1CC(=O)C12CC2,0.1973
CC12CC1(C)C=CC2,0.2464
COC1CC(O)CC1=O,0.2001
CC1C2CC2(C#N)N1C,0.2386
CC1(O)CCC1N1CC1,0.308
OCC12NC1CC2=O,0.2206
COC1COC(=O)C1,0.2786
C1C2CC3C4CC3C4C12,0.3466
CC1CC23CC(CO2)C13,0.2937
O=C1CCC(CC#N)N1,0.2686
OCC1N=CNC1C#C,0.2413
OCC(O)C1CN=CO1,0.2706
CCn1ccnc1C#C,0.2023
CN=C1CCCC(=O)O1,0.245
N#CC12OC3CC1NC23,0.2535
C#CC12C3OC1COC23,0.2541
CCC(O)C(O)C(C)O,0.306
CC1OC2COC2C=C1,0.2511
OC1CNC2=CON=C12,0.2025
CC12CC=CC1(N2)C#N,0.231
CCC1CC(=O)CC1O,0.2229
OCC1(CO)C2CN1C2,0.2969
O=CC1COC1C1CC1,0.2163
CN1CC2CC1C(=O)N2,0.2332
OC12CC3C(C=C1)N3C2,0.2346
C1CC11OC2CCC1C2,0.3043
c1c(non1)CC=O,0.2087
O=C1CNC11CC=CC1,0.2142
CC(=O)Cn1cccc1,0.1803
CN1C(CO)C1C(N)=O,0.2362
OCC1(CC2OC12)C#N,0.2887
CC(O)C1=C(N)NC=C1,0.2286
CCC1C(C)CC11CO1,0.3226
CC1C2C3(O)CC2(O)C13,0.3189
O=C1NC=NCC1C#C,0.2275
N#CC12C3CC1CCC23,0.2877
CCC(=O)C(C)(O)CC,0.2298
O=C1NC2=C(ON=N2)O1,0.1365
COC(C=O)C(C)(C)O,0.2135
CC1C2C(O)C(=O)N12,0.2227
C1C2C3C2C2C4C3N4C12,0.3
N=COCC1CCC1=O,0.2182
CC12NC3(CO)C1OC23,0.2912
CCC(OC=O)C1CN1,0.251
N#CC1OCC2OC12,0.2947
CCC1OC2C3OC1C23,0.2876
OC1C=CC2=CON=C12,0.2019
CC12CC1NC(=O)OC2,0.2878
CC12C3C1C1C3C21C,0.2999
O=CNC1C2CC1C=C2,0.2395
CN=CN1CC(C)C1=O,0.2237
CCc1cnc(nc1)O,0.2069
Cc1c(c(no1)O)N,0.2288
OC1C2CCC2C11CC1,0.3147
COCC1(COC1)C#C,0.2941
C#Cc1ncnc(n1)N,0.1975
CC1=NC(CCO1)C=O,0.2183
CC(=N)N(C=O)C(=O)C,0.2319
CC1C=CC(O)C11CO1,0.2481
CC12CC(C=O)C1C2O,0.2016
O=CC#CC12CC1CC2,0.1938
CC(C#C)N1C(C)C1C,0.2715
CC1COC2CCC1C2,0.3108
O=C1OC2C=CC1C=C2,0.2207
CC(O)CCCC=O,0.2285
c1coc2c1OCOC2,0.2226
CC12CC3COC1(C)C23,0.3099
O=CC1C2CCCCC12,0.2206
COC1CC2(C1)CCC2,0.3285
CN1N=CN=C(F)C1=N,0.1602
OC12CCC1C1OCC21,0.2977
c1c(nc(=O)on1)N,0.1842
CC12CC1C(O)CC=C2,0.2456
CC1=CC(C#C)N2CC12,0.2345
CC1C(O)C2C1CC2=O,0.2203
C(C=O)N=CNC=O,0.2116
COC=NCCCC#N,0.2691
CC1OC2(C)C1OC2=O,0.2509
NC1C(O)C(=O)NC1=N,0.2251
CC#CC1C=CC2CN12,0.231
C1C2C3C4OC4C2C13,0.3284
O=C1OC23CC4C2NC134,0.2162
C1C2(CO1)C=CNC2=O,0.2044
CN1C=COC(=N)C1=N,0.1721
CC12C(O)C1C1COC21,0.2966
NC(C#N)C1C2CCC12,0.2762
c1c(cnoc1=O)N,0.1776
OC1C=CC2C1CC2=O,0.2087
C1OCC2C3OC3CC12,0.3246
CC(=O)NC(=NC)N,0.2188
CC12COCC1C2C=O,0.2188
O=C1NCC11CC1C#N,0.2683
CC1CC(O1)C1CN1,0.3146
O=COC1C2CC(=O)C12,0.2298
O=CCC(NC=O)C#N,0.2261
OC12CCC11CCC1C2,0.3153
C(C#N)N(CC#N)C=O,0.2754
C1C2C3C4C5C(C5N24)N13,0.262
c1c(c(c([nH]1)O)C#N)O,0.2078
CCC12OC1CC2O,0.3208
CC1=C2C(O)CN2N=N1,0.2481
CCOC=NC(C)CO,0.2587
CC#CC1CC(C1)=NO,0.2493
C1C2C=CCC3OC2C13,0.2474
NC1=C(C=O)C2OC2C1,0.1804
CCC(=O)NCC(=O)C,0.214
COC(CO)CC(N)=O,0.2736
COC(C)C(=O)N1CC1,0.2392
C(C=O)C(=O)OCC=O,0.2227
CNc1c(oc(=O)o1)N,0.241
CCC1NC(=O)CC=C1,0.2509
C1C2CC3=C(ON=N3)C12,0.2041
CC12CC1CC2(C)C#C,0.2995
CCC12CC(O1)C(C)C2,0.3281
CCC(C)C(=O)C(N)=O,0.1756
CC1(CC1)C1CCCO1,0.3231
CC1CCC1C=O,0.223
CC1CCC2CC1C2,0.3562
CC(C)c1ccc([nH]1)O,0.2351
C#CC1C2CCC12C#N,0.2678
OCC1CC2CC12C#C,0.2692
N=C1NC(=O)NN=C1,0.1915
CCC1OCC1(O)C=O,0.2195
CN1C=CC(=N)N=C1F,0.1952
COC12CC1N1C(C)C21,0.2744
OC1CC11NCC1=O,0.2131
CC1(C)C2CC2C1=O,0.2251
CN1CCC1C(O)C#N,0.2698
CC12CC(OC1)C2(C)C,0.3101
OCC1(O)C2COCC12,0.3015
Cc1cn2c(n1)[nH]nn2,0.1945
O=CCC1CC(O1)C#C,0.223
CC1C=CC(C=O)C1C,0.2095
C1CC=CN(C=C1)C=O,0.2018
C1C2C3OCC1C1C3N21,0.32
CC1CC(C=O)C2CC12,0.224
C1C(CO1)c2n[nH]nn2,0.218
N#CC12C3CC1OC23,0.2628
CC1(O)CC=C(C1)C=O,0.1938
CC1(Cn2c1ncc2)C,0.2572
C#CC1=CCCC1=NO,0.1759
CCc1c(c(co1)N)N,0.2223
Cn1c2cn[nH]c2cn1,0.2073
CC1(C)C=CC2(O)CC12,0.2471
CC1CCN=C(C)O1,0.2722
CN1CC23CC(O)(C2)C13,0.285
CCCC#CC(=O)N,0.2343
CCc1c(c[nH]c1N)N,0.2298
CC1CN(C=N1)C(N)=O,0.2306
CC12C3OC4C(C13)C24C,0.312
NC1=C([O-])C(C[NH3+])=NO1,0.1986
CCC12OC1C1COC21,0.2931
C#CC1OC11C2CC1O2,0.2547
NC(=O)CC(O)CCO,0.2707
CC1CC11CCC=CC1,0.2686
CC1(C)C2NC2C11CC1,0.3093
CC1CC1(C)CC(N)=O,0.2688
COc1cncn1C=O,0.1786
OCC1(CC(=O)N1)C=O,0.2061
C1CN1C(=O)N2CC2,0.2691
CC1(C=O)C2C3CC1C23,0.2239
CC12CC3(C)C1C1C2N31,0.2993
CN1C(=O)C2(O)CC12C,0.2393
O=C1NC2(CC12)C1CC1,0.2501
C1OC23C=CC4C2N4C13,0.2257
COCC12CC(C1)CC2,0.337
O=CCOC(C#C)C#N,0.2292
O=C1OC2C3NC=C1C23,0.1626
C1CC1CCCC=O,0.2286
CCC(O)C(CO)C#N,0.2941
CC1CCC(O)C11CN1,0.309
NC12C3OC3C1NC2=O,0.2463
OC1CCC2OCC12,0.3094
CC(C)n1c(cnn1)N,0.2369
CCC1=CCC2(CO2)C1,0.2614
OCC1CC11CC2OC12,0.325
CC(CO)C(F)(F)F,0.3455
COCC12CCCC1N2,0.3176
Cc1c(cc([nH]1)O)CO,0.2279
c1c(coc1N)OC=O,0.2026
[O-]C(=O)C12C3CC1[NH2+]C23,0.2488
CCC1OC2C(O)C12,0.2995
N=COC1CCC1C#N,0.2812
COc1c(cc[nH]1)C#C,0.2155
OC1COC2=C1NN=N2,0.2102
CN=C1CCOCCO1,0.2641
CC12C3CN(CC1=O)C23,0.2051
CC1CC(O)CC(O)C1,0.3247
CC1(CC1)C2(COC2)C,0.3203
CC1(O)C2C3NC3C12O,0.2583
OC1COCC2CC2C1,0.3149
OCC12COC(C1)OC2,0.3062
CC1(C=O)C2C3NC3C12,0.2013
CC12C3C4C(N14)C23CO,0.2679
CC1CC2(C=O)C(O)C12,0.2235
CCC(C)(OC=O)C#C,0.2758
CC(C)(O)CC(N)C#N,0.2796
c1c(=O)c(con1)N,0.161
OC1C2NC2C2OC12,0.2991
COC1CN2C1C2(C)C,0.3036
C1CC=CCCC(=O)C1,0.2202
CC1C2OC2CC1CO,0.3315
CCC1NC(=O)C2OC12,0.2497
CC1C(C#C)C1(C)O,0.2791
OCC12CC(C1)C1OC21,0.3253
OCC1C2CC1(CO)O2,0.3036
CC(=O)C1(CC1)OC=O,0.2312
OC1C(=N)N2CC12C#C,0.2396
C[NH+]1CC(C1)C([O-])=O,0.1737
CC1CC2N3CC2(C3)O1,0.301
COC1=CC(=O)N=NO1,0.2069
CCCC1CN1C(N)=O,0.2853
OCC1C(O)C11CCC1,0.3013
C#CC1OCCC11CO1,0.2893
N=C1NC2=C(N1)N=CO2,0.1826
c12c(non1)oc(n2)N,0.2082
c1cc([nH]c1N)N(=O)=O,0.1494
COCC12CN1CC2,0.3045
CCNC(C#N)C#N,0.256
CCNC(=O)C(=O)NC,0.2129
OC1COC1=NCC=O,0.2241
CC1(C=O)C=CNC1=O,0.1935
CC12C3OC1C(CO)C23,0.297
CC1(O)C2CC(=O)NC12,0.2574
CCC1OC2CCC1O2,0.3308
ON=C1CCC11CC1O,0.2268
C1OC23COC2CC=C13,0.2371
OCC12CC3C4C(C14)C23,0.3109
C1COCOC=N1,0.2602
O=C1OC(C#C)C11CO1,0.2509
CC(C#N)C1OC1C,0.3087
CC1CC2CC(C#N)N12,0.2355
OC(C#N)C1CC(=O)O1,0.2807
OC1CC1C12CC1OC2,0.2971
CC1OC2COC1CO2,0.3314
COC=NCC(=O)N,0.2506
COC(C)COCCO,0.3046
C1NC1C1=CC=NN1,0.2502
O=C1OC2C3CCC2C13,0.2748
O=CC1COCC11CC1,0.2235
C1CCC(C1)C2CC2,0.3501
CC1CC2CC1C2O,0.317
CN1CC11CC(O)C1,0.3024
CN(CC(=O)C#C)C=O,0.1741
CCN1C(C)C1(C)C#N,0.2714
CC1C(O)C11COC1,0.301
O=C1C2CC1(N2)C#N,0.2486
C1C2C3OC=NC3CN12,0.253
CCC1CC(C=O)C=C1,0.2162
CCC1C2NC3C2OC13,0.2955
N=C1OC2CC1(C2)C=O,0.2213
CC1=CC2C3C2N2C3C12,0.239
CC1CCC(O)(C1)C#N,0.3172
C1C2C3CC4C(CN34)N12,0.2866
CC12CC=CC1(CO)O2,0.2478
O=CC1CC(=O)OCO1,0.2197
CCCCC1C(O)C1O,0.2813
OC1CCC2NC12,0.3096
CCC1CCNC(=O)C1,0.2683
CC12CC1(O)CC(=O)C2,0.2214
C1C2C1C1OCC2C=C1,0.2453
CC1=CCOC(C1)(C)C,0.2621
NC1=NON=C(N)C1=N,0.1555
OC1CNC2=C1C=CO2,0.2177
CC1([NH3+])CC(C1)C([O-])=O,0.2689
CC(C#N)C1=CNN=C1,0.2617
OC1C(OC1=O)C#N,0.2596
CC(C#C)C#CC=O,0.2044
C#CCCCC1COC1,0.2976
CC1=C(C)C2CC1O2,0.2324
CC1=CNC=C(F)C1=N,0.1864
CC#CC(=NC)NC=O,0.2002
CC(C)C1CN1CC#N,0.2721
OCC(O)C(=O)C1CC1,0.2222
ON=C1C=CNC1C#N,0.1755
CC1CC(N)C(O1)C#N,0.2699
COCC(C)(N)C#N,0.3016
CC1(O)C2CC(C)(O)C12,0.3091
CN1CCC1(C)C#N,0.26
N#CC12CC(C1)N=CO2,0.2591
N=C1COCC(O1)C=O,0.2145
CC1=C(CCCC1)C#C,0.2088
OC1C2CC3CC1C23O,0.2984
CC(=O)C12CCC1N2,0.2218
CC1CCC(CC=O)O1,0.2255
N#CCC1CN1CC#N,0.2714
CCCNc1nc[nH]n1,0.2245
CC1(CC1)C#CC1CO1,0.2641
CCC(C#C)(C#C)OC,0.2783
OC12CN3CC1C23,0.2896
CC1CN1C1C2CC1C2,0.3165
CC1CCC2NC12C#N,0.2751
C#Cc1ccc([nH]1)C=O,0.1646
C1C2C3OCCCC1C23,0.3162
CC1(C)OC(=N)C(=N)O1,0.2328
CC1(CC1O)C(=O)C#N,0.2033
OC1(CCOC1)C1CC1,0.3132
CC1(COC1)C(=O)C=O,0.1523
CC12OCC1C2CCO,0.3075
CC(=O)CC1CN1C=O,0.2255
CC1CCC=CC(=O)C1,0.19
COc1cc([nH]c1)C#C,0.1927
CC1(NC1C1CC1)C=O,0.218
Cn1c(cc(n1)C=O)N,0.1848
CC12CCC1(C)C(=O)O2,0.277
c1([nH]c(=O)nc(n1)O)N,0.2296
O=CC1COC11COC1,0.2161
CC1(O)CC11NCC1=O,0.2113
Cc1c(ncnc1F)N,0.2237
C1C2C3OCOCC3N12,0.31
CN=C1OCC(N)=C1,0.2075
C#Cc1cncc(=O)[nH]1,0.1534
N=C1NC(CC=O)=NO1,0.1926
Cn1c(=O)c(=O)[nH]cn1,0.1891
OCC12CC3(O)C1CC23,0.324
CC12CC(C1O)C2C#N,0.3006
CC12COCC11CC2O1,0.3226
C1OC11CN=C2OCC12,0.2622
C#CC1(CC#N)CN1,0.2745
COC=NC1COC1C,0.2492
CCCC1(COC1)C#N,0.2894
Cc1c(cn[nH]1)N2CC2,0.2452
CC(=O)OC1COC1=N,0.2731
CC(O)C1(C)OCC1=O,0.2212
CC(C)C1CC1(C)C,0.3379
CC1(C)C(O)C2CC12O,0.3054
COCCC1C(O)C1O,0.2985
CNc1cnc(cn1)O,0.1609
CC12C=CC(=O)C1C2O,0.1799
CC12NC1C(O)C2CO,0.2983
O=C1CC(O1)C1CCO1,0.2753
CN=C(NC=[NH2+])C([O-])=O,0.1787
CNc1c(con1)C=O,0.1798
CCC(=O)C1(COC1)O,0.2267
N=CN1C(=N)OCC1=O,0.2314
N=C1OC2C3C4C2C1N34,0.2568
CC1C2NC(C#N)C12O,0.2489
COC1C2CC=CC12C,0.2402
C#Cc1ncc(o1)CO,0.1948
CCC1CN1CCC=O,0.2114
CC1(CN1)C(=O)C1CC1,0.222
N=C1OCC11CC1C#N,0.2698
CC1(CCCCO1)C#C,0.2946
Cc1ncnc(n1)F,0.2241
CC(C)(C)C(=O)C=O,0.1527
C1CC(C1)CO,0.3388
CC1C2OC(C#C)C12,0.257
COC1CC2OC1C2O,0.3271
CCC1OCC1C(N)=O,0.2612
c1cc(cnc1)F,0.2262
O=C1NCCOC1C#C,0.2573
CC1(COCC(=O)N1)C,0.2653
CC12OCC(C1O)C2=O,0.1953
CC12CCC3CC3C1O2,0.3331
N#CCC1NCC11CN1,0.2763
CC12CC1C(O2)C=O,0.2078
CC1(C)C2C3C=CC1N23,0.2115
COC1(C)CC2(C)CC12,0.3244
CC(=O)OCC1CO1,0.2848
N#CCC1(CN1)C#N,0.2884
NC(=O)C1(CO1)C=O,0.2006
CC1CC(CO)CC1C,0.3384
CC#CC1(CCCC1)O,0.2838
CCCC1CN(C1)C=O,0.2663
O=C1NC=C2C3CC3N12,0.2115
ON=C1CCCC(O)C1,0.2507
COCCc1cnon1,0.2238
CN1C2C3C1=NCC23N,0.1696
OC12C3CC4C(CC13)C24,0.3176
CC1C=CCCC1(C)C,0.2687
OC1C2C=CCC(O)C12,0.2479
CC1CC2C(C)(O)C12O,0.3034
OC1(CNCC1=O)C=O,0.1717
CN1C(CCC1=O)C#C,0.2675
CC(O)C1CC2(CN2)C1,0.3073
CC1CC=CC2(CO2)C1,0.251
CC1(CC1C#C)OC=N,0.264
CNC(=O)C(C)OC=N,0.255
C1C(CN1)(C#N)C(=O)N,0.2357
CC1OC2C(C#C)C12C,0.2749
CC(C)(C=O)C(O)C=O,0.1981
CCCCCC1COC1,0.3205
NC(C#N)C1=CCOC1,0.2315
OCC1(CCO1)C1CC1,0.32
Cc1c(=O)[nH]cnc1F,0.195
OC12C3CC4C(CC14)C23,0.3254
OCCC(O)C(=O)CO,0.225
CC(C)CC1C2CC1O2,0.3086
OCC1(O)C2C3CC2C13,0.3074
CC1(C)C2C3CC3(C)C12,0.3432
c1ccoc1,0.2445
c1nc(c(o1)N)C#N,0.2147
OCC1(CO)OC1C#C,0.2661
CC(=O)C1=NC2CC2O1,0.1923
c1cnc(cc1C=O)F,0.1851
OCC1CC(=O)N2CC12,0.2412
NC1C2CN=CN2C1=N,0.2324
NC1=C(O)C(=N)N=CO1,0.168
COC(C#N)C1COC1,0.2682
COc1nc(co1)C#N,0.2117
Cc1c[nH]c(c1C#N)C,0.2194
OC12CC1(NC2)C#N,0.2349
OC1(C=CC2CC12)C#N,0.2355
CCC12C3CC1OC23,0.31
CN=C1COC(C)CO1,0.2608
CC1OC1C(O)C(N)=O,0.2775
CN=c1occo1,0.2318
CC1NC1(C)CC(C)=O,0.2187
CC1C2CC11CC(=O)C21,0.2187
CC1=CCCOC12CC2,0.2451
O=CN1C2CC1C1OC21,0.2633
COC1C2NC2C1(C)O,0.3003
OCC12CC3C(CC1)C23,0.3231
c1c(c2cn[nH]c2[nH]1)O,0.2121
NC(C#C)C1=CN=NO1,0.2185
CCC1C2OC(=N)C12N,0.2592
N=COC1COC(=N)O1,0.2706
[O-]C(=O)C1C2CN2C1=[NH2+],0.2211
C1NC11C2CC1N=CO2,0.2545
COC1C2NC1(C)C2=O,0.241
O=C1C2CC1COCC2,0.2178
CC12CC3C(C1)C3CO2,0.3096
CC1=C(C)C2CC1C2O,0.2387
CC#Cc1nnon1,0.1988
CN1N=CC(=N)NC1=O,0.1848
CN1CC2C3C2C(=O)C13,0.1983
CC1(C)CC2OC3C2C13,0.3086
CC12CC3CC1(C=O)N23,0.2156
CCCCC(=O)C(=O)N,0.1785
CC1C2N3CC1C23C,0.3238
CC(C#C)C(C)=O,0.2255
OCC1NC11CC(O)C1,0.3112
C[NH2+]C1(COC1)C([O-])=O,0.2598
OC1C2NC(=NC12)C#C,0.1883
CC1CC2(CO2)C=C1C,0.2466
C1COC(O1)(C#N)C#N,0.2846
Cc1cnc(cc1F)F,0.2299
Cc1coc(c1NC)O,0.2137
OC1CC(O)C2CCC12,0.3172
CC(C)Cn1ccnn1,0.2567
CC1CC2(C)CC2C1=O,0.2222
C1C2CC3OCC2OC13,0.3158
O=CC12CC=CC1CO2,0.2108
C1NC2C11OC22CNC12,0.178
COC1C=CC=CC=C1,0.1843
COC1C(O)C=CC1O,0.264
CN1CCC(=O)C1=N,0.1683
OC1C2CC3C2C13C#N,0.2925
Cc1c(c(on1)N)CO,0.227
CC12NC(C)(C1O)C2=O,0.2304
Cc1c(nno1)CC#C,0.2253
OC1CC11CC(O)C1O,0.308
CN(C)C(=O)COC=N,0.2505
CC1C2CC3C1(C)C23C,0.3162
CC12NC1C(=O)N1CC21,0.2194
OC12CC3CC1CC23,0.3291
ON=C1C2CC2OC1=N,0.1991
CN1C2C(O)C2(O)C1=N,0.2336
CC1=NCC2CC(=O)N12,0.2342
CC1OC2C1C2(C)C#N,0.2778
CC1(O)C2N=COC12C,0.2451
OCC1NC(C#C)C1=O,0.2067
CC1(CC1O)C(O)C#C,0.287
CC12CC1(N)C(=O)O2,0.2465
OCC1C(OC1=N)C#N,0.2641
CC12CC3C(C13)C(=N)O2,0.2752
C1C2OC3=NC=CN3C12,0.2451
N#CC12CCN1C1CC21,0.2456
c1c(nc(oc1=O)O)F,0.2043
OC12CC1N1CC1C=C2,0.2385
CC1OC2(C)C3CC3C12,0.3177
CC12CN3C(C13)C(=O)O2,0.254
CC(O)(CO)CN1CC1,0.289
CC1CC2C(O)C2C1=O,0.2243
C1CC2C3OC3COC12,0.3274
CC(C)(O)C(O)C(N)=O,0.2807
OC1CC(C#C)C11CN1,0.2876
c1c(nc[nH]1)N2CCC2,0.2153
C1OC2CC3NC3C1O2,0.3149
N#CC1CCCOC=N1,0.2623
CN1C2C=CC1C2=NO,0.2213
OC1(C#N)C2CN2C1=N,0.2327
CC1C2C3CCC2C13O,0.3259
COC1C(N)C1C#N,0.2677
C1CC1OC(=O)NC=O,0.245
CC(O)C(=O)C(C)(C)O,0.2291
Cc1cnc2n1CCO2,0.2386
CC12C=CCOC1C2O,0.2299
CNc1cc[nH]c1O,0.2393
NC1=CC(=NO1)C1CN1,0.2253
CC#CC(=O)NC(=O)N,0.2136
CC1CC11CC=C(C)C1,0.2601
CC1C=CCC1(O)CO,0.2631
N=C1CC2(CC2)CO1,0.2858
C1C2OC22COCC=C12,0.2543
CCC1N2C(C)C2C1=O,0.2129
CC1C2C3CC2(C)N13,0.3171
C(CCO)CC(=O)CO,0.235
CC1C2(O)CC2C1(C)O,0.3118
OC1=NOC(=C1)C1CO1,0.2318
CCCNC(=O)C1CO1,0.2651
CNC1C(C=O)C1C#N,0.2139
Cn1c(=O)n(nn1)C,0.2199
CC12OC1C1(CC1)C=C2,0.2377
COc1cnnn1C=O,0.1947
C1COCC(=O)NC1=O,0.2189
COC(=O)C1(C)CCO1,0.25
OC(C#C)C1(O)CCC1,0.2714
c1c(nnc(n1)F)N,0.1686
CCCC1OC1C1CC1,0.3407
C1C2CC1C21CCCO1,0.3226
CC#CC12CC1OCC2,0.2722
CC(O)COC(=N)C#C,0.2388
OCC1OCCC1C#C,0.2916
CC12OC3(CC3)C1C2O,0.2926
CCc1c[nH]cnc1=O,0.2088
OC1C2OC1C1OCC21,0.3091
C(CN=COC=O)CO,0.24
CCC(=O)CC1CCC1,0.2337
c1c[nH]c(c(c1=O)N)N,0.1849
N=COCC1NC1C#N,0.2652
C(c1c(n[nH]n1)O)O,0.2319
Cc1cc(oc1)N2CC2,0.2286
CC1CCC2=C1C=CO2,0.2299
OC12C3CC11OCC2C31,0.2985
OC12C3N=C4OC(C13)C24,0.1494
CC(=O)n1ccnc1N,0.1682
OCC12CC1OC2=N,0.2728
COC1CN2CC12C=O,0.2028
CC1=CC2(OC2C1)C#C,0.2318
CCCC1(O)CC1OC,0.3082
CC1CC11C(C)CC1C,0.3309
CC1(COC1)CC=O,0.221
CCc1ccc([nH]1)C#N,0.2031
CC1NC1C(=O)OC=N,0.236
C#CC#CCCCCO,0.2312
CC1(CC#C)OC1C#C,0.2733
NC1C2CCN2C1C#N,0.2329
CCC(OC(C)C)C#C,0.298
OC12CC1N(C=N)C2=O,0.2186
O=CN1C2CC3CC2C13,0.2541
C1CC1(C#N)C(=O)C#N,0.208
C1CC2=CCCCC12,0.2557
CC1=CC2CC1CO2,0.2471
CC1(N=CNC1=O)C#N,0.2266
CC1C2C(N2C)C1=O,0.2059
CC([NH2+]CC([O-])=O)C#C,0.2686
CN1CCc2c1nno2,0.1693
C1OC2COCCCC12,0.3069
OC1C2C=CC1C2O,0.2404
CCOC12CC1C(O)C2,0.3136
C#CC12C3C4C3C1CC24,0.2679
C1C2C3CCOCC2C13,0.3338
c1c(c([nH]c1O)N)O,0.2336
CC1C2COC1C1OC21,0.3339
OCC(O)C1=NC=CN1,0.2489
C1OC1C1(CC1)C1CO1,0.3445
CC(C)C1CCC1C#C,0.3027
OC(C#N)C#CCC#C,0.2622
c1c2c([nH]n1)C=CCC2,0.1843
CC1C(=O)NCC11CN1,0.2703
O=CC1CN1C(=O)C#C,0.2024
CC#CC(CO)NC=O,0.2743
CC1=CCC(=O)N1C=N,0.2043
CC1(CC(=N)O1)C=O,0.2165
OC12CC1COC(=N)C2,0.2805
O=COC(C#C)C#N,0.2688
N=COCC1=CON=N1,0.2314
N#CC1NC2C3CC2C13,0.2732
CCc1cnnn1CC,0.249
CC1OC(C#N)C1CO,0.2639
CN1CCn2c1ncn2,0.2385
C#CC#CCC1(CC1)O,0.2285
CCC(C)(O)CCOC,0.3106
C#CCC12OC3CC1C23,0.2777
CC1OC2CC1C(C)O2,0.3335
CC1=CCCC(=O)N1C,0.2099
CC(C)c1cc(c[nH]1)O,0.2306
N=COC1COC1C#C,0.2663
N#CC1CCOC=NC1,0.2612
CC(=N)OC1=NOC=N1,0.2588
CN1C2C3CC3C12C#C,0.2384
COCC1C=CNC1=O,0.2144
CC1CC2C(C)(C)C12C,0.3203
Cn1c(c(oc1=O)O)N,0.234
CC1C(C#N)C2(C)CN12,0.2705
NC1C(CC#N)NC1=O,0.2713
OCC1(CO1)C(F)(F)F,0.3297
OC1C2CC(=O)C(O)C12,0.2282
CC1OCC11OC1CO,0.32
N#CC1CN1CC1CN1,0.2583
CCC1C2OC3CC2C13,0.3218
Cn1c(cc(n1)N)C=O,0.1547
C1C=CC=CCOC=N1,0.2141
CCCCC1NC1CO,0.3177
COC1(COC1)CO,0.3117
OC1CC2CC2NC1=O,0.275
C1CCC=C(CC1)C=O,0.197
CC1=NC=C(N1)C1CN1,0.2395
CC1C(=O)C=C(N)C1=O,0.1635
CCCCc1cn[nH]n1,0.2567
CN1C2CC(=NO)C12C,0.239
C1CC(C1)(CCC#N)O,0.3142
CC1(CN1CC=O)C#C,0.2162
CC1(C)C(=N)OC11CC1,0.2804
CC1CC2C3C4CC13N24,0.3191
CC1CC(=O)CCN1C,0.2134
CC(C)(C)OC(=O)C#N,0.2417
CC1=C(CC(=O)C1)CO,0.2206
CC1NC11COC(=O)C1,0.2672
CCCc1cc(oc1)C,0.2346
CN1N=CC(OC=N)=N1,0.2262
CC(C#C)C(C)C#N,0.3027
CC12CC(C1)(C#C)C2=O,0.2418
O=CC12COC(=O)C1N2,0.2199
c1c(oc(n1)C(=O)N)N,0.1843
CC1=C(N)C=NNC1=N,0.1588
CC1=CC(N)=NOC1=N,0.1605
NC(C#C)(C#N)C1CN1,0.2484
CCC(CCO)OC,0.3217
CC1OCC(CO)O1,0.3426
N=C1OCC=C2CCC12,0.2473
C1C(CN1)(CC#N)C#N,0.2653
CC(=NO)C1OC1CO,0.239
CCCC(C)C(C)C=O,0.2265
C1C2CCC3OC2C13,0.3148
CC1CC11CCC1,0.3465
CC(=O)n1cc(cn1)N,0.1777
CCC1C2C1C(=O)C2O,0.2231
CN1CC1C1(C)CCO1,0.2909
CC(=O)C1C=CCC1O,0.2082
CC1C2N3CC3C12C#N,0.2467
COC1CCC(=O)CC1,0.2234
CC12CN3CC3(C)C1N2,0.3164
CC1(O)C2NC(=O)C12N,0.2284
COC1=CC(=N)N=NO1,0.2265
CCC(C#N)C1CN1,0.2806
c1c2c(no1)CCCC2,0.2411
c1cn(c(c1N)N)C=O,0.172
CN=C1CCC2CC2O1,0.269
CC1=NC=C(N)OC1=N,0.1558
c1coc(c1N)C=O,0.1765
COc1c(non1)C#C,0.2054
N#CC12C3CC1CCN23,0.2764
CC12NC3=CC(=O)C1C23,0.1552
OC1C2C=CC11COC21,0.2256
CC1C2(O)C3OC1(C)C23,0.287
CC1C2NC2(C)CC1O,0.3099
O=CC1OCC1N1CC1,0.214
CC1=NN2CC(O)C2=C1,0.2533
CCC1(CCCC1)O,0.3261
CN1C2C3C2C(=NO)C13,0.2347
Cc1cc(n(c1)C=O)C,0.184
CC(C)C1C2OC2C1O,0.3247
CC(CO)C(C)C1CO1,0.3374
CCC1C2OCC(=O)C12,0.22
CC(O)C1(CC1)C1CC1,0.3277
CC1(COCC=C1)C#C,0.2525
COC1C2OC2C1=O,0.1945
CN=C1OC(C)(C)C1N,0.2646
CC(C)OC(C)(C)C#N,0.2951
COC1C2CC=CC12O,0.2351
CNc1[nH]nc(n1)N,0.2425
CCC(CC=O)C=O,0.219
CC1=NCC2=NCCN12,0.2139
CNc1c(onc1O)N,0.2359
C#CC12COC3C1NC23,0.2778
CC12CN3CC1(C#N)C23,0.258
OC1CCC(=C1)C1CC1,0.2429
C1C2N3CC22COCC132,0.2939
CCC1=CCCCC1,0.259
CC1C(=O)C=CC11CO1,0.1876
COCC1CC1(C)C=O,0.2271
CN1C(CC1=[NH2+])C([O-])=O,0.1447
CCC1C=CC=CC=C1,0.1767
CN(C=O)C12CC1CC2,0.2665
CC1=NC(=N)NC(=O)N1,0.2092
CC(=O)C1(CCO1)C#N,0.2112
CCN1C2CCC12CO,0.325
N=C1OCC2=C1COC2,0.2123
CC1(CC1)C(=O)OC=N,0.2506
OC1COC11C2CC1C2,0.2987
CCC(N)(CO)C#N,0.2871
C1CC2(CC3OCC23)O1,0.3008
CC(C#N)C1(C)CO1,0.309
O=C1NCC2C3CC1C23,0.2598
CC1CC(CC#N)C1=O,0.2198
OC1C2C3CC2(O)C13,0.3158
CC1(CNC(=O)CO1)C,0.2638
COC(=O)C1CN2CC12,0.2433
CN(C=O)C1CC1C#C,0.2596
CC1(CN1)C1CCO1,0.3168
CC1CC(O)COC1C,0.3117
COC1C2C=CC1C=C2,0.2216
CC1C2N=COC12CO,0.2542
c1c(c(n[nH]1)C#N)C=O,0.1985
CCC1(C)CCC1C=O,0.2176
O=CC12CC1CC21CO1,0.2158
OC1C2NC1(C#N)C2=O,0.2305
CC(C)(CC(F)(F)F)O,0.3308
CC1CC(O)C2COC12,0.3124
O=CC1C2NCC(=O)C12,0.1906
NC1=NC2C3OC3C2O1,0.2785
CC1OC1C1=NCCO1,0.2516
Cc1c2c(cn[nH]2)[nH]n1,0.21
CCC12CC1CC2C,0.3224
CC1CN2C1=NOC2=O,0.2467
Cn1cc(nn1)CC#N,0.2536
CC(=O)C(=N)N(C)C,0.1923
CC12CCC1C(=O)OC2,0.2699
CC(C)(C)C12CC1OC2,0.2957
O=CC#CC#CC1CN1,0.1654
CC(C#N)C1CNC1=O,0.279
CCCc1ccncc1,0.2306
N=C1CCCCO1,0.2772
CC12NC1C1OC2C1=O,0.2284
CC1(C)C2CC2C1O,0.3162
CC1CCC=CC(O)C1,0.2556
CC12NC1C=CC21CN1,0.2357
CC1(C)C2CC1C1OC21,0.3372
C[NH2+]CC1=CC(=O)O[CH-]1,0.2233
CC1CC2=C(NN=N2)N1,0.2174
CC1CC2CC(=O)C=C12,0.1951
CN1C=NC2CC2N=C1,0.2026
O=C1CC2C3CC2N3C1,0.1897
OC1C2COC=NC12,0.2446
O=C1CC=CC2(CO2)C1,0.2238
c1cnccn1,0.1982
COc1coc(c1N)N,0.2264
CNc1cccnc1N,0.1927
CCc1c(cc([nH]1)N)N,0.2168
CC(C)C1(C)CC2CC12,0.3296
CC(C)CC(O)CCO,0.3268
CC1CCC2CC2C1,0.3389
C1NC1C1CCN=CO1,0.2728
C1OC23CCC4C2OC134,0.2717
CC1CC2C3OC2C13O,0.2908
Cn1cc(c(c1)OC)O,0.2321
OC1C(O)C11CC(O)C1,0.2819
CCN1C(=N)OC=C1N,0.227
C1CC1C2(CC(=O)C2)O,0.2149
C1OC11C2CC1OCC2,0.3162
c1c(c(n(n1)C=O)N)O,0.1772
CC(=N)OCC(C)=NO,0.2539
COC1CC(=O)CCO1,0.2262
N=C1OCC2OC12,0.2681
C1C=CCOCO1,0.263
C#CCOc1cc[nH]c1,0.2282
CC1(C=O)C(O)C1O,0.224
CC12CN=C3OCC1N23,0.2264
O=CC(=O)C12CC1CC2,0.1543
CC1(C)C2CC3C2C13O,0.3092
N=C1OC2CC2NC1=O,0.2154
CCCOCC(O)C#N,0.2829
CC1OC11CC2CCC12,0.3212
OCC1CC(=O)CC1=O,0.1955
Cn1cnc2c1n[nH]c2,0.2104
C1CN1C2CN(C2)C=O,0.2654
OC1CN2CC1C2C#N,0.2634
c1[nH]c(c(n1)O)C=O,0.184
CC(C#C)C#CCCO,0.2861
CC1COC1C1CCO1,0.3111
CC(O)C(=O)OCCO,0.2682
CNC(=O)C(C)C#CC,0.2707
CC(C)C1CC2(C1)CC2,0.3443
OC1C(=O)COC11CC1,0.2149
C1COCOC(=N1)C#N,0.2188
CC1C2C(C#C)C2C1C,0.288
CCC1(C=O)C2CN1C2,0.2084
CC1(C)CC2(O)CC12O,0.2829
CC(C)C(=O)N1CC1,0.249
C1Cc2c(n[nH]n2)NC1,0.2077
CC1C2CC1(CC#C)O2,0.2829
CCC1CCCC1=O,0.2189
OC12CC1OC(=O)CC2,0.2669
NC(C#N)C1CC(=N)O1,0.2911
c1(nc(nc(=O)o1)F)N,0.2247
OC1(CC1)C1CN1,0.2947
CC1CN2C(C#N)C12,0.2649
CCCOC1C2CC1O2,0.3143
COC1(CC1)CCC=O,0.228
NC(CC(N)=O)C(N)=O,0.2475
O=C1C=CCC2CCC12,0.1823
O=C1CN2CC3(CC3)C12,0.2026
c1c(nno1)OCC#N,0.2068
CN1N=CC(=N)C=C1O,0.1709
CC1CC=CC2COC12,0.2593
C1CN(C=C1)C=O,0.2091
OCC#CC#CC1CN1,0.2045
CCOC(=O)C(F)(F)F,0.2756
CC1C2N1CCC2(C)C,0.2901
OC12CCN3C(C=C1)C23,0.2177
COC1C2OCC12O,0.2915
O=C1CC2N1CCC2=O,0.2042
CC(C)C12CC1OC2=N,0.2793
OCC1C2CC2C1C#N,0.2811
CN1C(C#N)C1(C)C#N,0.2508
CCC#CCOC,0.2839
C1=C(C(=O)NC1=O)C=O,0.1415
N#CC1OCC2CC1N2,0.2664
c1c(nnn1CCO)N,0.2133
CC12CC3COCC1N23,0.3122
COC1(C)CCOC1=O,0.2529
CC1N2CC(C)C12C=O,0.2079
C1CC2CC1C=C2,0.2567
CCOC(=O)C1COC1,0.2517
O=C1CC(C#C)C2CC12,0.225
CC(C#N)C(C)(N)C#C,0.2814
c1c(nno1)COC=O,0.2356
CC(O)CC=O,0.2232
CC1C2CCC1N2C=O,0.2615
CC1C2CC2(C=O)C1=O,0.2036
OCC12CC1COC2,0.3171
CC1C2C3(C)OC3C12O,0.2873
CCN=COCCC#C,0.2712
CC1=CC(O)C(C1)C#N,0.2586
NC1C(=N)OC11CC1O,0.2671
CC1(C)C(O)C11COC1,0.3018
OC1CC1C12CN(C1)C2,0.2928
CN1N=CC(=N)OC1=O,0.1857
CC1C2C(C)C=CC12O,0.2423
COC(C)C12CN(C1)C2,0.2975
CC1=CC2NC2C1CO,0.2427
O=CN1CC2CC1C2,0.271
c1c(ocn1)OCC=O,0.1917
CN1N=NNC1=N,0.2027
CCCC(C#N)C1CC1,0.3322
CNC(=O)C(CO)CO,0.2698
NC1=C2C(O)CN2C=C1,0.2156
CC(C)C1=CCCOC1,0.2611
O=CC1C=C2CC3C2N13,0.1655
c1(=O)c(nonc1N)N,0.1459
C(C#CC=O)O,0.2057
CC(CCC1CC1)C#C,0.3139
CC(=O)C(C)(C)CC#C,0.2284
CC1(NCCC1N)C#N,0.2725
CC(C)C1C2C3CC3N12,0.2783
CC1OC2COC12,0.3075
CN1CC2NC2CC1=O,0.2656
CCOC1C(O)C1CC,0.2923
C1C2N1C13CC21COC3,0.2634
CN1C2C3OCC1(C)C23,0.2814
CCC12CC3OC1(C)C23,0.2982
N=COCC(=O)C1CO1,0.207
CCC1COC1C(C)=O,0.2152
O=CCOC1C2CCC12,0.226
CCC12CC(C#N)C1N2,0.2926
N#CC12C=CC3CC1N23,0.2164
CC1CCC2CC(=O)C12,0.2138
C1CC(=O)N(C=C1)C=O,0.2063
c1c[nH]ccc(=O)c1=O,0.1673
c1c(oc(=O)n1C=O)N,0.1851
C1C2CC11CCCC1C2,0.3645
OC1CC=CC2CC12,0.2465
CC12NC1CC2N1CC1,0.2813
CCN=c1cnonc1,0.1823
CC1CC(CC1C)=NO,0.2505
O=C(C1CC1)C1CCO1,0.2187
N#CC12CC1C1CCN21,0.2434
Cn1cc2c(c1)nc[nH]2,0.1956
C1C(CN1C=O)CC=O,0.2084
CC#Cc1nc(no1)N,0.1908
C#CC1OC2CCC1C2,0.2792
CN1CC2CC3C(O2)C13,0.2679
N=C1CNC=CC(=O)N1,0.1928
OCCNC(C=O)C#C,0.1938
C(C#N)N(C=O)C(=O)N,0.2501
CCC1(O)C2COC12C,0.2898
CC1C2OC2C1(O)CO,0.2971
CC1CC(CO)C1C#N,0.3036
OCC12OCC1(O)C2O,0.2577
CC12CC1C(C=C2)C#C,0.2469
C(C(=O)C(=N)N)NC=O,0.1706
CC(CCO)C(C)C#N,0.307
CN1C(C#C)C1C#N,0.2472
CNC1C(OC1=O)C#C,0.2441
O=CC12NC1C1CC21,0.1862
O=C1NCCN2CC12,0.2492
Cc1cn(c(n1)C)C=O,0.186
Cc1coc(c1C)C=O,0.1855
c1nn2c(o1)nc(n2)N,0.1965
CC12CCC1(O)C2O,0.2901
CC1C2CC=C(C)C12C,0.2458
OC1(CC#N)CC2NC12,0.2896
N#CC1CCCCC=C1,0.2554
OCC1C2CC3CC2C13,0.324
c1c(onn1)N2CCC2,0.2055
CCC12CC(C1)O2,0.3241
Cc1c(cc(cn1)N)O,0.1959
C1CC1(CC(=O)N)O,0.271
Cc1ncc(c(n1)N)O,0.2029
CC1C2C3OC1OC23,0.3297
COCC1=CNC(=O)C1,0.2088
CC1(NC1C#C)C1CC1,0.2777
CC1(CO)C2C3CN3C12,0.2753
OC12CC(C1)CC=C2,0.2506
N=C1NCC2COC1O2,0.2598
O=CC1CC2CC12C=O,0.214
O=CCC1NCC1C#N,0.2171
O=CCC1C2CCC1O2,0.2225
C1C2C=CC3OC=NC123,0.2188
CCn1cc(nc1C)O,0.2227
C#CC(CC#N)N1CC1,0.2701
N=C1OC2CCCNC12,0.2434
Cn1cnc(=O)c(n1)O,0.1975
CC1=CC(=O)COCC1,0.183
C1OC2CC1CO2,0.3353
CC1CC1CC(=O)CO,0.2383
N#CC12CC=CC1N2,0.2381
CC#CC12CC(C1)OC2,0.2848
N=C1ON=CN1C1CC1,0.2252
CC12CCC(=O)C1(C)N2,0.2131
CC1(C)N=C2NC3C2C13,0.1713
CC12CC1C1(NC21)C#C,0.2316
c1c(n(c(n1)N)C=O)O,0.1513
CN(C)c1c(nn[nH]1)N,0.2087
CCCN=COCCC,0.2702
CC1C(=O)C(O)C11CC1,0.2178
CC1=CC(=O)C2OC12C,0.1755
COC1CC2(C)OC12C,0.3203
CC(C)NC(=O)C(=N)N,0.2208
CCN=C1NCC1(C)O,0.2588
OCCC12OCC1C2O,0.2937
Cc1c(=O)nc(on1)O,0.1928
CC(C)n1c(ccn1)O,0.2554
CC1OC1C(N)=O,0.263
CCC(CC#N)C#CC,0.2858
OC(CCNC=O)C#N,0.2693
OC1CC=C(CC#N)C1,0.2575
COC1CCOC1C#C,0.2843
ON=C1CN2CC12C#C,0.23
C#CC(=O)OC1CC1,0.2353
COC(=O)C1(CC1)C#C,0.2573
CC1C2C(O)C2C11CC1,0.3176
CC12COC1C(=N)N2,0.2502
CC(C)C(O)C(C)(C)O,0.3105
CC1=NN2C3CC3C2=C1,0.2325
O=COCC12CC(C1)O2,0.2612
COCC1(C)CNC1=O,0.281
Cn1c(coc1=O)C=O,0.1658
CC12C3C4C(C1C4=O)N23,0.221
c1c(non1)C(=N)N,0.1839
C1CC(C1)NC=O,0.2799
Cc1c(non1)CC#C,0.2434
CCC1C=CC2(O)CC12,0.2447
OCCC1C2OC=NC12,0.256
CC1CCC(C)C(C)=C1,0.2585
OCC(CCC=O)C=O,0.2159
CN=c1ccocc1N,0.171
CC(C=O)C#CC1CN1,0.2054
C1C2CC11CCCOC21,0.3337
CC1(C)CC(=N)OC1=O,0.2617
CC12CCC1(N2)C1CO1,0.3234
CC12C3CC1C3C21CC1,0.3445
CC12C(O)CC11CC2O1,0.2969
CC1(C)C(CO)C1C#N,0.2953
CN1CC2C1C2(O)C=O,0.2045
CCC12CC(C1)C1CN21,0.318
CN1C(CC1C#N)C=O,0.1859
CC(C)C(C)C#CC#C,0.2311
CC1CC2C3N2CC13O,0.2774
OC1CCCCC2NC12,0.3106
CC1CN=C2OCC2C1,0.2685
O=C1C2CC2C2CCC12,0.2155
OCC1OCC=C1C=O,0.1769
COC=NC1C2CC1O2,0.2428
CC12CC1OC(CO)=N2,0.2638
CCCC(CCC)O,0.3325
N#CC1CC2C1C1CN21,0.2681
O=CC12CC(N1)C(=O)C2,0.1973
CC1CC2C=CC3C1C23,0.234
CN=c1oc(c(o1)O)N,0.2441
CC12CCCC1(CO)N2,0.292
C(=O)c1c([nH]c(n1)N)O,0.1827
N#CC1CCCC11CN1,0.2821
COC1OC(N)=NC1C,0.2802
CC(=O)c1ncn(n1)C,0.1994
CC1=CC2CCC1OC2,0.2536
OC1C2CC11N=COC21,0.2436
COCC(=O)C=O,0.1563
CC#CC1CCC1,0.2939
C1C(CN1C=O)CC#N,0.2638
c1c2c(c([nH]1)N)onn2,0.1694
OC12CC1(C#N)C(=O)C2,0.2286
CC#CCOCCOC,0.2823
CC(NC=O)C#CC=O,0.1938
C#CC12CC1CO2,0.2469
OC1CC2(CO2)C11CO1,0.2892
OCC12CCC1O2,0.328
c1c(oc(=O)o1)NC=N,0.2084
C1C23OCOC12C1NC31,0.2599
C1OCC1C12CN(C1)C2,0.3011
OCC12CN1CC2C#C,0.2805
OC1(CCC11CC1)C#C,0.283
CCC1(C)C2CC1C2O,0.3284
CC(=O)CC12CN(C1)C2,0.2061
CCC(CO)(C=O)C#N,0.2199
OC1CCC=CC11CO1,0.2488
CC1CCN(C)C1=O,0.2706
CC1C2CC1(C=O)C2O,0.2127
CC1CC(O)C=C1C#N,0.2209
COC=NCC(C)C#C,0.2632
CC(=O)CC12CCC1N2,0.2249
COc1c[nH]c(n1)C=O,0.1612
OCC12CC1OC1CC21,0.2932
CC1C(O)CC1OC=O,0.2637
C1C=CN(C1=O)C(=N)N,0.2062
C1C2OC3C4C=CC13C24,0.2251
OC1CC2OC(=O)C12O,0.2563
C1C=CC2C3C4C2C1N34,0.2484
c1c([nH]nc1O)CC#N,0.2417
CC1=C(N)NN=CC1=N,0.1707
OC12C3CC4C(C13)C24O,0.2751
CC1(O)C2CCC(=O)C12,0.2209
C1CNc2c1c([nH]n2)N,0.228
C1C2=C(COC2)C(=O)N1,0.2173
C1OC2CC1CC=CC2,0.2676
CC1(C)OC2CC12C#C,0.264
CC12CN1CCOCC2,0.3095
O=CCOCCC1CO1,0.2293
CCC12OCC3OC1C23,0.2915
CCC12C3C1C1CC3N21,0.3051
CC12NC(C1O)C2=O,0.2325
CC1C(OC=O)C2CN12,0.2544
CC(NC=O)C1(C)CN1,0.262
OCC1NC1CC1CC1,0.3175
C#Cc1c(nc(o1)O)O,0.1954
CC(=O)C1(OCCO1)C,0.2149
C(CNC=O)C(=O)N,0.2734
CCC1(OCC1=O)C#C,0.2132
CC(C)N1CC1C,0.3051
OC1CN=COC11CC1,0.2657
CC1(O)C2NC2C1C=O,0.2065
CC12CCC1OCO2,0.3324
OC1=NC=C(N1)C1CO1,0.2335
C1CC2C1C21COC=N1,0.2491
CC12OC3CC1COC23,0.3267
Cc1c2c(co1)NCC2,0.2147
CN(C)C(=O)C#CC=O,0.1819
CC(C=O)C(C)C(C)=O,0.2134
CCC(CO)N1CC1,0.3168
CN=C1OC2CN(C)C12,0.2375
OC1CNC2=C1NN=N2,0.1989
CC12CC1OCC1CC21,0.3221
COC1CN2CC12,0.3064
CCC1C2CC1(CC)C2,0.3705
CC1(C)C(C#C)C1(C)O,0.2778
CCC(CO)C#CC,0.3037
Cc1cc(c(=O)[nH]n1)F,0.1802
CC1C2COC1C2O,0.2979
C#CC1(CN1)C1CC1,0.2752
OCC1CN1C=O,0.2597
CC1C(C)C1(O)CC#N,0.2878
COCC1(C)COC1=O,0.2693
CC1(N)CNC1(C)C#N,0.2677
CC12CC3CC1(CO)N23,0.3277
OC12CC3COC1C23,0.3
CC1(CC2(C1=O)CC2)C,0.2139
CC1(CC(=O)C1)CC=O,0.2166
CC(O)C1(O)CCC1=O,0.2102
C1CNc2c1c(n[nH]2)O,0.2401
c1c(nc2n1nco2)O,0.1908
CC(C)C1(CC1)N2CC2,0.3045
COC(=O)C1CC(C)C1,0.2778
CC12CN1C1C(O)CC21,0.2731
C#CCCC1C2CCC12,0.3075
OC12CN3C1C(C=O)C23,0.2198
C1C2CC3CC(C3)OC12,0.3014
NC(=N)C1(CO1)C#N,0.2342
CC1N(C)CC1=O,0.2078
C1C2CC3COC3C12,0.3149
CC1CC2CC11COC21,0.3001
CC1CCC2CC1O2,0.3154
CC1C2C(O)C2(C)C1=O,0.2246
OCC12COC3CN1C23,0.314
CC1OC2CC(=O)C1O2,0.2156
N#CC12C3C1N1CC2C31,0.2519
CC1=CN(C(=O)OC1)C,0.2167
COC1C2C3COC2C13,0.328
CC1=NC(O)=NC(=N)O1,0.1925
CC(C)C1(C)OC2CC12,0.3135
O=CCC12OC1CC=C2,0.2191
OCCC1(O)CC1C=O,0.2212
COC(C)CC1CC1O,0.3285
CCC1CC2(C)CC2O1,0.321
COC(C)(CO)C1CO1,0.3165
OCC(O)C1CC(=O)N1,0.2763
OC1CC11CCCC=C1,0.2494
CC1(CO1)C1=CCOC1,0.2416
CCCC1NC(C)C1=O,0.2174
c1c(nc([nH]1)C=O)CO,0.1809
CC1(O)C(=O)CC11CC1,0.2067
CC1NC1C1NC1C#C,0.2738
COC1OCCOC1=N,0.2798
CCn1cnoc1=NC,0.2183
NC(=O)C1CC1C(N)=O,0.2438
OCC1CC=CC11CO1,0.2523
OCC1CC2(CN2)C1,0.3117
CCc1c(cc[nH]1)CO,0.2394
N=C1OC2C(O1)C2C=O,0.2185
CCC1(CC1)C2CC2,0.3331
OC1C=CCCC2NC12,0.2553
C#CC#CC(=NO)C#C,0.1627
C1C2C1C1OC2C=C1,0.2424
CC1=CC(=N)OC(=O)C1,0.2156
CC1C2C(C)C1N2C=O,0.2483
CC1CCC11CC(=O)N1,0.2841
C(C(=O)NC(=N)C=O)O,0.165
C1C2C3C4OC4C2N13,0.2928
O=C1NCC11CC=CC1,0.2668
C#Cc1c[nH]cc1N,0.2031
CCC#CC1(C)CCO1,0.2781
CC1(C)NC1C(=O)C#C,0.1908
COC1CC1(CO)OC,0.3082
CN1CC(CO)C1=O,0.278
CCc1[nH]nc(n1)CC,0.2646
CC(C)(C#N)NCC#N,0.2714
CC1C2C3C1C(O)CN23,0.2957
O=C(C#N)C1CCCO1,0.1812
C1NC2=NCCC3OC123,0.2399
Cc1c(nc(cn1)N)O,0.1822
C[NH+]1CCC(C1)C([O-])=O,0.2754
OC12CN(C1)C1COC21,0.2888
C#CC1C2CC1C21CO1,0.294
CNc1c(cco1)C#C,0.1996
Cc1c[nH]c(=O)[nH]c1=O,0.2048
CC1(OC2COC12)C=O,0.2095
Cc1cc(oc1)NC,0.2211
CC(CC1CC1C)C#C,0.3122
CC1=CC2CCCC1O2,0.2487
O=C1CC2CC3OC2C13,0.2104
CC1(C)C2C3OC3(C)C12,0.3212
CCc1cn[nH]c(=O)n1,0.1781
CNc1cc(oc1)C=O,0.1568
OCC1C2C3NC3CN12,0.2832
CC(C)(C)C1OC1C#C,0.2761
OCC1(CC#N)CC1O,0.3042
OCC1CC(C1)C1CO1,0.3375
Cc1cnc([nH]1)CC#N,0.2399
CC1(C)C2COCC12,0.3276
OCCN1C2C3NC3C12,0.2644
OCC#CC(O)CC=O,0.2267
COC12CC1NCC2=O,0.1925
CCNc1cncnc1,0.186
OC12CN(C1)CC2C#C,0.2753
O=C1NC2C3COC2C13,0.2551
OC1C2OCC(C=O)C12,0.2313
OCC1(CCO1)C1CO1,0.3172
CC12C3C4C1C(C2O)N34,0.2861
c1cc(c(cc1O)N)F,0.2038
CC1=C(CCC1=NO)N,0.188
OCC#CC1(CO1)C=O,0.2174
CC(=O)CCC(O)C#C,0.2354
OC1=CN=C(F)C(=N)N1,0.1643
CC1(O)C2CC1C(=O)O2,0.2673
COC12CC(C1)CCC2,0.3167
CC(=O)C(=O)C(=O)OC,0.1518
OC1C=CNC1=O,0.2049
C#CC1=CC2CC2CC1,0.1985
OC1CC2C(C=O)C12,0.2208
C1C2CN1C1=CC=CN21,0.2338
CC(C)C12CN1CC2=O,0.2225
N1C=CN=CC=CN=C1,0.1777
O=C(C#N)C1(CO1)C#N,0.2034
CC1N2CC(=O)C12C#C,0.2103
CC12C3COC11CN2C31,0.3164
CC1C2CCC(O)CN12,0.281
c1c([nH]c(=O)c(=O)[nH]1)N,0.1685
C1OCC11C2CN=CN12,0.2384
CC1OC(C)C11CC1O,0.3093
CC1N=COCC1=NO,0.2405
c1c2c(cnn1)OCO2,0.1982
c1c2c(c([nH]1)O)CCO2,0.2341
O=C1CC2COC1CO2,0.211
CC1=CC2CC(C)(C2)C1,0.2491
CN(C=N)c1c[nH]cn1,0.2152
Cc1coc(n1)C=O,0.1828
OC(C=O)C1C2COC12,0.2082
CCC1CC2C1C2(C)O,0.3167
CC(O)C(C)(C=O)C#C,0.2118
OC1CC2CC2(O)C=C1,0.2373
CC1CC11COCC1C,0.3248
CCc1c(cnn1C)O,0.2273
CC(=Nc1nc[nH]n1)N,0.2085
NC1=NNN=C1C1CO1,0.2092
CN(CCC#N)CC#C,0.2644
Cc1nnn(n1)CC=O,0.2232
c1c[nH]c(c1C#N)N,0.2135
CCC#CCC1CC1,0.299
CCOCC#CC1CC1,0.2762
c1c(n[nH]n1)C(=O)C#N,0.1998
CC1OCC2=C1C=CO2,0.2307
OC1CC1(O)C1CC1,0.2967
O=C1OCC2C3NC3C12,0.256
C1CC1n2nc(nn2)N,0.2126
COc1cnoc1N,0.218
C1CN=C(C1=O)NC=O,0.1747
C1CN(C(=O)N1)CCO,0.2899
CC1CC23CC=CC12O3,0.2297
CCC1C2CC1(C2)C=O,0.2167
CC1(O)C(O)CC1C#N,0.3035
CCCCC1(COC1)C,0.3149
CC1(CC(=O)C1O)C=O,0.2163
C#CC1CC2OC12C#N,0.2627
CCC1C2C3C(C)N2C13,0.3049
Cc1cc[nH]c1C2CC2,0.2318
CC1CCCN=CO1,0.2598
O=C1OC2CC1CC=C2,0.25
CC(=NO)CCC=O,0.2205
CC1C2OC2C2OCC12,0.3002
CC1OCC11CCC1,0.3158
CC1CN2C1=NCC2=N,0.2205
CC1(C)CCC1CO,0.3364
CCC1=NCC(=O)N1C,0.2327
CC12NC1C1OC21C#N,0.2305
c1c(onn1)C2CCC2,0.2287
OC12CC3C1N3C2C=O,0.214
O=CC1C2CN3CC3C12,0.1821
CC(C#C)C1=CON=N1,0.23
CC12OC3CC4C(C14)C23,0.3124
CC1(O)CC2C1N2C=O,0.2567
COCCN1CC1CO,0.2857
CC12CC3C1C3(O2)C#C,0.2461
N=COC1CN2CC12,0.27
CC(C)(C)C1CC1CO,0.3305
COC1C2CN3C2CC13,0.3114
CC#CC#CCC(C)C,0.2262
CC1COCOC1=O,0.2704
CC12CN=C(N)C1(C)O2,0.2486
CC(O)C1=NOC(N)=N1,0.2515
CN(C)CCC#N,0.2654
CCC1C2CC=C(C)C12,0.2455
CC(=O)C1CC1C#N,0.2276
CC12COC(O1)C(=O)C2,0.2121
CC1OCC2C3OC2C13,0.3051
OCC(C=O)C#CC=O,0.1913
OC1CC2C3CC12CC3,0.3011
CC1CC23CCC(O2)C13,0.3218
OCC12OC(C=C1)C2=O,0.243
FC1=CNC(=N)C(=N)N1,0.1726
C1C2OC22CC=CCC12,0.2648
CC12C3C1N1C3C2C1=O,0.2243
C1C2OC2C2C3OC1C23,0.302
OC12CC(C1)C2C1CO1,0.3326
CC1OC2C3CCC3C12,0.3108
OC1C2N3CC3CC12O,0.2763
CC1NC1C1(CO1)C#C,0.2736
c1c(c(n[nH]1)CC=O)N,0.1653
CC1=C(N(CC1)C=O)C,0.2062
CC12CCC1CC2C=O,0.2139
CC(O)(C=O)C#CC=O,0.1888
OC1CC1(O)C#N,0.2708
CCC1=CCOC1OC,0.2595
O=CC12C3C1N1CC2C31,0.2119
OC1CC2CCC1(O)C2,0.317
C(c1c(non1)C=O)O,0.1853
CC1(CC(=O)C=CN1)C,0.1884
C[NH+]=C1[N-]C=CC(N)=N1,0.2018
CC(O)C(O)C(=O)C#N,0.1777
C1CC2(C1)C1CC3C1N23,0.3182
CC(=O)C1=CCNC1=O,0.1803
COC(C)C(CO)C#C,0.3069
CC12CC(O1)C(C2)C#N,0.2948
N#CC12CC3C4C1C2N34,0.2678
CCCC(C)(O)CC=O,0.2214
COCC1OC1(C)C#N,0.2776
CC1N=C(N)OC1C=O,0.1982
Cn1c(nc(n1)N)OC,0.2418
Cc1ccnc(c1)C=O,0.1819
COC12COC1(C)C2O,0.2754
c1c2n(nn1)C=CCO2,0.1977
N=C1OC(=O)CC1C=O,0.2279
C1C2CCC3COC2C13,0.3174
CCOC12CC(C1)OC2,0.3181
O=C1NC2=C(O1)N=NO2,0.1419
OCC(O)C1=CNC=C1,0.2481
C1C2C3C=CC2C2C3N12,0.227
c1(c(nc(o1)O)O)N,0.2323
CCC1(COC)NC1C,0.3149
C#CCCCOC1CC1,0.3039
OCC(OCC#N)C#C,0.2704
C1CC=C(C1)C(=O)C#N,0.1742
Cc1nc(nn1C)C#C,0.2221
C1CC1N=COC2CC2,0.2529
CC(C)CCC#N,0.3517
C#CC1OC11CCOC1,0.266
OC12COC11CC(C1)C2,0.3188
OC1CC11COC1C#N,0.2712
N#CC1CC11CCCO1,0.2813
CN1CCn2c1ncc2,0.2306
CC1C2CC1C(C)OC2,0.3259
OC1(C#N)C2C3OC2C13,0.2592
C1COCC(=O)C(=O)N1,0.1766
CC12CC1C1C2OC1=N,0.2758
CC#CCOC(=O)C=O,0.1771
O=C1C2CN3C=NC1C23,0.1985
CC1=CC(O)C(=O)CC1,0.2207
CC#CC(O)COC=N,0.2741
CC1C2OC(C12)C(C)=O,0.2175
CC1=NC(=N)NN=C1,0.1565
CCC(CC)C1CN1C,0.3075
CC12CC(=O)C1N=CN2,0.195
CC12CC(C#C)C1N2,0.2935
C(=O)c1c(c(no1)O)N,0.1667
CC#CC1CN(C)C1=O,0.2646
OC1C2OC1(C#C)C2=O,0.2141
N=C1COC(O1)C1CN1,0.2696
CCCC1(CC)CCO1,0.3209
C1CC1(C2CC(=O)C2)O,0.2232
Cc1cc(cc(c1)N)N,0.2065
C1C2NCCOC=NC12,0.2265
COCC1(CC#N)CO1,0.3024
Cc1nc(cc(=O)o1)O,0.1944
OCC1=NC(=N)N=CN1,0.1979
CC#CCCC(C)C#C,0.2898
CCC1CCCCCO1,0.3234
C#CCC12CC(C1)C=C2,0.2391
NC1=COC(=N)N=C1O,0.1599
CCC(C)(C)C(=O)C#C,0.2025
O=C1NCCC11CN1,0.2686
CC12C3NC1C(=O)C23,0.2212
CC1OCC2=C1NN=N2,0.2355
OC1C2CC=C(C#C)C12,0.1968
CC12CC(OC1)C2CO,0.3093
CC1CC=C(C1)C1CN1,0.2389
c1c(cn[nH]1)OCC=O,0.187
c1c(non1)C(F)(F)F,0.2673
COC=Nc1ccn[nH]1,0.1897
CC(C)C(O)(C#C)C#N,0.284
CC(O)CCCC(C)=O,0.2338
CN1C2C(O)C1C2C#C,0.2585
c1c2c(c([nH]1)O)CC=C2,0.1862
c1[nH]c(c(n1)C#N)C#N,0.1982
CC12CC1C1(C)OC21C,0.2931
OC1CC2(O)CC(O)C12,0.2946
OC1CCC2(OC12)C=O,0.2214
C1CC1C(=O)CCO,0.2344
CCn1c(cnn1)OC,0.2444
CC1CC2(CC2O)C1C,0.3062
C1NC23C1OC1C2NC31,0.2849
NC(=N)C(O)(C=O)C#N,0.1989
CC(C)OCC1(C)CN1,0.3098
CC1C2OC3C2CC13O,0.2972
CCOCc1cn[nH]n1,0.2526
CC(=N)OC1=CC=CN1,0.2304
c1cncc2c1n[nH]n2,0.1812
C1OC11C2C3COC1C23,0.3191
C#CC1N2CC2C11CN1,0.2574
Cc1cncc(c1O)O,0.2162
CC1CC2CC2OC1=O,0.2702
CC(=O)C1(CCC1)O,0.2285
OC1CN2N=CC(O)=C12,0.228
CC1CCC2(CC12)C#N,0.3091
c1c2n(cn1)CCC=C2,0.1845
CCC1C2OC3C2C13C,0.3014
CCCC1(C)NC1C=O,0.2183
CC1C2CCC2CC1=O,0.2221
CCC(C)C(CC)C#C,0.3138
c1c(noc1NC=O)O,0.2115
CN1CC(=O)C1CO,0.2169
O=CN1C2C3C4C3C1C24,0.2535
CC(C)CCCCO,0.3424
C1CCC(C1)OCC#N,0.2892
CC1N2CC3C2C13C#C,0.2589
CC1CC1C12CC(C1)C2,0.3459
O=CCC1C=CC2OC12,0.225
OC1CCOCC(O)C1,0.3127
C(CO)N(CC#N)C=O,0.2699
OC1C(C=O)C1C#C,0.2199
c1cc(nc(c1F)N)N,0.1871
C(C(C(=O)N)C(=O)N)O,0.2611
CC1=CC(=O)C(C1)C#N,0.1961
CC1=C2CCC3C(C1)C23,0.2146
C1CC2CC=CC(C1)C2,0.2656
c1c(c(c[nH]1)N)C2CC2,0.2287
c1c(c(=O)onc1N)N,0.1724
CC1(O)CN=C2NCC12,0.2521
CCc1c(=O)oncn1,0.1652
CCOC(C#C)C1CN1,0.2697
CC(C)c1c(onn1)N,0.2077
CC1=C(C)C(=N)C=NO1,0.1797
Cc1c(cc([nH]1)N)C=O,0.177
CC(C=O)C(C#C)C#N,0.2225
CC#CC1CC(O)C=C1,0.2532
C1C2COC3=C2N1C=C3,0.1785
CC1C(O)C2NC12C#C,0.2586
CCCC(C)(CCC)O,0.3227
CCC(C#N)C(N)C#C,0.2783
CC#CCC(=N)NC=O,0.2266
ON=C1CN2CC2C1=O,0.1651
Cn1ccc2c1nno2,0.1918
CC1=CCCOC=NC1,0.2386
COC12C(O)C3C1OC23,0.2843
CCC(CO)C(=O)OC,0.2772
O=CC12CCC1C(=O)C2,0.2088
CCC(=O)COCC#N,0.2355
O=C1NC2C3CC1C23,0.258
CC1COC(=O)C1=O,0.1711
CC(COC=O)CC#C,0.2768
CC1(C)C2CC1(O2)C#C,0.2543
CCc1conc1O,0.254
OC12CN(C1)C2,0.3126
CCC1CC(O)(CO)C1,0.3189
CCN1C2C=CC1C2=O,0.2376
C1C2CC3=CON=C3N12,0.2386
CC1(CC(OC1)(C)C)C,0.3141
OC1C2CC2C1C1CO1,0.3081
CC1C2OC2C2CC1O2,0.3077
CC(C)C(C)C#C,0.3149
CC#CC1CC2CC2C1,0.297
CC(O)C(=O)C1COC1,0.2212
CC1C(C)C1NC=O,0.2713
CNc1c([nH]cn1)CO,0.2058
C1C2C3C4C3N3C1C2C43,0.2824
c1cnc(nc1F)C#N,0.2094
COC12CCC1C=CC2,0.2593
CC1(OC1CC#C)C#N,0.2774
C1CC11CC2CC(C2)O1,0.3079
CC1C2C3CN1C23CO,0.3044
OC1C=CC2=NNC=C12,0.1994
CC1C2C3C4C1CC2N34,0.3131
OCC12COC1=NCC2,0.2544
CN=C1OC=CC(C)=N1,0.1676
C1C2C=C3CCCC3C12,0.2368
CC(CC=O)C1COC1,0.2259
CC#CC(=N)NC(=O)N,0.2242
Cn1c(=O)cc[nH]c1=O,0.2103
c1c(cncn1)N,0.1943
CN1C2C3CC2C13C#N,0.2394
CC#CC1CCOC1,0.2963
CCn1ncc(n1)N,0.22
CC(C)(CCCO)CO,0.3329
CC12OC3C4OC3C1C24,0.3336
CCOCC1CC(C)O1,0.3251
N=C1OC(C=O)C2OC12,0.2174
C1C2CC3(CCC3)CC12,0.3478
CC1OC2C(O)C2(C)O1,0.3057
C1CC2CN=COCC12,0.2597
COC(C)C1NC1C,0.319
CCc1cc(no1)C=O,0.1944
OCC(=O)CC(O)C=O,0.2282
OC12CC1C1C2OC1=O,0.2596
CN1N=CNC(=N)C1=N,0.1805
CCCC1COC(C)O1,0.3432
CCCN=COC,0.27
CC(=O)C1COC(=N)N1,0.2
N=C1NCCCC1=O,0.1866
CC1(C)COC1CC=O,0.2245
OC1CN2CC3(CC3)C12,0.2648
CC(C)C12CC1CC2=O,0.2308
Cc1coc(c1O)C,0.2233
CC1OC11CCOC1=N,0.2622
CC1=CC(O)C2CC12O,0.2371
CN1N=CC(N)=CC1=N,0.1594
C1OCC2C3C4C3C2C14,0.336
C1C2C3N=COC3CN12,0.2535
CC(=O)NCC(O)CO,0.2778
O=C(C#C)C1(CO1)C#N,0.1985
OC1=C(NN=N1)C1CN1,0.2131
CC(NCC(N)=O)C#N,0.256
COC1OC2CN3C2C13,0.3134
COC1COC11COC1,0.3093
N=COC1CC2CC1O2,0.2715
CCN1CC(N=C1)C#N,0.2337
O=CC12CC1N=CN2,0.2054
COC1C2NCC(=O)C12,0.2008
CC(OC1CC1)C#N,0.2913
c1c(c2n(n1)CCO2)O,0.2268
C1CC2CC1CC=CC2,0.2663
CCC(=O)N(C)C=NC,0.2293
C1CC1C12CN(C1)C2,0.309
CC(C=O)N1N=NN=N1,0.2286
CCCCC1OCC1=O,0.2243
C#CCc1c(nn[nH]1)O,0.2266
C1CC23NC2COC3=N1,0.2614
Cc1cnccc1OC,0.234
c1c2c(co1)C=CCC2,0.2013
CCOc1cccnc1,0.2101
CC1COC(=N)C(C)C1,0.2755
C1CC#CC=CCC=C1,0.2039
c1c(c(ncn1)N)F,0.2131
CC(C)C1CCC1=O,0.2191
C1CC(=C2CCOC2)C1,0.2403
COC(C)CNCC#N,0.2702
CC1C=CC2C(CO)N12,0.2266
CC1(CCOC1)C#N,0.3063
N#CCN1C2CC1C2,0.2676
N=C1CC=CCCCO1,0.2497
COC1CCC2C(C)C12,0.319
CCc1ccn2c1CC2,0.2485
c1c(non1)CNC=O,0.2283
CC1CC=CC(C)C1=O,0.2244
CC12CC3C(C1)N23,0.3261
CC12CC(C1)C=CC2,0.2549
Cc1cnc(o1)N,0.2315
CN=C1ON=CC=C1O,0.1666
CCC(OC)C1CN1C,0.3023
CC1(C)C2C3C4C2C1N34,0.3035
NC1C(OC1=O)C#C,0.2459
C1OC2C1C1C3NC3C21,0.2777
Cc1nc(no1)CNC,0.2077
CC(O)C1OCC1C#C,0.2873
CC(O)COC(=O)C#N,0.2153
N#CC12C3C4C3C1CC24,0.2771
CC1=C(C)C2(C)CC1C2,0.2331
C#CC1CCC=C1C#C,0.2095
CC1(OC2COC12)C#C,0.2744
CC12CC3C1C2C3=O,0.2444
c1[nH]c2c([nH]nc2n1)N,0.2103
O=C1CC2CC2C1C#C,0.2169
CCC12CC1OC(C)=N2,0.2603
CC1C2C3NC2(C#N)C13,0.2538
CC1CC1CCC(C)=O,0.2331
CCC12C=CC3CC1N23,0.2159
CC12CC(=O)C(N1)C2O,0.2106
OC1CC2(CN2)C11CO1,0.2926
CC1CC1N1CC1C#N,0.2677
CC(C(O)C#C)N1CC1,0.2788
C1C2COCC=CCC12,0.2542
Cc1c(c(n(n1)C)O)O,0.2436
OC1CCOC1CC#N,0.3018
OC1C2OC3C2OC13,0.282
CC12CC1(OC2=N)C#C,0.247
CC1(COC1=O)C1CN1,0.2616
CCC1CC(C)C1C,0.3548
c1cnc(cc1C#N)F,0.2033
O=C1C=CCCC1C#N,0.1925
C1C2OCC3CC12CO3,0.324
OCCC1CC1C1CO1,0.3341
CC1CC1([NH3+])CC([O-])=O,0.2736
CCCCC1CN1C=O,0.2531
CC1N2C3CC3C12CO,0.2786
c1c(c[nH]c1OC=O)N,0.1835
CN=C1CCOC(=O)O1,0.2595
CN1CCCC(=O)C1,0.2052
C#CCc1cnc([nH]1)O,0.24
COC12C(C)C1C1NC21,0.2792
COC12C3OC1COC23,0.284
C(CO)c1c(nno1)N,0.1926
CC(C)C(C)(C)CC=O,0.2231
CC1(OC1CC#C)C#C,0.2787
CC1C2CC1C1CC2C1,0.3576
N=C1N=CC=CC=N1,0.1645
CN1C(=O)C2CC12CO,0.2473
CC12CC3(C)C1C(O)C23,0.3129
CC1OCC=CC1(C)O,0.2663
CC(=N)OCCOC=N,0.2725
OC12C=CC3(O)C1OC23,0.2109
CCCC(C)(CC)C#N,0.3511
CC12CC3OC3C1O2,0.3188
NC(=O)CCCC1CO1,0.278
CC1C2CC2(O)C1C#C,0.2831
Cc1c(n(cn1)C)C=O,0.1859
CC12OC(C=C1)C21CO1,0.239
O=CC1C2CC2C11CN1,0.2178
CCC#Cc1cnn[nH]1,0.2095
CCC#CC#CC=O,0.177
O=C1CCC11CCCO1,0.2031
FC1=CNC(=N)N=C1F,0.1597
CC1C(O)CC1(C)C,0.3223
OC12CCC1C21COC1,0.3057
CC(C#N)C(N)C(N)=O,0.2485
OC12CC(C1)N1CC1C2,0.2968
CCC1OC11CCC1O,0.3103
COC(C#C)C#CC=O,0.203
N#CCC1=NC2CC2N1,0.2272
CC1(C)OC(=N)C=C1N,0.2134
C#CC12CC1CC1CC21,0.278
CC12CC(O1)C2C1CC1,0.3273
CC12C3OC1C(C)(O)C23,0.2974
CCC1OC(=O)OC1C,0.3291
CC1=NNC(=N)C(N)=N1,0.1734
OC1CC2CC2(O)C1=O,0.2089
OCC12CC(C1)O2,0.3196
CC12CCC1(O)C(=O)N2,0.2556
N=C1OC2CC11NCC21,0.2465
OCCN1CCC1C=O,0.1975
CCCn1cnc(n1)N,0.2305
CCC1=NCC(=N)N1,0.2309
c1cc(ncc1C=O)F,0.1904
C(COC(=O)CO)C#N,0.2868
Cc1c(nco1)O,0.2168
OC1(COC1C#N)C#C,0.2672
CCC(=O)C1(CN1)C=O,0.2207
CCC1COCOC1=N,0.2755
CC12CC3(CC3)C1O2,0.3314
N=C1C=COC(=N1)C#N,0.1722
COC1CC1N(C)C=O,0.261
CC12OC(N)=NC1C2N,0.2668
C1CC2C3OC2C3C1,0.3007
OC1C2COC3C2C13O,0.2881
CC1CCC=CC1C#N,0.2641
OC1C=C2C3C4C2C1N34,0.163
N=COC(=O)C#CC#C,0.1882
CC1OC2(C)OC1C=C2,0.2417
C#Cc1[nH]c(=O)[nH]n1,0.1911
CCC(CC)C(C)C#C,0.3115
[O-]C(=O)CC1C2C[NH+]1C2,0.2778
c1c(c(c[nH]c1=O)N)N,0.1767
OC(C#N)C(=O)C1CO1,0.22
OCC(COC=O)C=O,0.2197
O1C2C3C4C=CC(C13)C24,0.229
CC(O)CC(N)=O,0.2677
COCc1[nH]c(cn1)O,0.2355
C1C2N1CC1=NNN=C21,0.2217
C(CN(C=N)C=O)C=O,0.22
C1COCCN1CC#N,0.2604
CCCC(CC=O)C#C,0.2232
O=C1CC2C3CN(C3)C12,0.2045
c1c(nnnn1)N(=O)=O,0.1489
Cc1c[nH]c(=O)o1,0.2397
OC1C(=O)CCOC1=O,0.2014
N=C1C=NNC(=O)N=C1,0.1636
OC1CC2CC(C#C)C12,0.284
CNC(=O)OC1CC1O,0.2993
CC#CC#CCC#N,0.2238
CC1C2(O)C3OC2C13O,0.27
COC(C)CCNC=O,0.2801
CCCCC(=O)C#C,0.2081
CC1=CCC2CN2C1=O,0.2078
Cc1cc([nH]c1)N2CC2,0.2326
CC1(CC2CC12)OC=O,0.2755
Cc1c(c(n[nH]1)N)C#C,0.2085
CCC1COC11CC1C,0.2942
OCC1C2CC1(O2)C#N,0.2587
N=C1N=CON=NC1=N,0.1927
CC(C)(CO)COC=O,0.2866
Cn1ccnc1NC=O,0.2128
CCCCCCOCC,0.3369
C1CC1C12CC(C1)O2,0.3176
OCC1(NC1C#C)C#C,0.2532
COC1(C)C2CC2C1C,0.3217
O=C1CNC2CC2NC1,0.1956
N=C1CC=CC(=O)O1,0.2143
c1c(onn1)CC2CC2,0.2335
C#CC1CC1N1CC1,0.2557
CC1C2CC3C4C1C2N34,0.2993
NC1=C(F)OC(=N)C=N1,0.1323
CC(O)C1OC1C=O,0.2237
COCC(C#N)(C#N)N,0.2578
N=C1C=CC(=O)ON=N1,0.1651
CC(=O)C1CC1(O)CO,0.221
COC(C)CC(C)(C)O,0.311
OC1C2CC1C(=N)OC2,0.2836
O=C1OC(C#C)C11CN1,0.2597
CC1C2CCC11COC21,0.3132
c1c(=NO)cnoc1N,0.151
c1c2c(co1)nc[nH]2,0.1893
c1c[nH]c2c1[nH]cc2N,0.2026
CC(O)C1C2CC(C)N12,0.3003
OC1CC1(O)C1CCC1,0.2964
C1C2C3CCOCC1C23,0.3157
CC1OC=NC1C(C)=O,0.2196
CC12CC(CO)CC1O2,0.331
c1c(=O)c(coc1F)F,0.2065
CC12CC3=CC4C(C13)N24,0.1758
CC12CCC3C1OC23C,0.3032
CC1=CC2=CCCC2C1,0.1927
COC1(COC1=O)C=O,0.1995
O=CC1CCCC1C#N,0.2242
COC1(CC1)C(N)C#N,0.2892
CN(C)CC(N)C#N,0.2606
CC1NC11C2OC1C=C2,0.2307
C1OC23CC4C(C2)OC134,0.2914
c1c2n(nc1N)C=CC2,0.1798
CC1(C)OC2CC12,0.3206
COC(C)CO,0.3335
C#Cc1c(nco1)C=O,0.1787
C1C2CC3NC3CN12,0.2906
CC1CN2C3C2C2C3N12,0.2697
C1OC2C3C4C3C1OC24,0.3121
CC1=CN=C(O1)C1CO1,0.2235
CN=c1ncn(nn1)C,0.164
O=CC1CC=CC1C#C,0.221
C1C2NC2C2=C1N=CO2,0.2254
OCC(OCC=O)C=O,0.2088
OC1CC1C(=O)CC#C,0.2189
c1cnn(n1)CCCO,0.2569
C1C23CCOC12C=CC3,0.2314
[O-]C(=O)C[NH2+]CC1CO1,0.2698
Cc1c(onn1)C(=O)C,0.1913
CNc1[nH]nc(n1)NC,0.2396
c1c(c(coc1=O)N)O,0.1653
OCC12CC(C1)C=C2,0.2407
c1cnc([nH]1)C(=O)CO,0.1908
O=C1CCC2COC2C1,0.2198
CCc1cncnn1,0.1641
Cn1c(nc(n1)C#C)O,0.2179
OC1CC=CC1NC=O,0.251
N#CC12CC3=NCC1N23,0.1945
CC12CC3OC(=NC1)C23,0.218
CCC(O)C(=O)CC#N,0.2279
CC1CCCC(C=O)=C1,0.1972
Cc1c(onn1)CC#N,0.2265
CC(O)C1=CC(O)CC1,0.2551
CC1=NC(=N)C=C(O)N1,0.1922
CCCC(C)C1CCC1,0.3656
O=C1CCC=CC11CO1,0.2131
N=C1OC2CC(=O)C1O2,0.2069
CNc1nc(=O)cno1,0.1858
O=CNCC1(CO1)C#N,0.2589
Cc1cc(=O)nc(o1)N,0.2096
OC1C=CCCC2OC12,0.2619
OC1(CN2CC12)C1CN1,0.2902
c1nc2n(n1)c(no2)O,0.2422
C1C2OC3C2CCCC13,0.3145
NC1=NNC=CC1=N,0.1758
CC1COC2(C)CC12C,0.3009
CC1C2CCNC(=O)N12,0.2885
CC1CCC2(C)CC12,0.3398
[NH3+]C12CC1CC2C([O-])=O,0.2566
CC1(O)C2C3CC3C12O,0.2551
C1CN(C1)C1C2CC1O2,0.2981
CCC1CCC(C)C1C,0.3625
C1C2CC3(CC=CC3)C12,0.2644
c1ncoc(=O)c(=O)n1,0.182
O=C1NC2C3CC(O3)C12,0.2723
CC12CC1(CC=C2)C#C,0.2426
N=COCC1COC=N1,0.2614
CNc1cccoc1=O,0.1568
OC1CN2CC2C11CC1,0.2878
C#CCCNCC#N,0.2727
OC12CCC1OCOC2,0.3224
Cc1c(coc1N)NC,0.2224
OCC1OC2C3OC3C12,0.2921
N=C1OC2CC1CC2=O,0.2125
CC12C3N1C1CC2C=C31,0.1985
C1CNC=C1C=O,0.1791
C1C2CC3(CC4CC34)C12,0.3372
OC1CC2(CC#C)CC12,0.3009
CC#CC1CCC11CC1,0.2903
OC1CC(CN2CC2)C1,0.3086
OC1CC1C1(CC1)C=O,0.229
CC1(O)C2C3C1CN23,0.3016
CCc1c(c(no1)N)C,0.2369
CN1CC(=O)C2(CN2)C1,0.1843
CC1CC1(C#N)N(C)C,0.2665
CCCC1(O)CC1(C)O,0.29
O=C1CN2C3CC=C1C23,0.1842
Cn1cnc(n1)CC=O,0.2228
CC1(COC1)OCC#C,0.2691
CCC1(COC1)C(=O)N,0.2676
COC1C(O)C2CCC12,0.3055
OCC1CC1C(O)C=O,0.2077
N=C1OCOC11CC1,0.2704
C1C2C3OC3C3CC2C13,0.3361
CC1CC2(C)OC2C1C,0.3276
c1coc(c(c1=O)O)N,0.1727
C1NC2=NCCC3NC123,0.2426
c1coc2n1nnn2,0.2335
CCC1(C)C(C)C1(C)O,0.3081
CN1C2COCC(=O)C12,0.2059
CCC1C2C(O)C1C2=O,0.2414
CC1(C)C2OC2C11CC1,0.3307
CC1(C)NC1CC#N,0.2963
CN=COc1ccn[nH]1,0.2152
CC1(COC1=O)C#C,0.2633
CCC1C2CC1(C)C2C,0.3756
CC1(CC1(CO)CO)C,0.3013
CC12COC1C(=N)OC2,0.2597
O=CNC1C2CN2C1=O,0.2284
C#CC1(COC1)C(=O)N,0.2579
CC(C=O)N1CCC1=O,0.2242
CCC(OCC=O)C=O,0.2107
CC1(CO)OC1C#N,0.2777
CC1C2CC(C2)CC1O,0.325
C#Cc1c(cc([nH]1)N)N,0.1828
C(CCO)CCOC=O,0.2806
CC1C(=N)OCC1=NO,0.2461
CC1(C)NC(=O)C11CO1,0.2573
O=CC12C3C4C3N1C24,0.1895
CC(COC(C)=O)C#C,0.2816
CC12CC(O)C1C2CO,0.2973
OC1COCCC1C#N,0.2921
c1c(oc(n1)C#N)CO,0.1998
CC1C2CC1(C)C1NC21,0.3101
c1cnc(=O)oc1F,0.1876
C#CC#CCC#N,0.2289
COCCCC(C)O,0.3211
CC1OC(C)C1C,0.3199
CC1=CC=CCC2CC12,0.1834
CC(C)C(CO)C(C)O,0.3226
C1C2CC1OC2,0.3339
COC1C2CC1C21CN1,0.3184
CC1COC2=C1OC=C2,0.2095
CC1(C)CC11CCC1O,0.3158
CC1(C)C2CNC12C#N,0.2399
c1c(onc1C=O)CO,0.1936
OC1C2C3(O)CC3C12O,0.2746
Cc1ncc(cn1)OC,0.2022
CN1CC1(C)CCC#C,0.2846
CCC1(CC(C)O1)C=O,0.2112
CC1NC1C(=N)OC=O,0.2482
CN=C1OC(=O)NN=C1,0.1901
CC1CCC(C)C=C1,0.2649
CC(C)(C(=O)N1CC1)O,0.2396
CC1=CC([O-])=C(C[NH3+])O1,0.1728
O=C1CCC(NC1)C#N,0.201
CC1OC(=N)C2(C)NC12,0.2673
CCC1CC2CC1(C)C2,0.3657
C#CCC(=NO)C1CC1,0.2429
CC1CC(=O)NC(=N)N1,0.2289
c1c[nH]nc1OC2CC2,0.2442
C1C2CC3(CCO3)CN12,0.2969
CCC1CC2(CC12)C=O,0.2264
C#CC1=C(CCC1)C=O,0.1718
CC1OC(N)=NC1(C)C,0.2794
N=C1CC(=O)OCCO1,0.2592
O=CC12CC1C1OC21,0.2198
CC1(C2CC1[NH2+]2)C([O-])=O,0.266
COC(CC(C)O)C=O,0.2135
CC1OC11CCC(O)C1,0.3222
CC(C)C1(O)CN2CC12,0.2877
CCC(C#C)C#CC,0.2874
CC(=O)C#CC(=O)C,0.1998
OC1(C#C)C2C3OC1C23,0.2717
CC(C)C12CC(C1)O2,0.3158
O=C1OCC23CCC12N3,0.2418
CN1CCC11COC1=N,0.2356
CC1NC(CO)=NC1C,0.2524
CC1CC11CC2C(C)C12,0.3216
CC1C2C3OC1(C=O)C23,0.2052
c1(c(onn1)N(=O)=O)N,0.1511
CC(=O)C1CC(=O)CN1,0.199
C1CC23C1C1C4C(C21)N34,0.2953
CC1(CN1)C1(CC1)C=O,0.2264
CCc1cc(=O)[nH]nc1,0.1783
CCC(C)C(CO)OC,0.3128
CC1C(C)C(=O)N1C=O,0.2171
CC#CC(=O)C(O)C=O,0.1753
CN(C)C(C#C)C(N)=O,0.2434
CC1=CC2CC1C(=O)O2,0.226
COC12CC1NC(=O)C2,0.2659
CCC(C)COC(N)=O,0.323
NC1C(OC1=O)C1CC1,0.2479
COCC1C(C)C1C=O,0.228
C#CC12C3C1N1CC2C31,0.2466
CN=C1NN=NC(F)=N1,0.1539
C#CCCC1CCC=C1,0.2625
CC12CC1OCC(O)C2,0.3306
CNC(=N)N(C=N)C=O,0.2089
c1cc(oc1CO)C=O,0.1826
CCCCC12CCC1O2,0.3283
CC1(COC1=O)C,0.2816
CCc1nc(cn1C)O,0.2218
CCN1CC1CCC#N,0.2715
CC(C)CNC(=N)C#N,0.2107
CC(C)NC(=O)C(=O)C,0.1788
C#CC1=C2CN3C(C1)C23,0.1434
N#CCCC1CC2CC12,0.3042
CCC(C)C(O)CCO,0.3294
CC12CC1C(CC=O)O2,0.2221
OCC12CC1OC(=N)O2,0.3004
CCC1N=COC1C=O,0.2153
OC1CC(=O)C1(O)C=O,0.2051
OCC1CC(=O)C2NC12,0.2157
CCC1CC=CC(C)O1,0.2655
CCC1CC(=O)C(N)=N1,0.1839
CC12COC1C(O)C2,0.2981
CC1CC2C1C2(C)O,0.3167
CC12CC(C=C1)C1OC21,0.254
OCC1OC(=N)C1O,0.2725
OC1C2C3OC1C23,0.3133
CCC12OC(C)C1C2C,0.3081
OC1CCCC1(O)C=O,0.2211
CCC1(O)CC11CCO1,0.2847
C1C(=O)OCC12COC2,0.2683
CC1CC2C=CC(O)C12,0.251
CC12C3C4C(O)C(C14)N23,0.2895
O=CCC1CN1CC=O,0.2138
O=C1CNC11C2CC1O2,0.1975
C[NH2+]CCC([O-])=O,0.2763
COC1CNC(C)C1=O,0.1867
CC1(C)NC1C(N)C#N,0.28
CC(C)(C)C(=O)NC,0.2767
CC#CC(=O)C(F)(F)F,0.2051
CC1(CN1)C1(O)CCC1,0.3117
C1OC2CCCCC12,0.3219
O=CC1=CC2CC2OC1,0.1813
C1CC(=O)C(=C1)C=O,0.1631
CC12NC1COCC=C2,0.2502
CC12CC1(C)N1CC1C2,0.2985
CC(O)CC1CCC1,0.3278
c1c([nH]nnc1=O)N,0.1727
CC1CC2OC1OC2=O,0.2674
COC(=O)C(O)CC=O,0.2242
CC1C2C3C(N3C)C12C,0.269
O=CC#CC1CO1,0.201
CCC(C)CCOC,0.332
CCNc1c([nH]cn1)C,0.2109
OCC1CNC(=O)OC1,0.3044
CC1CC1N(C=N)C=O,0.2228
OC(C#N)C1(CN1)C#C,0.2644
CC1(C)OCC1(O)C#N,0.2674
CCC12NC1C(O)C2O,0.2918
COC1CCC(=C1)C#C,0.2096
C1CC2(C1)CCOC2=O,0.271
CC1N(C)C1(C)C=O,0.21
C(=O)N(C=O)C(=N)N,0.2143
CCC(C=O)C1COC1,0.2189
c1cc(ccc1C#N)F,0.2124
CC12C3C1C1OC3C21C,0.3219
c1[nH]c2c(n1)NC(=O)C2,0.2019
CCC1(CC)OC1C,0.3314
CN=C1ON=C(C)C=N1,0.1525
Cc1nc(cc(n1)F)O,0.2388
CCC1(COC1)C#CC,0.2943
O=C1CNC2C3OC3C12,0.1946
C#CC1CC(CO1)C#N,0.2956
OC1C2OC(C3CC3)C12,0.2974
N=C1OC2OCC3C2C13,0.2789
CCN(CC1CO1)C=O,0.2691
CC(CCO)C1(O)CC1,0.3285
C1C(=O)C=CNC(=O)N1,0.1859
C1OC2C3C4N3CCC124,0.3058
O=C1CC2C3CC3N2C1,0.1938
CCOC(C)(C=O)C#N,0.2209
CC1OC2C3NC3C12C,0.2937
CN1CCc2c1n[nH]c2,0.2143
CC1(O)C2CCC12C,0.3103
OC1CNC2C1OC2=O,0.2368
NC1=NNC=C1C1CN1,0.2305
OC12CCC11CC2CO1,0.2747
COCCC1CC1C=O,0.2283
CCc1cc[nH]c(=O)c1,0.1804
OC1(CC=CC1=O)C#N,0.1915
CN1C2C3C=CC2(C)C13,0.2036
CNC(=O)NC(=N)C=O,0.1613
OCC1(CCC#C)CN1,0.3017
CCC1C2N1CC21CC1,0.3029
CC1CC(C)=CCC=C1,0.2527
CC1=CCC(=O)C1C#N,0.2221
CC1=CC=CCOC1=O,0.1835
CCN1CC1(CC)C=O,0.216
OC12C3C4C3N(C14)C2=O,0.2229
CC1C2OC2C1CC#N,0.3049
OC12CC1OC1CC2C1,0.2929
CC1=CCC2(CN2)C1=O,0.188
Cn1ccc2c1nco2,0.201
CCCC(C)C(=O)C#N,0.2074
CC1CCCO1,0.3246
CC1C(O)C2C1OC2=N,0.273
OC1C2OCC3OC2C13,0.2967
N=COCC#CC#N,0.2238
COC1C=C(C)CC1=O,0.1995
CN1C2C=CC3NC3C12,0.2128
OC1C2C(O)C1C2C#C,0.2863
CC(C=O)C1OC1(C)C,0.2207
Cc1c(cncn1)CO,0.2139
CC1COC(=O)NC=C1,0.2281
Cc1cccn1CC#C,0.2247
CC1CC(=O)CCC1=O,0.2159
COCC1(CO1)C#C,0.2845
CC1(CC1)COC,0.3357
CCC1CC(C#C)C1O,0.287
CC1=CC=CC(O)C=C1,0.1835
CC1(COCOC1)CO,0.3203
CC1OCC1(C)O,0.309
CC1C2CC1C2O,0.3244
CCOCC(O)C#CC,0.2861
CC1(CC#C)C2CCC12,0.3076
CCC12CC1C(=O)C2,0.2327
Cc1[nH]c2c(n1)[nH]cn2,0.2062
c1nc([nH]n1)C2CCC2,0.26
CC12CC1C(C)(O)C2=O,0.2138
CC1=NC2CC2O1,0.2611
O=CCC1C=CC2NC12,0.2214
c1cnc(c(c1F)F)O,0.2208
OC12CC1C(=O)C2,0.2299
CC1CC(NC=O)C1O,0.2737
O=C1NCC2CC1C2,0.2723
CN=C1CN=C(N)CO1,0.2457
CC(=O)C1CN2CC12,0.2142
c1c([nH]c(=O)o1)CC#N,0.2288
O=C1CC2CC2NC1=O,0.1796
N#CC12CC3C1C=CC23,0.2198
CC1=C(N(C(=O)C1)C)C,0.2037
CC12OCC1(O)CC2O,0.2883
NC(=O)C12CC(C1)C2,0.2645
C1C=CC2C3OC3C12,0.2637
CC12OC1CC21CCC1,0.3213
Cn1cc(ncc1=O)F,0.1547
CC1C(C)C1C1(C)CC1,0.3227
CC1CN2C=CC(N)=C12,0.2231
O=CC1CC23CC(O2)C13,0.2276
CC1=CC2CCOC2C1,0.2592
CC1=CC(=O)N2CC12,0.2001
CN=C1OCC2CC12,0.2688
N#CC1COCC=CC1,0.2586
CC1(CCO)CC2CC12,0.3316
c1c[nH]cc1NC(=O)N,0.2287
COC(=O)n1cnnn1,0.2347
CCCCC1C(C)N1C,0.2872
OC1CNC2=C1ON=N2,0.1792
C#CC1C2NC(C#N)C12,0.2533
CC(C)OCC(=O)C#C,0.1864
CC1=NC2C3NC3C2O1,0.2672
CC12NC1CC2C#N,0.2747
C1C(CO1)(CCO)C=O,0.2237
CC1(C)C2COC12C#N,0.2497
CC1(O)CC(C#C)C1O,0.2875
COCC(C#C)C#C,0.2947
Cc1cocc1OC,0.2369
Cc1c2c(c[nH]1)OCC2,0.224
CC1OC=NCCC1O,0.2581
C(=O)C(=N)N(C=N)C=O,0.186
CC#CC1OC1CC=O,0.2217
CC1N=COC1C1CO1,0.2696
O=CC(=O)C12CC(C1)O2,0.1484
CN1CC1(C)CC1CO1,0.3108
CC1COC11CN2CC12,0.2992
CCOC,0.3428
COC1CC(C1)=NO,0.2485
c1cn(c(n1)N)C=O,0.1777
CC1CC(CCC#N)O1,0.2992
COc1cc(c([nH]1)O)N,0.2192
CC12CC3C1N3C(=O)C2,0.2381
O=C1CC2C3NC2C3O1,0.2614
CCC(C)CC(=O)C=O,0.156
CC1=C(C)C(=O)ON=N1,0.1769
C1CC23CC1OCC2O3,0.3192
COC1CN=C(N)O1,0.2831
CC(C)N(C=N)C(=O)N,0.2492
C1C2CC3COCC3C12,0.315
CC1=NCC(O1)(C)C,0.2727
CC12CC(N1)(C#N)C2N,0.2559
COC12CC1N1CCC21,0.2834
OC(C#N)C#CC1CO1,0.2561
CC1(CO)COC2CC12,0.2967
CC1(CC1)C1NC1C#N,0.2782
CCC12CCC1C=CC2,0.2615
COC1C2CC2C1C,0.3222
CC#CC1(C)COC=N1,0.2665
OC12C=CCC1C1OC21,0.2556
C(CNC=O)C=O,0.2229
CCC1(CC)CC1O,0.3267
CN=C1OCC2NC12,0.2575
Cc1cc(=NO)cco1,0.1779
C1C2CC3NC3C1O2,0.3054
CC(O)C(C#C)N1CC1,0.284
OC1CC2(C1)C1CCN21,0.3045
CC1CCC2C3CC3C12,0.3149
OC1CC1N=COC=O,0.2127
CCNC(=O)C(O)C#C,0.2687
CN1CC(C1)NC(=O)N,0.2734
CCC12C3CC1=CCN23,0.1649
C1C2CC3OC3C12,0.3368
CC1C=CC(C)C1(C)C,0.2646
COc1c(non1)N,0.2179
OCC1OC1(C#C)C#N,0.2519
CC1C(O)C2OCOC12,0.3134
CN1C2CC(=O)C12C#C,0.2091
C1OC1C12CC3OC1C23,0.3054
OC12CC1(O)CC=CC2,0.2541
CC12C3CC4C(OC13)C24,0.3067
O=CC1CC2N1CC2=O,0.1932
CCOCC1CC1CC,0.3368
COCC#CC(O)CO,0.276
C(=N)Nc1nnon1,0.1944
CC1(O)C2C3C(O)C1N23,0.3015
C1C2C3C4C=CC2N1C34,0.2283
CC1(C)C2CN2C1CO,0.3041
NC(=O)C1OCC11CO1,0.2669
C#CCCCCNC=O,0.2824
CCC1CCC=C1CO,0.2594
C1COCC=C1CC=O,0.2061
CCC1CC1,0.3709
CC1(COC1)C1CO1,0.3164
CC1C2C3CCOC2C13,0.33
OC1C(=O)C=CC1=O,0.1553
c1nc(c2n1CC2)O,0.2303
COCC1N2CC2C1=O,0.2184
CCC1=CCC(C)C1=O,0.1954
N=COC12CC(C1)C2=O,0.2438
CC1=CCC2(NC12)C#N,0.2449
CCC1OC1CC(C)=O,0.2341
O=C1C2C3CC4C3C2N14,0.2203
OC12CCC3C(C13)C2=O,0.24
OC1C2(O)CC=CC12O,0.2152
CC1OCC1(C)OC=O,0.2626
OC12CCCC1=CCC2,0.2521
C1CC2(C1)CC1CC2C1,0.3688
OC1CC11CCC1C#C,0.2946
O=CC1CC(C1)C1CO1,0.2266
Cc1c(nc(o1)O)C#C,0.2054
CC1CCCN=C(C)O1,0.2544
CC#Cc1cc(no1)C,0.202
CC1COC11CC1(C)C,0.2974
O=C1CC2CC3C1N3C2,0.2149
C#CC1=NCC(=O)O1,0.2195
CC(C)(C)OCC#N,0.2971
C#CC12COCC1CO2,0.2709
c1cnoc1C2CCC2,0.2384
COC1C2CC(O)C1O2,0.2978
CC12CC1(O)C=CC2,0.2458
CC1CC2COC1C2O,0.3011
Cc1cc(cn1C)N,0.22
[O-]C(=O)C[NH2+]CC1CC1,0.2692
Cc1ccoc1NC=N,0.2065
CC1(CC(C1)C#C)C,0.305
CCC1(CO)C(O)C1O,0.2837
CC1(C)CC11NCC1=O,0.2065
CC12NC1(C#C)C1CC21,0.2737
Cc1c(oc(=O)[nH]1)OC,0.2401
OC12CCC1C2C1CC1,0.3186
CC(=O)C1CN(C1)C=O,0.2144
OCC1CC1C(=O)C#C,0.198
O=C1OC2(CC2)C2CN12,0.2764
C#CC(C#N)N1CC1,0.264
CNC1CC2OC12C#N,0.2318
CCC1=CC2(C)CC2C1,0.2426
OCC1C2C3C(O)C1N23,0.2944
Cc1c(occc1=O)C,0.2018
CCC1CC1CNC=O,0.2804
CC(O)C12CN1CC2,0.2939
ON=C1C2COC1C2O,0.241
COCCC(C)CC#N,0.294
C1CC1(C=O)O,0.2204
OC12CC(C1)C=CC=C2,0.1796
OC1C=CC2CCCC12,0.2599
ON=C1CCCC11CO1,0.2325
CC#CC1(O)C2CC1O2,0.2669
C1OC11COCC11CO1,0.3129
COC1CC2CC2C1,0.3275
C1OC1C12CC1C1CC21,0.2808
OC1(C=O)C2OC(=N)C12,0.2003
CC1=C2CCCC2CC1,0.2449
NC1=NC(CO)C2OC12,0.2401
CC1=CC(=NO)C2NC12,0.187
c1c(nc[nH]1)CCC=O,0.2124
CC(C)n1cnoc1=O,0.2455
CC1C2C3C1C2C3(C)C,0.3659
Cc1cc([nH]c1O)N,0.2275
COC=Nc1ccco1,0.1755
O=C1CN2CC1C1CC21,0.1976
Cc1cc(cc(c1)F)F,0.2344
CC1=CCC(O)CCC1,0.2518
C1C2NC2C2OC=NC12,0.2655
CCCC1CC1(C)C#N,0.3149
Cc1c(cc[nH]1)CC#N,0.2373
CC(C(=O)N)C(=O)N,0.2486
CC1C2CC(C)OC12,0.3152
C1CC2COCCC2O1,0.3333
CC1NC1COCC#N,0.2688
NC1C([NH3+])C1(N)C([O-])=O,0.1993
O=CC12CC1C=CCO2,0.213
C1CC2CCCC3C1C23,0.3264
COCC(N)C(O)C#N,0.2736
OC12CC1C1NC1C2=O,0.1947
COC(=O)C(=O)CO,0.182
CC1OC2CC1C21CN1,0.3137
CC1=CC2CCC1C2=O,0.236
C1C(=O)OC(=N1)CO,0.2499
CCC12NC1C(C)C2O,0.3005
CC1(C)C2C1C1CCC21,0.3091
C#CC1C2CC=CC12,0.2407
CC(C)CC1(CO1)C#C,0.285
CC(CO)C12CN1CC2,0.3027
C1CN(CC=C1)CC=O,0.182
CC1C2CC1(O)C21CO1,0.3177
CN1C2CC=C(CO)C12,0.237
O=C1CC(CC#N)C=C1,0.1923
CCOCCC1(C)CO1,0.3392
CC1C2C3OC3C12O,0.2857
CC(C)C1CC(O)C1O,0.3016
CC1C2CCC1C2CO,0.338
c1c2c(no1)COC=N2,0.2098
C1CC2=C(C1)C(=O)CC2,0.1962
CC1(CCCO)CO1,0.3383
COC=NCC(=O)C#C,0.1913
CCC12CC3NC3C1O2,0.3079
COC12CN3C1C(O)C23,0.3108
CCC12CC1C(C2)C#N,0.3009
CC1OC=NCC=C1,0.2322
CC1C2CC2C1O,0.3196
CCC#CCC1CN1,0.2947
O=C1COC2C3NC3C12,0.2068
CN=COC1OCC=C1,0.2458
COc1cnoc1OC,0.2068
CC(C)C(C=O)C1CO1,0.2253
OC1C2N3CC2(C#N)C13,0.279
CC(CO)C1(C)CCO1,0.3175
CC12CC(C)(C1)C(=O)O2,0.2752
CCC12CC1N(C)C2=O,0.2465
CCC1OC(C)OC1=N,0.2906
c1c(cn[nH]1)C#CCO,0.2208
c1c(nnc(n1)N)C#N,0.1658
OCC(O)C1CCCC1,0.3175
COC12CN(C1)CC2=O,0.1931
CC1CC11C=CC2OC12,0.2345
CC12C=CC3C(N13)C2=O,0.1893
CCC1(CO1)C1CO1,0.3416
Cn1c(ncn1)OC=O,0.2324
CC1=NCC(=O)N1,0.2348
CC(=O)Cc1cc[nH]c1,0.2057
CC(CNC(N)=O)C=O,0.2232
COC(=O)C1CC1C#C,0.2538
CC1C2CN2C(=O)N1C,0.2764
CN=C1NC(=O)NN=C1,0.1804
CCN1CC(=O)C1C,0.2079
CCc1cc(on1)CO,0.245
C1CN(C1)C(C#N)C#N,0.2431
N=C1NCC(C#C)C1=O,0.1848
NC1=CNC(F)=CC1=N,0.1824
COC(=O)C1NC1C#C,0.2516
OC1C2(O)CCC12C#C,0.2544
CN1C2C3CC3C12C=O,0.1995
O=C1CN2CC3CC2C13,0.195
N=C1NC2=C(N1)N=NN2,0.1928
C#CC1C=CC2CN12,0.2312
CNCC(=O)OCCO,0.2369
C#CC12OC1CC1CC21,0.2723
CNC(=O)C1CN=CO1,0.2588
OC12CC(O)(C1)C=CC2,0.2516
CC12CC3(CO)C(O1)C23,0.2913
C1CC1C(=O)NC(=N)N,0.2181
COCC1(CC1)O,0.3238
CC(=O)C1CC2NC12,0.221
CC#CC(C#C)C(N)=O,0.2587
CC1N2CC1(O)C2,0.3115
CC1CN1CC1(C)CC1,0.305
CCC1=CCOCC1,0.2596
CC12NC1C(=O)OC2=N,0.2355
c1c2c(no1)N=COC2,0.2165
OCCC(CO)C1CO1,0.327
N=C(OC=O)C(=O)C#N,0.1624
CCCO,0.3429
CC1NC1(C)C(=O)C#N,0.1804
OC1C2C3C1C(O)C23O,0.3099
OC12CCC1C=CC2=O,0.1879
CC(CC(C)(C)O)C#N,0.3235
c1c[nH]cc1OCCO,0.2418
c1c(c(c([nH]1)C=O)N)O,0.1712
CC1=CC2(O)CC2(C)C1,0.2416
CC(C#N)C(=O)CC=O,0.2071
OCC1(CO)C2CC1C2,0.328
N=C1C=NON=N1,0.1747
CC1(CC(C1)(C#C)O)C,0.2871
CC1(CC#C)C(O)C1O,0.2765
CCC#CC(C)COC,0.302
COC1CCC(C=O)=C1,0.1904
OC1CCC(=O)CNC1,0.1993
CC1CCC(C=O)=C1C,0.192
O=CC12CN1C1CC21,0.1944
CC1CC1(C)C1CC1O,0.3098
C1CC2C1C1COC21,0.3064
Cc1c(oc(n1)C)NC,0.2135
COC1CCCC2CC12,0.3205
CN(C)CC(O)C#N,0.2686
C1C2OC3CCOC2C13,0.31
C1C2C3OC4C1OC4C23,0.3091
O=CCC12CC=CC1N2,0.2107
O=CC12CC(C1)OC2,0.2182
OCC1(CC2CN12)C#C,0.2701
N#CC1=CC2CCC2C1,0.2172
OC12CC3C4C(C13)N4C2,0.3021
CC(O)(C=O)C(=O)CO,0.204
CC1OCCOCC=C1,0.2328
C1CC23CC(C2)C=CC13,0.2478
CC(C)C1CN(C)C1=O,0.2784
CC(C)OC1(CC1)C,0.322
O=C1CCC11C2COC12,0.2066
CC#Cc1cn(cn1)C,0.2152
CC1CC2OC(=N)C12,0.2826
CCC1(CC1)C#C,0.2959
c1cc(ccc1N)N,0.1817
c1c[nH]c2c1NCCO2,0.2286
CN1C(CO)C11COC1,0.2931
NC(=O)CN1C2CC1C2,0.2699
N#CC1CN2N=CN=C12,0.2685
CC(C)(O)C1(CO1)C#N,0.2835
COC1(CNC1=N)C#C,0.2502
CCn1ccnc1CO,0.2396
OCC12CCC(O)C1N2,0.3089
CC(C1CO1)C1(O)CC1,0.3329
CC1C2OC2CC1=NO,0.2537
CC1OC1CC1CC1O,0.3078
CC1(C)C2CC3(OC3)C12,0.3317
CC1(CC(=O)CC=C1)C,0.2241
C(C#CCO)C(=O)N,0.2661
CN1C2C3CN(C23)C1=O,0.2498
CCn1nc(nn1)O,0.2355
CC(CCC=O)C(C)=O,0.2225
OC(C#C)C(C=O)C=O,0.2126
CC1C2C3C(N13)C2=NO,0.2436
C(CNCC=O)C#N,0.2215
CCC1NC(C#N)C1=O,0.2178
CC#CC#CC,0.2291
C#CC1C2CCC12C#C,0.2571
c1c(c(n[nH]1)N)NC=N,0.2154
CC1=CC(=O)C(=NO)C1,0.163
CCC1(C)OC(C)C1O,0.3005
CC#Cc1nc(on1)C,0.2174
CCC1CNC(=O)C1,0.2738
CCC1NC=NC1C#N,0.2483
CC(C)C#CCN1CC1,0.2761
C1OC1C1=CN=CC=C1,0.2247
C(=O)c1c(non1)N,0.1783
CCC#CC#CC(C)C,0.2258
C#CC(=O)N1CC(C1)O,0.2204
CC1NC1(C=O)C1CN1,0.1939
CN(C=O)C1C(O)C1O,0.2652
COC(CN)(CN)C#N,0.2567
CCC(=O)CCO,0.2353
Cn1cnc(=O)nc1O,0.2131
CCC(O)C(=O)COC,0.2093
O=COCC1(CN1)C#C,0.2667
CC(NC(N)=O)C1CO1,0.3024
CC(O)C(=O)C(=O)CO,0.1616
Cc1nc(no1)C(=O)C,0.1938
COC1OC2CC1C2,0.3461
OCCC12CC3CC1C23,0.3222
OC1C2CC(OC=O)C12,0.2607
O=C1C2OC2C2COC12,0.186
OC12COC3CC1C23,0.3009
CC1C2N1CCC21CC1,0.3106
CC(CO)N=COC=O,0.2385
N=COCC1CC1C=O,0.2284
CCC1(C)NC1(C)C#N,0.2783
CC1C=CC23CCC12N3,0.2124
C#CC12CN1CCOC2,0.2628
CC(CO)N1N=CC=N1,0.2582
CNC1=NNC=NC1=N,0.1861
CN=C1OC(C)C11CC1,0.2711
CNc1nc(=O)onn1,0.1666
OCC1CC2C(C#C)N12,0.259
CC1OCC(CC=O)O1,0.2261
C1Cc2c([nH]nc2O)C1,0.2461
CC1C2CC2(O)CC1=O,0.2197
CC1C2CC(C)C12O,0.3175
CN=C1OC2C3OC2C13,0.2547
c1c(cn(c1N)C=O)N,0.1657
OCC12CN1CC1OC21,0.2935
OCC1CN1,0.3113
CCNc1cnc([nH]1)O,0.2426
CCNc1c(cco1)N,0.2161
CC1(C)NC1CNC=O,0.2785
CC#CC(C)C(C)C=O,0.2208
c1c(c[nH]c1CO)CO,0.2329
CC1C(CC#C)OC1=O,0.2777
CC(O)(CCC#C)C#C,0.2879
CC1=CC(O)C=CCC1,0.2286
OC12CC1CC2N1CC1,0.2811
CC1(CC#N)CC2CN12,0.2791
CC12OC1C1=CCCC21,0.2383
Cc1cnn2c1CC2,0.2577
CC1C=CC(C)C1C=O,0.213
CCC(C)OC(C)CC,0.3244
OC12CC1C1OCC21,0.312
CC1OC1C1=CN=CN1,0.2394
C1CC(C1)(CC#N)CO,0.29
OC(C#N)C#CCC#N,0.2762
CC(C)c1nc[nH]n1,0.2693
C1CC1(CO)C=O,0.2286
O=CC12OC1CC1NC21,0.2102
C1CC11OC2CC2C=C1,0.237
CC1C(O)C=CNC1=O,0.212
c1cc(c(=O)oc1)C#N,0.1629
CCCOC1CC2OC12,0.3271
CC1C2C(C)CC12CO,0.3178
CC12CCC1C(C2)C#C,0.2985
CC1C=C(C)C(C)C1=O,0.2214
C1CCC2(C1)CC(=O)O2,0.2844
OCC1CC(C#N)C1=O,0.2172
CCC12CC1(CO2)OC,0.3032
C#CC1=CCOCCC1,0.2029
OCC12CC(C1)N=CO2,0.2636
CC1CN2N=NC=C12,0.2602
C1C2C3C(N12)C31COC1,0.3161
CNCC1(CCO1)C#N,0.2408
O=C1COC11CC1C#N,0.2166
C1C2OCCC3OC3C12,0.3156
C1C2C3C4C3N3C2C3C14,0.3165
OC1C2OC(=N)C1C2=O,0.2
C1OC2C1C1COCC21,0.3077
C1C=CC2(CO1)COC2,0.2547
CC1C=CCC1CC#C,0.2636
CC1[NH2+]C(C1N)C([O-])=O,0.2568
C(C1CC1)C1C2COC12,0.3124
CC1(C)CC1(C)CO,0.33
CCC(O)(CCO)C#N,0.2916
CCC1=CC(=O)CCC1,0.1885
CCC12C3CC(C13)C2C,0.3255
CC1C2CC(O)C12C#N,0.2812
CC1(CC1)c2cnn[nH]2,0.2505
O=C1CC2CC=CC2O1,0.2564
O=C(C#C)C1OCC=C1,0.1766
O=C1NCC2CN12,0.2896
N#CC1C2CC3CC1N23,0.2608
CC(C)(C#C)C(O)C#N,0.2812
C1C2OC3=CON=C3C12,0.2188
COC1CNC=CC1=O,0.1847
CCC(O)C12CCC1O2,0.3138
CC(CO)C(C=O)C#N,0.2239
O=CC1C2C3N2CC=C13,0.1591
C1C2C3CC4CC13C2O4,0.3291
CC12CC3C4CC1C4C23,0.333
O=C1COC2C(C#C)C12,0.2119
CC1=CC(=O)C(=O)CC1,0.1497
OC1CNC1C#CC#N,0.2125
OCC1=C2COC2CC1,0.238
CCc1cnnn1C=O,0.2025
OC(COC=O)C1CO1,0.2781
CC#CC1(O)CNC1=O,0.2452
CC1(OC1C#N)C(N)=O,0.2397
CNC(=O)COC,0.2727
CN1C2C1C1C2CC1=O,0.2037
CC1CCC(CO)O1,0.3231
CC12OC(C=C1)C(=O)O2,0.2231
CCc1cc(on1)N,0.2327
CCC1(C)C2C3CC2C13,0.3636
CC1=C(NN=N1)C1CN1,0.2384
CC1(O)C2CC1C(=O)C2,0.2285
O=CC12CCC1C(=O)N2,0.2118
CC1OCC(=O)C1C,0.2191
N=C1CC2NC2C(=O)O1,0.2431
CC(C)C1COC1=N,0.2896
COCC1NC1C(C)O,0.3146
CC1=NC2C(O1)C2(C)C,0.2521
NC(=O)CC12CC(C1)O2,0.2757
CNc1c(oc(=O)[nH]1)O,0.2372
CCNC(=O)C1CO1,0.2649
C(CC#CC#N)CC#N,0.2457
CC1=CC2COC1(C)C2,0.2491
O=CC1OC2OC1C=C2,0.2205
COCC#CCC1CC1,0.2833
OC1CC1COC=O,0.2851
CCCC1(CN1)C(N)=O,0.2648
Cc1nccn1C(=O)N,0.2118
CCC1C2CC1OC2,0.321
CC1C=CC2=NOC=C12,0.2146
O=C1C2CCC1C=CC2,0.2176
CC12CN1CC1OC21,0.2943
CC1OCCCCCO1,0.3405
c1c2c(ncn1)CCN2,0.1843
CC(CN1CC1C)C#N,0.2817
OC(C=O)C(=O)N1CC1,0.2087
O=CC1C2N1CC21CO1,0.2166
N#CC1CC2=CN=NN12,0.2499
CCCCOC1CC1O,0.3021
CCC1OCC2CC12,0.3352
CC1CC2OC2(C)C1C,0.3265
ON=C1C2NC2C11CO1,0.2294
CCC(C)CCCOC,0.3336
CC1C2CC1C2OC=N,0.2806
CN1C=NC=C(F)C1=N,0.1802
c1c(c(n[nH]1)N)N(=O)=O,0.1584
OC1CC11CC2C(O)C12,0.2946
C1OC1C1C2OCOC12,0.3119
CC12COC3C1OC23,0.3074
CC12OC1C(C=C2)C#N,0.2441
CCC(OC)C(=O)C=O,0.1432
CC1C2OC(C#C)C12C,0.2529
Cn1cnc(c1OC)N,0.223
C1CC2CCC1CCC2,0.3478
COC1C2CC2C1(C)O,0.318
CC1COC(C=C1)C#N,0.264
CCC1CC2NC2CO1,0.3106
CCN=c1[nH]cc(o1)C,0.2178
CN(C)C1COC1CO,0.2775
OC1CC1OCCC#C,0.2809
CCCc1[nH]nc(n1)C,0.2655
CCc1ccc(cc1)C,0.2324
CC1N2C(=O)NCC12C,0.2834
OC1C2CCC(C2)C1=O,0.2181
Cc1cncc(n1)NC,0.1785
OCC#CC(O)CO,0.2789
CC(=O)C1NC1C1CC1,0.2217
CC(C)(O)C(=O)C1CN1,0.2238
O=C1C2C3NC1(C#C)C23,0.2235
CCC1(CO1)C#N,0.3021
Cc1cc(c2n1CC2)O,0.2259
CC[NH2+]C(CO)C([O-])=O,0.2614
CC1CC2C(O)C2(C)O1,0.3075
OC1C(O)C(=O)C1C#C,0.2101
C1CNC(=O)C(=O)C1=O,0.135
CCC1C2C(O)C2C1O,0.2814
c1c(c([nH]n1)O)C2CC2,0.2515
CCOC1CCCC1=O,0.2002
OC1(C#N)C2COC12,0.2623
O=C1C2C3C2C1C3C#N,0.238
c1c(c[nH]c1C=O)N,0.1569
CC(=O)CC1(CC1)OC,0.2265
CC1C(O)C2COC1O2,0.3081
CC1C(C)(O)C1(C)C=O,0.2268
CC1C(CC=O)OC1=N,0.2249
O=CC(=O)C1(CN1)C=O,0.1598
O=C1C2C3CN4C3C2C14,0.1962
CCC12CC(O1)C1NC21,0.3035
C1C(CO1)(CCO)O,0.3112
CC(CC#C)CC#N,0.2934
C#CC1OC1C1CO1,0.2772
NCC1=NC(=O)N=NO1,0.2028
c1c(c(c([nH]1)N)O)O,0.2206
CC12OCC1C2(C)C=O,0.2131
OC1C2OC1(C=C2)C#C,0.2442
COC(=N)N1CCN=C1,0.2308
c1cn2c(n1)NCC2=O,0.1815
CN=C1NC(C)C1(C)O,0.2553
CC(O)C1=NN(C)N=N1,0.243
N#CC1=NCC2CCN12,0.1938
CCNC(CC#N)C=O,0.2003
CN1C2C3OC(=O)C2C13,0.2261
Cc1ccc(nc1C)C,0.222
C1OC2C=CC=CC=C12,0.1733
CCOC1CC=CC1=O,0.1714
C#CC1C=CCCC=C1,0.2534
CC1(C=CCCO1)C,0.2663
C1OC11CC2OC=NC12,0.261
COCCC(=O)N,0.2795
CN1C(C2CN2)C1(C)C,0.2974
CC12CC(C)(O1)C1NC21,0.3052
CC12NC(CC1O)C2=O,0.2324
CC1(C)CC11CC2NC12,0.3039
Cn1cc(nc1)CC#C,0.2496
OC1C=CN2C1CC2=O,0.2149
C1N2CC11OCC3C2C13,0.2742
OC1C2CCC1(O)C=C2,0.2585
O=C1C2CCC1OCO2,0.1979
C(=O)Nc1n[nH]nn1,0.2258
CC12CC1CCC2C=O,0.2228
CC(C)(C#N)C(=O)C=O,0.1559
CC#CC1C2CCOC12,0.2675
OC12C3C4C1C4(C#N)C23,0.2559
CC(C)C1CCC1(C)O,0.3246
c1c([nH]nc1O)C2CC2,0.2385
c1c2c(c[nH]1)nn[nH]2,0.1814
CCC1=CC(C)(O)CC1,0.2545
N=C1OC2C3N=CN1C23,0.2208
O=C1NC23CC12CCC3,0.2558
C1Cc2c([nH]nc2N)C1,0.2344
CCC1(C)CC1OC=O,0.2712
CCCC(C=O)C=O,0.2032
CC1CC(C)=CC11CO1,0.2471
N=COCC1=NNN=C1,0.2526
CC1(CN1)C1COC1=N,0.2756
CCC1CN1C,0.3065
OC12C3C1C1=CC2N3C1,0.1027
CC1(C)CCC1C=O,0.2181
C1CC(=O)CC(=O)C1,0.2106
O=C1CN2C3CC3C12,0.2045
N#CC1C2NC2C2OC12,0.2967
CCCC1(C)OC1C=O,0.2155
CC12C3CN1C(=O)C23O,0.2344
CC(C#C)C1CCCC1,0.3125
CN=COc1cnon1,0.2176
COC1=NC(C)CN1,0.2753
CC12CN3C4C(C1)C4C23,0.2844
CC(C)OCC(C)C#N,0.3053
CC1C2C(CO)C1C2=O,0.2502
CC1OC2CC2N2CC12,0.2915
O=C1NC23CCC2CC13,0.2628
C1CC2(C1)CCC(=O)O2,0.2771
c1c2c(on1)OCC=C2,0.1881
CC12CC1OC2(C)C#N,0.2669
OC1CC23COC12CO3,0.2691
N=C1COC(=N)C(=O)O1,0.2137
O=COC12CC(C1)C=C2,0.2359
CCCC(O)(CC)C#N,0.3111
CCC1C(O)CC2CN12,0.2899
CC(C=O)C1=NC=NO1,0.2152
COc1nc(on1)C=O,0.1811
CC1C2CC(CN12)C#N,0.2694
O=CC(C#N)C1COC1,0.205
CC(CO)C(C)(O)C=O,0.2166
CC1CNC1(CN)C#N,0.2693
CC1=NC=C(F)NC1=N,0.1669
CNC(=O)N(C)C=N,0.2527
Cc1ccccc1CO,0.2365
CC1CN1C(C#C)C#N,0.257
O1C2C3C=CC4C1C2N34,0.2099
OC1C2OC2C1(O)C#C,0.2765
Cc1c(non1)C#N,0.2338
COC(COC=N)C=O,0.213
O=C1CC23NC(C=C2)C13,0.1886
CC1=C(CO)C(O)CC1,0.2462
CN1C2C=CC(=O)C12,0.1659
CC1=C2NCC2NC1=O,0.2035
OC(C#N)C1CC2CC12,0.2807
c1c2c([nH]c1N)[nH]nn2,0.2025
CN(C)c1cnco1,0.2147
CC12CC1C(C)(C)C2=O,0.2245
COCc1cc(c[nH]1)O,0.2236
CNC1(CO)COC1=N,0.247
Cc1c[nH]c(n1)CC#N,0.2426
OC12C3CC1(OC23)C#N,0.2473
CNc1nc(c(o1)N)N,0.2171
CC1NC1C#CC(C)=O,0.2052
CCC(OC)C(O)C=O,0.2148
N#CC1NC1C1CCC1,0.289
COC1C2CC1(C)C=C2,0.2408
OC12C=CC3OC1C2O3,0.2305
CC1(C)OC2C3CC1C23,0.3059
O=C1C2CCC3CC2C13,0.2222
C1CC1N(C=O)C(=O)N,0.2385
Cn1nc(c(n1)N)C#C,0.1946
CC1CC1N1C=NC=N1,0.2658
CC1=CC2(CO2)C2OC12,0.2312
Cc1c(nc[nH]1)N(=O)=O,0.1892
CCC1(COC1)COC,0.3084
C#CC12CC3CC3C1O2,0.2739
CNC1(COC1)C#N,0.267
c1c(noc1NC=N)O,0.2098
OC12C3NC1C=CC23,0.2274
CC1(C(=O)C(=O)CO1)C,0.1339
N=C1OC=CC(=N1)C#C,0.1516
C1C2OC3=CNC=C3C12,0.2319
CC#CC(C#CC)OC,0.2671
C1N2CC3C4OCC13C24,0.3029
OCC12CN1CC21CO1,0.3104
COC1CCC(C)C1O,0.3224
CCOc1cc(oc1)C,0.2288
c1c(noc1N)CCO,0.2345
NC(=O)C(O)(C#C)C#N,0.2487
O=C1OCCC1C#C,0.2602
NC1(CNC1=O)C1CN1,0.2595
CC1OC2CC12CC#N,0.2729
CCOCCCCOC,0.3391
C1CCC2(C1)C(=O)CN2,0.2147
C1CC23NC2C=CCC13,0.235
CC1=CC2NC(C1)C2=O,0.2187
COC1C2NCC12OC,0.2847
N#CCC1CCCC=C1,0.2645
CC1C2C3N2C2C1C32O,0.2931
CC#CC1NC1C=O,0.2143
CCC1(CCO1)C(N)=O,0.2632
O=C1CC2OC1C2C#C,0.2106
Cc1[nH]c(cn1)C=O,0.1868
Cc1cc(c(n1C)C)O,0.2192
CC1(NC(=N)C1O)C=O,0.212
CCCc1cnc(o1)O,0.2415
OC1CC2=CCC3C1C23,0.2208
COC1(CC1)CC(=O)N,0.2728
Cc1c(nn(n1)C=O)O,0.1994
CC1=CCCC1N1CC1,0.2565
OCC12CC=C3CN1C23,0.1722
CCC1=CC(=O)N=NO1,0.2026
CC(O)C1(CC1)C1CO1,0.334
c1c(nco1)NC2CC2,0.2125
NC(=O)C1(O)CC1C=O,0.2174
CC12CC1(C)C1NC21,0.3236
CC1(CO1)C1(C)COC1,0.3102
N#CCC1C2CCCN12,0.2705
FC(F)(F)COC=N,0.2903
CN=CNC(=O)CC=O,0.2163
CC(=O)c1cncnn1,0.1571
CC(NCC#N)C=O,0.2181
CC1COC(C)C2OC12,0.3386
N#CC1=CCCC2OC12,0.2128
CC(CC(=O)C#C)C#C,0.1972
OC12C3OC3C1OC2=O,0.2576
C1C2NC2C2=CNN=C12,0.2473
CCN1C2CC(O)C12,0.2944
CC12C3C4OC1(C)C4N23,0.3076
C1C(=O)OC12COC2,0.2679
O=CC1=C2COC2CC1,0.1852
CCc1c[nH]c(=O)o1,0.2385
CC1CC2CC12C(C)=O,0.2251
C#Cc1c([nH]nn1)C=O,0.1737
CCN1C2C3C2C(=O)C13,0.215
OC1C(=O)CC11CCC1,0.2218
CC1C2OC2(C)C1=O,0.2127
CCCC12CC(CC1)O2,0.3251
COC1C=CC2CC1O2,0.2329
C1OC1C1CC2OC12,0.3342
CCC#CC1(CCC1)O,0.2809
OCCC1(CCO1)C#C,0.2777
CC1(OC(=O)C1O)C#N,0.2586
COC(C#CC)C(C)=O,0.2074
CC1OCC1OC(C)=O,0.2593
C1CC12C=CCC2=NO,0.2265
N#CC12CC1CC1NC21,0.2867
c1cnc(nc1CO)F,0.2174
NC(=O)N1C2C3CC3C12,0.2562
OC12CC1C1=CCCC21,0.2368
COC1CC1(O)C#N,0.2687
Cc1cc(c(o1)C)OC,0.2119
OC12C3C1C1CC2C3O1,0.3137
OC1CC11CCOCO1,0.3216
O,0.3615
CC(C)(C)C#CCOC,0.2825
N=C1C=CN(C=O)N=C1,0.1671
O=C1CC(=O)C2CC2O1,0.2237
CCC1C2CC3CC1N23,0.2899
CC1CC(C)C2(C)OC12,0.3347
CC1CC11CN(C)C1=O,0.275
OC1CC2CN2C1=O,0.2366
OC1CC(=O)C1OC=N,0.2077
OC1CC2CC2C=C1,0.252
CN1N=NC(C)=CC1=N,0.1648
CC(O)(CCO)CC#N,0.2972
CC#CCOC(=N)C#C,0.224
C1CN1C1=NC2CC2O1,0.2586
CC#CCC(=NO)C,0.255
C1CC23OCC2CCC13,0.3063
CCC1CC1C(N)=O,0.273
C1C2CC11NC1C=CC2,0.2496
CN=COCCC(C)O,0.2729
C1C2C1C1OC2C11CC1,0.3186
O=C1OCC2C3OC3C12,0.2657
CNc1nc([nH]n1)OC,0.2426
CCC1COC1CCO,0.3201
CC(O)C1CC2(C)NC12,0.2937
C1C(CO1)OC(=O)C=O,0.1704
CN1CC2(OCC12)C#N,0.2291
CC12CC1OC2(C)C#C,0.2646
CC1CC(C2CO2)C1O,0.3202
OC12CN(C1)CC1OC21,0.2852
COc1cnn2c1CC2,0.2345
OC1CCC2=NON=C12,0.2418
CC1C=CCNCC1=O,0.2049
O=C1OC2COC1CO2,0.2566
CC12CN1CC(=O)OC2,0.2431
C1CN(CCC1=O)C=O,0.2237
OC1C2C3CC(=O)C1N23,0.2192
O=C1C2CC3NC3C1O2,0.2344
O=C1CC2CC12C#C,0.2267
N=C1OCOC1CC#C,0.2714
O=C1C2NC1C1CC21,0.2318
[O-]C(=O)C1CC(=[NH2+])N1,0.2497
CNc1c[nH]nc1NC,0.2259
N=C1CCC(=O)CO1,0.2186
O=C1NC2C3NC=C1C23,0.1632
CCC1(C)C=CC2CC12,0.248
CC1(C=O)C2CC1C2O,0.2311
CC(C=O)C1C(C)N1C,0.1982
CC(C#N)C(C#C)C#N,0.2935
N=C1NC=NC2COC12,0.2192
CC1=C(CCC1)CCO,0.2519
CC#CC(CO)C=O,0.217
CC1OCC2OC12CO,0.3182
C1NC1C1=NNN=C1,0.2459
CCC1NCC1=O,0.2184
CCC1CNC(=N)C1=O,0.185
c1nc2n(n1)C=CC2=O,0.1459
O=C1C2CC(C2)C2CN12,0.2394
CCOC1C2CC1(C)O2,0.3138
CCC1C2OC3(CC3)C12,0.3015
CC12OC1C=CC1OC21,0.2374
C1OC11CC2OCC12,0.3093
NC1=NC(=N)C(F)=CO1,0.209
COC1CN(C=O)C1C,0.2647
CC12C3OC1CC23C#N,0.2663
CC1(C#N)N2CC1(O)C2,0.271
CC1C2OC=NC12C#C,0.2465
c1c2c(co1)C=CC2,0.2001
Cc1ccc(cc1O)N,0.2083
N=C1OC2(CC12)C#C,0.2507
CC(C#N)C1OCC1O,0.2923
OC1CC2OC3C2NC13,0.2856
CCc1c(c(n[nH]1)N)N,0.2239
OCC1CCC1C#C,0.3014
C1C=CCC2OC1C=C2,0.2482
CC1=CC2C3C1N=CN23,0.223
C1CC23CCC12OC=N3,0.2563
CC12CC3C1NC23C=O,0.2046
Cc1nc2conc2o1,0.2085
CC1(C#C)C2CN1C2,0.2586
Cc1c2c(cno2)on1,0.2094
OC1CC2CC1C(=N)O2,0.2824
CC12CCC1OCC2=O,0.21
CCC1CCC(CO)=C1,0.2575
CC12CC(C1)C2(O)C#C,0.2866
NC1=C(F)C=COC1=N,0.1611
O=COC(CC#C)C=O,0.2184
CC12C(O)CN1CC2O,0.2616
CC1=CC2OC1C2(C)C,0.231
CC(O)C1CC2C1N2C,0.3037
N#CC1=C2CCC2CC1,0.2073
CC1OC11COC(C)C1,0.324
CC12CC3(C)C4C1C2N34,0.2911
O=CC1C2C=CC(=O)C12,0.1743
CC1(COCC1=O)C#N,0.211
CC1(CC(=O)C=C1)C#C,0.1903
C1C2C=CC3=CCOC123,0.1843
CC(=O)OCC(O)C#N,0.2846
CC(CC(C)C#C)C#C,0.3021
OC(CC#C)(C#C)C#N,0.2587
Cc1c2c(n[nH]1)onn2,0.1926
CC(CO)(C#C)C#N,0.2873
O=CCC1(CN1)C1CO1,0.204
O=COCC1C2CC1O2,0.2537
CC1CCOC2C(O)C12,0.3071
N#CC1C=CCC2OC12,0.267
CC12C3C(O)C1CC23O,0.3099
CCC1=NNN=CC1=N,0.1802
c1c(c(n[nH]1)C(=N)N)N,0.2003
Cc1c(nc([nH]1)NC)O,0.2222
CC1(O)C2CC1C21CC1,0.3347
Cc1c(n[nH]c1C=O)C,0.1916
CCC(C)C1=NC=NO1,0.2629
c1nnn(n1)C=O,0.2093
CC1N2CC2C1(O)C=O,0.2052
CN1CC11CCOC1=O,0.2454
CCc1coc(=O)cn1,0.1656
N#CCC1(CC1)C1CN1,0.2825
C1CC2COCC2O1,0.3163
CC(C)C(O)C(=O)C=O,0.1526
CC1C2(C)OC2C1(C)C,0.3269
CC1CCCCC2CC12,0.3316
OCCC(O)C#N,0.2894
CC1C2C1C(O)C2O,0.3048
CC1C2NC2(C#C)C1=O,0.2115
O=C1OC2OC1CC=C2,0.244
Cc1c(cn(n1)C)C#C,0.2226
ON=C1CC2CC2C=C1,0.1874
O=C1NC(CO1)C1CC1,0.3135
COc1cc(=O)nco1,0.2086
CC1=C(COC1)C,0.2486
Cc1cncc(=O)[nH]1,0.1696
OC1CC11COC1=O,0.2752
OC12CCC1C2(O)C=O,0.2071
c1c(nc([nH]1)O)CCO,0.2515
CC1(CC2CN1C2)C=O,0.2151
NC1=C2C(O)CN2N=N1,0.2164
CCN(C(=N)C)C(=O)N,0.2455
COC1(CC1C#C)C#C,0.2612
COC1C2C3CC1(C)C23,0.3307
CC1C2NC2(C#C)C1C,0.2547
OC1C(OC11CC1)C#C,0.253
OCC(O)C1(CO)CO1,0.3191
CC1CCC=C1CCO,0.2545
CC(C#N)C1(CN1)C#N,0.2798
C1C2C3COCC1CN23,0.292
C1CCCC2(CC1)CC2,0.3334
c1c(n2cnoc2n1)N,0.2042
COC(CN1CC1)C=O,0.2037
CCC1CC(O)C(=N)O1,0.277
CCC(=O)OC(C)C,0.2858
CCN1C2C3CC3C12,0.2778
Cc1cc(c([nH]1)C#N)N,0.1908
CC12CN1C(C#N)C2=O,0.2183
CC1CC(OC1=N)C#C,0.2844
NC1=CON=C1C1CN1,0.2091
CC1OC(=N)C2OC12C,0.2672
CC#CCCC1COC1,0.3003
CCC(=O)C(C)(O)C=O,0.1971
CCC1C2OC1C2(C)O,0.3277
C#CCC1CCCC=C1,0.264
CC1OCC2=CNC=C12,0.2443
COCC1NC11CCC1,0.3137
CC1C2CC3(O)C2C13C,0.3066
CCOC(=O)C1(C)CO1,0.2619
C(C#CC#CCO)C#N,0.2125
CCC(C)CC(O)CC,0.333
CC(=NCCC#N)OC,0.2733
CC12C3CC(C)(N13)C2=O,0.2329
CCNC(C=O)C=O,0.2025
NC1=CC(=O)C2(O)CC12,0.1932
COC1C2NCCOC12,0.2716
CC1C2C(C=O)C(C)N12,0.1987
CNC1C(O)C1(O)C#N,0.2145
CCC1CC11CC2CC12,0.3326
C1C2C3C4CN2C13CO4,0.3209
c1c([nH]nc1O)OC=O,0.2122
Cn1nc(nn1)COC,0.2343
C1CN(C1)CC#CC#N,0.196
O=C1COC2CCC2C1,0.2129
C1CC1c2c(nn[nH]2)N,0.2111
CC(C)C12CC(C1)C2C,0.3573
COC(C)C1=CC=NN1,0.2586
NC(=[NH2+])NC1=CN=N[N-]1,0.1813
OC(C=O)C(=O)CC=O,0.1886
OC1C2CC1OC2,0.2991
CC1OCC=CC11CO1,0.2441
CNC1(COC1C)C=O,0.2053
CC1OC11CCC11CC1,0.3251
c1cc-2ncnoc2c1,0.1154
N#CC1C2COCC1N2,0.2681
CC#CC1CCOC1=O,0.254
CC1COC2C(C#N)C12,0.2763
FC1=C(F)N=CC(=N)O1,0.1496
CCOC(CC)C1CC1,0.3299
CC(C)C1C2C3NC3C12,0.2751
CN=C1CC2(CC2)CO1,0.2747
CN=C1NN=NC=N1,0.1487
CCC12C3N1CC2C3=O,0.2275
CN1CC(C#N)C11CC1,0.247
COC(=N)NCC#N,0.2656
Cc1c(c(c[nH]1)C=O)O,0.1808
OC1CCC2C3CC12C3,0.332
N=COCCC#C,0.2835
OCC1NC1(CO)C#C,0.2698
CCCN(CCC)C=O,0.2698
Cc1ccn(c1CO)C,0.2311
C1C2CCCCC=CC12,0.2378
O=C1C2C3C2C2(CO2)C13,0.243
Cc1c(n[nH]c(=O)n1)C,0.1737
CC(N)=[NH+]CCC([O-])=O,0.2422
C1C2CC3C=CC1C3O2,0.2514
COc1cncnn1,0.1694
O=C(OCC1CN1)C#N,0.1967
Cn1cc(cn1)O,0.2325
c1[nH]c2c(n1)CCC2,0.2388
c1cnn(c1N)C=O,0.1901
CC1=CC2NC2C1C#C,0.2412
c1[nH]c2c(n1)CCOC2,0.243
CC(CCO)NC(C)=O,0.2772
CN=C1C2C3N=CN1C23,0.2074
CC(C)(C)NC(=N)C=O,0.1672
CC1COC1(C=O)C#C,0.2075
C1C(=CC(=NO)CO1)N,0.1852
CC1(CC1(C)C#C)C#C,0.2747
CCCC#CCC,0.2988
CCN1CC2(CC12)OC,0.2935
COC1CCC1=NO,0.2436
OCC12NC(=O)C1C2O,0.2527
CC1C2(C)C3OC2C13O,0.2884
C1COCOC(=O)N1,0.287
CCC(C)C1=COC=C1,0.2426
C#CCN=c1occo1,0.235
CC12CN3C(CC13)C2=O,0.2052
OCC(O)C1=COC=C1,0.2411
N#CC1C2OC(C#N)C12,0.2672
CC1COC2=C1N=NN2,0.2271
CCC#CC(=NO)C#C,0.1783
CC12CN3CCOC1C23,0.2811
CC1CN=COC1=O,0.2493
CC1(CCC1)N(C)C=O,0.265
C1OC11C2C3N2CC=C13,0.1685
CC1=NNN=CC1=N,0.18
OC1(CC2CC12)C1CN1,0.2977
COC1C2NC(C=O)C12,0.2113
CC1(CC(=O)C1)OC,0.2213
c1c(c2c([nH]1)CCO2)N,0.2198
CC12CNC1(CO2)C#C,0.2464
CC1CCC1OC=O,0.2862
CC(O)C(O)CC(N)=O,0.2694
CC12C3C4C=CC(C14)N23,0.2307
CCC1CC1CC#N,0.3271
Cc1cnc([nH]1)C(=O)N,0.205
N=C1NC=CC(=O)O1,0.1913
CC(C[NH+]=CN)C([O-])=O,0.2394
OCC12CC(O1)C(O)C2,0.3073
Cc1c(cc[nH]1)C2CC2,0.2357
CC1C2CN2CC1(C)C,0.2945
CC(=O)C1(CO1)C1CO1,0.2201
CC1C2C1C1(CN21)C=O,0.1922
OCC1=CCC(=N)OC1,0.2565
CC1N=COCC1C#N,0.2686
CCC(C)C(O)CO,0.3184
CC12CCCC1C2O,0.3117
C1CNCC(=O)COC1,0.1944
OC(C=O)(C#C)C1CO1,0.2084
OC1CC2COC2C=C1,0.247
O=C1C=C(C#C)C2OC12,0.1585
C#CCn1cc(nn1)N,0.212
C1CCC(C1)(CC#N)O,0.3048
NC(=O)C1CC1(O)C#N,0.2459
CC12C3CC1C(=O)C23O,0.2363
OC1CC1C12CC1CC2,0.3008
O=C1CNC=CC(=O)N1,0.1885
CC#CC1CNC(=O)N1,0.2821
OCC1(CCN1)C#N,0.261
CCC(CC#N)OC=O,0.2842
CCCCC12CN(C1)C2,0.302
c1c(oc(=O)c(=O)[nH]1)N,0.1548
Cc1c(con1)N(=O)=O,0.2067
CC1CC(C)=C(C1)C#C,0.2055
CN=CN1CC=CC1=O,0.1938
OCC1OCCOC1=O,0.2605
CCCOCC1CN1C,0.3058
CCNc1c(ocn1)C,0.2031
OC12CC3C4OC4C1C23,0.3162
CCC#Cc1ccc[nH]1,0.1999
CC12C3COC1CC23O,0.312
CC12CC1(C)C(O)C2O,0.2996
C1C2C3OC1C=CC23,0.24
CCC1(CC1)CCC#N,0.3194
C1OC2CCN=COC12,0.2605
OC12CN3C(CC1=O)C23,0.2066
CCC(O)CCO,0.3288
CC#CC1(CO1)C#CC,0.2516
CC1=CCC(C)(C1)C#C,0.2608
CC12CC3(C)C1CN23,0.3202
CCC#CC1NC1C,0.277
CC1NC1C#CC#C,0.2176
C1COCC2(CN2)CO1,0.3216
CC1(C)C(O)CC1C#N,0.3051
COCC12CC(O)C1N2,0.3159
COC1OC=NCC1=O,0.2035
NC1=CN=C(F)OC1=N,0.168
CC(CCCCO)C=O,0.2267
CC1=CC(=O)CNCC1,0.1642
COC(=O)C1COC1,0.2505
Cn1c(ccn1)N(C)C,0.2384
c1c[nH]cc1OC(=O)N,0.2429
CC1CCC2C=CCC12,0.2646
CCC1CC(COC)O1,0.321
C1C(=O)OCOC(=O)O1,0.2645
CC(C(C)=O)C1(C)CO1,0.2274
OC1C2C3C4C(C=C13)N24,0.1812
CC1(CC1)c2c[nH]cn2,0.2427
C(C1COC=N1)N1CC1,0.2524
CC1=CC(O)C(C1)=NO,0.2378
CCC12CCC1CC=C2,0.2604
COC(=O)C#CCO,0.2397
C1C2CC=CC3CC12C3,0.2505
COC1OC(=N)C2OC12,0.2724
COc1cnoc1CO,0.2336
CCOC1CCC1=O,0.2007
CC1CC1N1CC1,0.32
CC1C2C3C1C(C)N23,0.3207
O=C1C2OC3CC1NC23,0.2024
NC(=O)NC1C2COC12,0.2854
C(COCC(=O)C#N)O,0.1613
c1cn(nn1)CCO,0.2567
CC(=O)C1CCCC1O,0.2278
OCC1CC(=O)CC=C1,0.2254
C1CC23OC12CC1NC31,0.3166
c1coc(n1)CCO,0.2458
C1C2C3OCC4C1N4C23,0.3071
CC#CC12OC3C1NC23,0.2515
CC1(CC1)CCC(=O)N,0.279
OCC12OC1CC=C2,0.2485
CCC1C(O)CC1C#C,0.3031
CC12CC3(C)CN1C23,0.3134
CCNC(=O)NCC#C,0.2808
CC12OCC1NC2C#C,0.2642
O=C1NC=C2CC3C2C13,0.1916
CC12NC1C=CC21CC1,0.2359
CC1C(C2CC2)N1C=O,0.2555
c1[nH]c2c(n1)OCOC2,0.2268
N=COCC12CCC1N2,0.2798
NC(=O)CCC(O)C#N,0.2704
CCCC(=O)COC=O,0.2307
CC1CCCC=CC1,0.257
COC1CC2CCOC12,0.2969
NC1C([NH3+])C1CC([O-])=O,0.2747
N#CC1C2C3CCC3N12,0.2507
OC1(C=O)C2OC2C1=O,0.1771
C1CC1OCC=O,0.2283
CCC(=O)COCCO,0.2032
CNC(=O)C=O,0.178
CCC12CC1C1COC21,0.3057
CCC1(CC1)OCC#N,0.2822
CC1C2OC(=O)C(C)C12,0.2768
CC(O)(CO)CCCO,0.3173
c1c(c(n[nH]c1=O)F)F,0.1774
OCC12CN3C1C2C3=O,0.2425
CC(CO)C1(CO1)C#N,0.2791
COC1(C=O)C(C)C1O,0.2109
ON=C1CC2C3OC2C13,0.2436
CCNC1C(O)C1C#N,0.2495
CC1C2C(C)C(=O)C12O,0.2142
OC1C2CC2C11CCO1,0.2893
CC12CC3C(CC13)OC2,0.3247
CC1OC11C2OC2C1=O,0.2006
CC(C)(NC=O)C1CO1,0.2752
CC1C2CN1C2C#N,0.2566
C1COC2(CC2)CC=C1,0.2539
C#CC1CC23CC(C2)C13,0.277
CC(O)CC12CC(C1)O2,0.2978
C1COc2c1[nH]c(n2)N,0.2113
C(C1CO1)N1C=NN=N1,0.2663
CN(C=O)C1=NCCO1,0.2345
CN1C=NC=C(O)C1=N,0.1782
CCC1OC11CCC1C,0.3285
COC=NC(C)C(C)O,0.256
OC1C2CN2C2CC12O,0.2829
CC1(C)CC2CC(O)C12,0.3159
CC(CO)C1=CC=CN1,0.2429
C#CC1CC1,0.2928
CCNC(=O)OC,0.3125
CCC12CC1(O)C1CC21,0.3207
CC(C#N)N1CC=CC1,0.2359
CCC1(NC1CO)C#N,0.2787
CCC1=CC(O)CC1=O,0.1904
OC1C2C3CC1(O)C23O,0.2877
OC1CN2CC2(C1)C=O,0.215
OC1CC2CN2C11CC1,0.2947
NCC(O)(CCO)C#N,0.2683
C1C2CC3CC1C2C=C3,0.2588
N=C1CCC(OC=O)O1,0.2725
C1N2CC11OCCC21,0.2968
CCN=C1C=CC(=O)O1,0.1853
C#Cc1c(nco1)N,0.1823
C[NH2+]C1(CC1N)C([O-])=O,0.2539
CCCC(=O)OC=N,0.2536
C1CC(C1)OC=O,0.2864
CC1(C)CCCC1C#C,0.3078
CC#CCCC1CN1C,0.284
CN1CCC(=N)OC1=O,0.2562
CCC(=N)NC(=O)NC,0.2585
OCC12CC1(OC2)C#C,0.2426
OC12C3OC(OC13)C2=O,0.1978
OC12CCC1C2CC=O,0.2209
CC1CCC1(O)C#C,0.291
CC12CCC1C(O)C=C2,0.2525
O=CC12COC(=O)C1O2,0.2127
N#CCC1C2C3OC2C13,0.2741
COC1C2CCCC12C,0.3129
CC1(C)C2C3NC3CN12,0.2801
CC1OC11CC(C)C1O,0.3049
COC(=O)c1cnco1,0.2127
CC1(C)C2CCCCC12,0.3243
CC1NC(=O)C11CN1,0.2623
CC1(O)C=CC2C(O)C12,0.2343
C[NH+](C)CC(O)C([O-])=O,0.2192
c1c(nc(o1)C#N)N,0.1709
CCC1CC1(C=O)C#C,0.2189
Cc1c(c(ncn1)N)O,0.2047
CC12OC1C1NC21C=O,0.1932
O=C1CC2(CCC12)C#N,0.2185
O=CCC1OC1C#N,0.2225
OC1C2CC2C1OC=N,0.2729
CC1C2CC=CC12C=O,0.221
C1CC1OCCCC=O,0.2293
CC12NC3=NC4C(C14)C23,0.1652
CCC#CCCC(=O)C,0.2248
Cn1ccc(=O)cc1N,0.2016
CC1(CC=C(C1)C#C)C,0.2096
Cc1cnc(o1)COC,0.2321
CCC(CO)C=O,0.2278
c1c(ocn1)CO,0.2415
CC1CCC2(CC2)C1O,0.3244
C1N=C2C3C4C(C13)N24,0.1555
c1c(cn2c1CCC2)N,0.2236
CC12OC3C1C2C3(C)O,0.3154
CC1=CC2OCC2CC1,0.2545
COCC1COC=NC1,0.2738
C#Cc1c([nH]cn1)C=O,0.1712
CC#CC(OC=N)C#C,0.2637
CN=C1NCCN1C=O,0.226
OCCC1(CC#N)CN1,0.2806
CC1OC(C)C2CC1C2,0.3286
C#CC1N=COC11CC1,0.2591
CC(CO)C(C)=O,0.2304
CNC(CC#N)C#CC,0.2662
NC1C(OC=N)C1C#N,0.247
CCC1=C(COCC1)C,0.2523
CC1=CC2OC2(C)C1,0.2411
CC1C2C(C#C)C2C1O,0.2848
CNC(=N)C(C)(O)C#N,0.2335
ON=C1CC2CC(C2)C1,0.2481
CC1CC(C#C)C(=O)N1,0.2603
CC#CC#CCCC#C,0.225
COC1CCCC1=NO,0.2421
CC1C(C#N)C2CN1C2,0.2757
CN1C(=N)CCNC1=O,0.2515
CN=C1NN=NC(N)=C1,0.1484
Cn1cc(n(c1=O)C)O,0.2286
CCC1(OC1C#C)C#C,0.2588
CC1CC2CC1C=C2C,0.2511
CCN(C)C(CO)C#N,0.2692
CC(C#N)N(C)C(C)=O,0.2676
Cc1c(cnc(n1)F)O,0.1975
CC1(CC#N)CNC1=O,0.2764
CC12C=CCC1N1CC21,0.2403
OCC12CC(C1O)C2O,0.301
CC1(C)CC1CC#N,0.3184
CCc1cc(n[nH]1)C#N,0.2352
CCOCC1=CCCC1,0.2604
CCC(C)(OC)C(C)C,0.3195
CCOC(=O)C#CC#C,0.1951
CC#CC(O)CC#N,0.2854
CN1CC1C1=CNN=N1,0.2148
C1C2C=CC3NC3C12,0.2432
CC1OCC11CC=CC1,0.2622
O=C1NC=NC1C#C,0.2244
CCC1(C)COC1C=O,0.2138
C1C2C3CC4C=CC13C24,0.2436
N#CC1NC1C1CC1,0.2864
CCC1(CCO)CO1,0.3314
CC(O)C12CCN1C2C,0.2906
c1cnccc(=O)c1N,0.1603
CC#CCC(=O)N1CC1,0.2407
Cc1c(nno1)NC=N,0.1959
CC1C2OC3(CC3)C12C,0.3025
CC1C2C3(O)CC3C12O,0.2847
O=C1CC23CC2(CC3)O1,0.2505
CC1(OC2CC2O1)C=O,0.202
CC1CC2(CC1N2)C#N,0.2651
N=C1C=NC=CC=N1,0.1679
OC1(CNC1=O)C1CC1,0.2601
CCN1C=NCC1=NC,0.2127
CN1C(CC#C)C1C=O,0.193
COC1CNC1C(C)=O,0.2155
N=C1NN=NC(C=O)=N1,0.1397
CCC1=CC(=O)CNC1,0.1659
N#CC1CCC=CC1,0.2669
NC1(CCC11CO1)C#N,0.2857
OCC1N2CCC2C1=O,0.2055
CC(=O)NC(=N)C1CO1,0.2394
CC1C=CCC1(C)C=O,0.222
c1coccc1=NO,0.1797
CCC12C3OC3C1N2C,0.2628
CNc1c2n(cn1)CC2,0.2154
CCOC(=NC)C#N,0.2303
C1CC23CCCC12N3,0.3027
CC1CC1C(O)CC#C,0.3018
C1C2(COC2)NC(=O)N1,0.3061
CC1CN1C1=CNC=N1,0.2281
Cn1ncc(n1)COC,0.2471
OC1C(CC#N)OC1=O,0.2615
CCC12CC1(O)C1NC21,0.3093
O=C1NC2CC3C2OC13,0.2432
N#CC12OCC3CC1C23,0.2654
CN(C)C(C=O)C=O,0.1738
c1c2c(no1)oc(n2)N,0.2087
N=C1OCC11NC2CC12,0.2404
C1CC=CCNC(=O)C1,0.2331
CCNc1ccno1,0.2236
CC(O)CC(=O)C1CO1,0.2197
CC1CC(C#N)N1C=O,0.2642
OC1COCOC=NC1,0.2539
OC12CC1C1CC1(O)C2,0.3251
OC1CNC(=O)C2OC12,0.2523
CC1C2CC1OCO2,0.331
OCC1C2CCN12,0.294
C1C2C1C1CC2OCO1,0.3301
CC1(CC#N)CN1C=O,0.2538
CN1CC2OC2(C)C1=O,0.2526
COC1C2N3CC1C23C,0.3162
O=CC12OC1CCC2=O,0.201
CC1OC(=O)OC1C#N,0.2932
CN=C1C=C(C)NC=N1,0.1851
O=CC12CN=C3CC1N23,0.1852
CC1CC2OC1CC=C2,0.2565
C1CN1C12CC1C1OC21,0.2712
C1C2CCC3OCCC123,0.3265
C#CC1(CCC1)O,0.2869
OCC1CC2(CCC2)O1,0.3098
CC1C2CC2C2C(O)C12,0.2982
c1nnnn1C(=O)C#N,0.1938
CC(C)CC1CC1CO,0.3354
O=CC(=O)C1C2CCC12,0.1494
N=C1ON=C2C3CC3N12,0.2133
OC12CCC1N1CC21,0.2892
CCC12CC1C(C)CC2,0.338
CCC(C)(CO)C#C,0.3114
Cc1nnn(n1)C(=O)N,0.2299
CCCC12CC1NC2=O,0.2525
CCC(=O)C1CC2NC12,0.2241
O=CC12CC1OCOC2,0.2272
CCC12CN3C1C(=O)C23,0.2312
C1CC(=O)N2CCC2=C1,0.2069
CC12CC1C1(O)CC1O2,0.3009
CC1C2CC1OC=NC2,0.2745
O=C1NC2C3NC3CC12,0.2698
CC1CC(N)=CC1=O,0.2066
N=CN1CC(=O)C1C#C,0.1953
CC(C)C1(N)COC1=O,0.2494
OC1C2NC(C=O)=NC12,0.1575
CCN1C=C(N)OC1=N,0.2203
CC1N2C(C)CC12CO,0.3059
C1c2c(noc2N)CN1,0.2236
CC1CC2(COC2=O)O1,0.2455
OCC(O)CC(O)C#N,0.2981
COC1(CO)CC1(C)O,0.306
CC1(CC11CCO1)C#N,0.2794
C1C2CCC11CCCC21,0.3525
CCC(=O)C(C)(C)CC,0.2289
N=C1C(CN1C=O)C#N,0.2287
CC12CC(C1)C(C)(C)O2,0.3212
c1c(ncnn1)CO,0.1656
OC1=CC=C(F)NC1=N,0.1696
C1CCC(=NO)C1,0.2505
c1cocc1OC2CC2,0.2331
CC1=C(C(=O)COC1)C,0.1826
COC(=O)C1NC1CO,0.2561
CC1=NC2(C)CCC2O1,0.2645
Cn1c2cnoc2cn1,0.21
COC1C2OCOC12,0.2952
OC1CCCCC1=O,0.2312
CC1COC(=N)C(C)N1,0.2458
CC1=NC(=N)C=CO1,0.2095
C1COC(O1)C#CC#N,0.2308
CCC1(O)CC1C(C)=O,0.2291
CC1C2CCC1C1OC21,0.335
C1CC1(CC(=O)C=O)O,0.1426
NC(=O)N1CC2(O)CC12,0.2785
CC1OCCC1(C)C#C,0.2985
CN(C)C(=O)N(C)C=O,0.2467
NC(=O)C1N=CNC1=O,0.2178
CCN1C(=O)COC1=O,0.2573
C#CC1C2CCN12,0.2619
CC1CN1CCCC#N,0.2732
CN1CC11CC2(C)OC12,0.3148
O=CC12OC1CC2=O,0.1993
Cc1c(ncnc1N)N,0.2218
OC12CC1CCOC2,0.3145
c1coc(n1)NCC=O,0.1911
OC12CCC=C1CC=C2,0.2445
C1CC1C(C#N)(C#N)N,0.2647
CC1C2C(CC12C)C#C,0.2959
CC(CO)C#CC(N)=O,0.2342
Cc1cc(nc(=O)o1)N,0.2033
Cc1cc(no1)N(C)C,0.2167
N=C1OC2C3CC2C3O1,0.2915
COCCC(O)CC#N,0.2886
CC12C3CC4C(C13)C24O,0.2885
N#CC1CCC2CC1O2,0.2925
C#CCC1CC11CCO1,0.2804
c1cnc(c(=O)cn1)O,0.1562
CC12CC1CC(=O)NC2,0.2662
CC(=O)C1CCCO1,0.2208
OCC1C2CC1C(=O)O2,0.2749
Cc1c(nc(o1)C#C)O,0.1735
c1c(ncnc1F)CO,0.2329
CC1CC2CC(C)=CC12,0.2549
CC1(C(=O)C2(O1)CC2)C,0.2175
N#CCC1COC2CC12,0.2761
C1C2OC2C2=C1OC=N2,0.2286
O=CC12CN3CC3C1N2,0.196
OCC12CC3C1N3C=N2,0.2376
CC(C)C12OC3C1OC23,0.293
C1C2CC3OCOC3C12,0.3285
O=C1C2OCC1N=CO2,0.1975
C#CC(C#C)C1CO1,0.2892
O=C1CC2NC12CC#C,0.2203
C#CC1(CO1)C1CCO1,0.2718
c1c(nn[nH]1)OC(=O)N,0.24
C#CC1CCC1C1CO1,0.3011
CCC1=NCC(O1)C#N,0.2653
C1NC11CN2C=CN=C12,0.2453
CC1=CNC(=O)N2CC12,0.2076
COC1C2CC=C(C)C12,0.2436
C1C=CC2OCCC=C12,0.2506
C#CC1COC2CC2N1,0.2519
OC1C2OC(C=C2)C1=O,0.1986
CC1C(CO)CC1C#C,0.2982
CC1CC2(O)C3OC1C23,0.2859
CCc1c([nH]nc1O)O,0.2546
O=COC12CC1NC2=O,0.2463
OCC1C(C=O)N1C=O,0.1986
Cc1cc([nH]c1)COC,0.2376
Cc1cn2c(n1)OCC2,0.2409
CCCC(C)(C)C1CC1,0.3501
CCCCCCC(=O)C,0.2343
OCC(OC=O)C1CC1,0.2785
CC1OCC11C2CC1O2,0.3158
CNc1c(nco1)O,0.2029
CC1NC(=O)N(C)C=C1,0.2171
CC1(C)C2C3CC1(O)C23,0.3113
NC1=NC(=N)C=NC=C1,0.1686
OC1C2CC1C2(O)C#C,0.2834
CC1=C2COC2CCC1,0.2484
C1C(=O)C=CC12COC2,0.1899
CC1CC2C3N4CC13C24,0.2984
COC12CC1C(=N)OC2,0.2782
CCC(O)(CC=O)C=O,0.2147
NC(=O)N1C=CC2CC12,0.2126
CC(O)(CC#N)C1CN1,0.2706
OC1=C2C3CC3N2N=N1,0.2074
CCC1COC1C,0.3229
C1C2OC3CN1C2CO3,0.3014
C#Cc1ccnc(c1)O,0.1917
c1c(c([nH]n1)N)CC#N,0.238
CNC(=NC)C(F)(F)F,0.2374
CC(C)(C)NC(=O)N,0.3004
O=C1CCC2OCC=C12,0.1832
C#CC(F)(F)F,0.3188
CC1C2(C)CC1(N2)C#N,0.2683
O=COC12CN3CC1C23,0.235
CC(O)(CO)CC1CN1,0.2931
COC(CO)CC1CO1,0.3186
Cn1c(c(cn1)N)O,0.247
CCCNC(=O)C=O,0.1771
CCC12NC1CC=C2C,0.249
O=C1NC=CCC1C#C,0.2093
CC1CC(CO)OC=N1,0.2704
CCC1OC(=N)C1CO,0.2804
CC1C(=O)NC=CC1=O,0.1857
CC1C2CC3CC1(C)C23,0.3366
C#CC1CC1C1CCO1,0.2883
CC#CC1CC(N1)C#N,0.2534
C1NC11CC2OCC=C12,0.2188
CC1C(C)C1(O)C(C)=O,0.2244
C#CCc1cnon1,0.2354
CC12CC3C1C(O)CN23,0.294
CC(C)(C)CC=O,0.2237
CCC1(CN=CO1)CC,0.2725
CC(=NO)C(C)(C)C=O,0.2087
CCC(NC(C)=O)C#N,0.2718
C1CC2OC3C1OC23,0.3037
CN1CC11CCC1CO,0.303
COC12CCC1C1OC21,0.313
O=C1OC2C=CC3C2C13,0.2347
C1C(CO1)CC(=O)CO,0.216
CC12CCC=C1C1CN21,0.2128
NC(=O)C1(O)C2CC1O2,0.2617
OC1C2(O)C3CC1(O)C23,0.3115
CC1CC=C2CCCC12,0.2496
N#CC1OCC2COC12,0.2847
CCN1CC11COC1=O,0.249
c1c(c2c([nH]1)ocn2)N,0.1984
N=C1NC2C3C2C(=O)N13,0.2226
NC(CCO)C(O)C#N,0.2887
OC12CC1C(=O)NC2=O,0.2226
CC#CC1CCC1=NO,0.2449
O=C1NCC2OC2CN1,0.2933
C#Cc1c(c(co1)N)N,0.1862
OCCC1CCOC1=N,0.2802
CCC1NC1(CC)C#C,0.2744
CCOCC(=O)NC=N,0.2291
C#CC1C2C3C2C2C3N12,0.2772
CC12OC3C1CCCC23,0.2993
OC(C#C)C1=COC=C1,0.2398
CCCC1OC(C)C=C1,0.2476
Cc1cc(cnc1)OC,0.2082
CCc1c[nH]c(=O)cn1,0.1654
CC#CC#CC#C,0.1871
c1cnc(c(n1)C=O)N,0.1546
CCN=C1CCOCO1,0.2616
NC=[NH+]C1=NC=N[N-]1,0.1331
COC(C#CC)C(C)O,0.2873
CN=C1CC(C)O1,0.2797
COC(C)C(=O)C=O,0.1527
OC1C2C1C1CC2CO1,0.3227
Cc1c(c([nH]n1)O)N,0.2539
C1COC(=O)CC1=O,0.2243
CC(C=O)(C=O)C#N,0.1967
CC(C)OC1(COC1)C,0.3113
CCC#CC1C(C)N1C,0.2556
N=C1OC2CC12CC#C,0.2778
CC1CCCC(C)C1C,0.3585
CC(O)(C#C)C(F)(F)F,0.3056
CC1OC2C(CO)OC12,0.3015
CC1CCCC2(CC2)O1,0.3232
OCC1(CC#N)CCO1,0.2896
O=C1C2OCC22COC12,0.1869
CC(=O)C(O)C1(C)CC1,0.2309
CC(=O)OC(=NC)C=O,0.1743
N#CC#CC1CN1,0.2142
CCc1nc(co1)C=O,0.2019
CC#CC(=NO)C,0.2034
CC1NC(CO)C1C#N,0.2711
CC1OCC=CC1C=O,0.2084
CC12COC(C)(CO1)C2,0.3241
CC1CC23CC(N12)C3=O,0.233
O=CC1CCC2COC12,0.2209
CC1CCC11CC2CC12,0.3328
CCC1=CC2COC1C2,0.247
CNc1cnoc1C=O,0.1594
CC(C)C12CC1C=CC2,0.2471
CC(C)(CC1CC1)OC,0.3251
OC1C2CC(CC#C)C12,0.2984
O=C1OC2CC12C1CN1,0.2398
CNc1cc([nH]c1)CO,0.2114
CC1=CCC2CC1(C)C2,0.2492
CC1C(O)CC1(C)C=O,0.2233
OC1(CN2CC12)C#C,0.2652
C#CC(C#C)N1CCC1,0.2476
CC(=O)NCCC1CC1,0.2776
c1c(=O)nc[nH]c(=O)n1,0.1779
CCC#CCC#N,0.2895
OC1(C#N)C2C3CC1C23,0.2903
C1CN1CC=O,0.2245
CN1C2C=CC3(CN3)C12,0.219
c1c(ncnn1)NC=O,0.1671
C1CC(=CC(=O)NC1)N,0.2056
C1Cc2c(non2)OC1,0.2242
CC1C2C3C(N13)C21CO1,0.3293
CC1(C#N)C2OC1C2O,0.286
COC1C2CCCC12O,0.31
CC12NC1C1CC21O,0.2772
OC12CN3C(C13)C(=O)C2,0.2145
c1c[nH]nc1CCC=O,0.2225
CC(C)C12CC1NC2=O,0.2528
CC1OC2(CC1C2)C=O,0.2219
NC=[NH+]C1=NOC=C1[O-],0.0901
CC1[NH2+]CC(=C1)C([O-])=O,0.151
OC1CC11C2CC1C=C2,0.2276
COC=NC1CC(O)C1,0.2502
CC1CCCC11CO1,0.3293
CCc1nnn(n1)CC,0.2573
CC1(CC1)NC(=O)CO,0.2737
CC12CCC1(C)C2CO,0.3086
COC1C(C)NC1C#N,0.2641
N1C2C3NC3C3OC3C12,0.2896
CCNC(C#N)C1CN1,0.2734
CN1N=CC(=N1)C1CO1,0.2403
O=C1CCCC(C1)C#C,0.2221
OC1CC11CN(C1)C=O,0.2659
CC1CN2CC2CO1,0.307
COC(=O)C(N)C(N)=O,0.229
c1conc1C#CCO,0.2174
COC(=O)N1C(C)C1C,0.2876
C1CC1C12CC3C(C1)C23,0.3325
OCC1=NC(CN1)C#N,0.241
CC(O)C1(C)COC1=O,0.2769
COC(=O)C1NC1C,0.2604
c1c2c([nH]n1)OCC2,0.242
CC1CC2CC12C1CC1,0.3247
COc1c(nno1)O,0.1912
CCC1OC(C=C1)C#N,0.2528
c1cncc2c1CCC2,0.2302
CC1C2CC3OC3CC12,0.3283
CCC(CC)(C#C)O,0.3002
C(c1c(nno1)C=O)O,0.197
OC12C3CC4C3C1OC24,0.3139
CC1CCC1C(=O)C#N,0.203
CC12CC3C(CC13)CO2,0.3218
CN1C2CC(O)(C#N)C12,0.2559
CCC(O)CC=O,0.223
CC1=COC(=N1)C1CN1,0.2243
CCC1=CC(=O)NC1,0.217
NC(=O)C1CC1C1CO1,0.2645
O=C1NC2=C(N1)OCC2,0.2229
Cn1cnc2c1occ2,0.2205
CC12CC1C(=O)CC2=O,0.2141
CC1(O)C2C1C1(C)CN21,0.2777
OCC1C2NC2C1O,0.3029
C1CC12CC(=NO)CO2,0.2437
CC1C2CC(=O)CNC12,0.2128
CC1=CC(=N)OC1C#C,0.2187
C(C#CC=O)C(=O)C=O,0.1544
CCCc1cc(c[nH]1)N,0.2229
CC1C=CC(O)C1C#C,0.26
CC1(CC1)C(F)(F)F,0.3903
CCC#CC(C=O)C=O,0.1867
CC(=O)C1NC(=O)C1O,0.2234
CCCC(=O)N1CC1C,0.2562
CC1C2CC3(O)CC3C12,0.3123
O=C1C2OCC3CN1C23,0.2156
NC1=NC2CC1N=C2N,0.2314
CC(=O)C12CC1(C)OC2,0.221
CC(=O)C1CCOCC1,0.2269
OC1CCC(O)C1=O,0.2163
CC(=O)OC(C#C)C#N,0.2701
C1COc2c(non2)O1,0.227
CC1OCC2(C)OC12C,0.329
CC(=O)C1OC(=O)C1O,0.2113
CC(=O)N(C)C(=O)CN,0.2141
c1c[nH]nc1OC(=O)N,0.2551
CC([NH3+])C(C#N)C([O-])=O,0.2772
Cn1cc(oc1=O)CO,0.2279
COCC1CC(C1)C=O,0.2235
C1C2C1C1CCC2C=C1,0.265
CC12C=CC3C(C13)C2O,0.2345
CC1C2CC1C2C1CO1,0.3573
c1c(oc(n1)O)C(=N)N,0.1984
Cc1c(cncn1)C#N,0.1973
CC1OC(=O)CC1CO,0.2775
C1COCC#CCOC1,0.2574
CC1(C(=O)CN1)C,0.2172
CC1CCC1(C)NC=O,0.2763
C#CC1C2OC3(CC3)C12,0.2726
C#CC1OC2CC1C2,0.2802
CC12C3CC1(O)C2(O)C3,0.2685
C1C(CO1)OCCC=O,0.2233
CC1CC2(CO2)C2CN12,0.312
CN=C1OC2(C)CC12N,0.2605
CN(C)c1cc([nH]c1)O,0.232
O=C1NC(CC#N)C=C1,0.2114
c1cc(ccc1CO)O,0.214
OCC1C2COC(=N)C12,0.2776
CC12CC(CO)C1N2,0.3202
ON=C1CN2CCC12,0.2201
c1c2c([nH]n1)OCC=C2,0.1882
CC1C2COC1C21CO1,0.3114
CC1CC(C1)OCC#N,0.2863
CC(C)(C#CC=O)O,0.2055
C(C1CC1)C1CCOC1,0.3229
CC12NC1CC2CCO,0.2985
CC1(CNC1C#N)C=O,0.2135
COC1(C)CC1N1CC1,0.2881
CC1NC(=O)C=C1,0.2151
CCCn1c(cnn1)O,0.2473
NC1=C(N)C(=O)OC1=N,0.1499
CCc1c(c(no1)O)C,0.246
OC1C2N3C1CC23C#N,0.2673
CC12C3C4C1N4C23,0.2784
CC1=CC23CCC2(C1)O3,0.2288
CC12CC34CC=C(C13)C24,0.0663
OCC1C=CC(=O)C1O,0.1947
CCCCOC(C)C,0.3333
OC12CC1OC2C#N,0.2528
CC1N2CC2C=CC1=O,0.1631
OC1C2C3(O)CC1C23O,0.2992
CC1CC2C1C2C(N)=O,0.2627
CC(C)OC1(CC1)CO,0.3169
CC1C2CC3(C)N1C23C,0.3178
Cc1c(con1)C#N,0.2341
C1CC11C2CC3OC1C23,0.3083
OC1C2NCCC(=O)C12,0.2162
CC(C#N)C(C)=O,0.2322
Cn1c2c(cn1)onn2,0.193
CC(O)C1CC2(C)CN12,0.2966
CC(=NO)C1(CN1)C=O,0.2211
c1c(c2n(c1N)CC2)O,0.2085
CC1CC2CCC2C1=O,0.2164
C1C=CC2OC=NC12,0.2526
CC1OCC1NCC=O,0.2099
C1CCN(C(=O)C1)C=O,0.2126
C#CC(=NO)CCCO,0.2094
CC1CC1(C)OCCO,0.3309
CC12C3OC(C13)C21CN1,0.2885
c1c[nH]c(nc1=O)O,0.2099
CC12CC1OC(O2)C#N,0.2837
NC1=CC(C[NH3+])=C([O-])O1,0.1504
OC12CC(O)(C=C1)C2=O,0.2288
CC1C2C(=O)CC12C,0.2301
c1c(nc2n1nc[nH]2)O,0.2012
CC1CCCC1NC=O,0.2773
C1NC2=C(C=C1)N=NO2,0.1494
CC1C2OC3COC1C23,0.3154
O=C(C#N)C1CN1,0.1856
CN1CC23CC(C2)C13,0.2834
C1OC23CC4C2COC134,0.2765
CC1COC(=N)C2CN12,0.2459
CC1=C(NC(=O)OC1)C,0.2245
CC(CO)C(C=O)C=O,0.1956
O=C1NC2(CC#C)CC12,0.2549
O=CC1=CC2NC2C1,0.1892
O=CC12COC3CN1C23,0.2134
NC(=O)CC#CC1CO1,0.2539
CN1CC2=CCOCC12,0.2341
CC(=O)CC#CCOC,0.2265
CC1=C(C)C(=O)N=NO1,0.1996
Cc1ccc(cc1)CO,0.2319
CC1C2C3OC2C3C1=O,0.2093
N#CC12C3C1C1C3CN21,0.2492
CC1C2CC(C)(C)OC12,0.3071
OC12CN3CC1(C=O)C23,0.2109
CCCc1c(cc[nH]1)N,0.2218
CCC(C)CC#CCO,0.2771
CNCC(OC)C#N,0.2478
C1OC2C3N=COC1C23,0.2563
CC12C3OC4CN(C13)C24,0.2728
C1CC11C2C3CC1OC23,0.3235
CCC(CC#C)NC=O,0.2816
CC1=CON=NC1=O,0.1985
COc1cnoc1C#C,0.1829
C#CCC1(CCC1)CO,0.293
CCC(OC)C(C)=O,0.2185
CC1CC23CCC2C1C3,0.3106
CC12CC3C4C1CN4C23,0.3
CC(C#N)C1CN1,0.2815
CC12CC3CN3C1C2O,0.2854
CN1N=CC=CC1=N,0.1535
C1C2OC11COC=NC21,0.2486
C1OC1C1=CC2CC2C1,0.2302
O=C1C2C=CC1C1OC21,0.2394
c1c(c(n[nH]1)O)CC#N,0.2474
CNC(=N)C(=O)NC=O,0.1937
O=C1OCC23CC12OC3,0.2517
N=C1OC23CC12COC3,0.2732
OC1CCCN=COC1,0.2587
OC(C#C)C(F)(F)F,0.3025
CCN1CC1C1CCO1,0.2937
CC(=O)C(=O)CCOC,0.1583
O=C1CC2COC3C2C13,0.2219
CC1=C(C=CN1)C1CN1,0.2389
CC1=CCCCOC1=O,0.2266
CN=CNC(=O)C1CO1,0.2274
C1NC1C12CC1OCO2,0.2965
c1c(ncoc1=O)C#N,0.1782
Cn1cc(cn1)N2CC2,0.2225
C1CCOCCC#CC1,0.2802
C(C=O)OC(C#N)C#N,0.2284
CCC(=O)C(O)C(N)=O,0.2176
O=C1CC2OCC1C=C2,0.2115
c1(nc(on1)N(=O)=O)O,0.178
CC1OC1C1(O)COC1,0.3123
CC12CC(=O)C1N1CC21,0.1966
CC#CC(C)CC#N,0.2858
OC1C2CC3C1C2C3=O,0.2328
Cc1c[nH]c(c1C)O,0.2325
CN=c1n(nnn1C)C,0.193
Cc1cccc(n1)C#C,0.1988
C(#N)c1c(n[nH]n1)N,0.1992
CC1=CC2CCC1C2O,0.2528
Cc1cn(cc1C)C,0.245
CC(OC1CC1)C1CO1,0.3229
CC#Cc1ccc(o1)C,0.1894
O=CC1NC1C#CC#C,0.2046
CC12CC3CCC13CO2,0.3117
N#CC1=CCCN2CC12,0.193
OCC1CC(=O)C1CO,0.2196
CC1CC2NC2C2CN12,0.2856
CCc1cnc(nn1)F,0.1659
CC12OC(=O)C1C2C#C,0.2525
O=CC12CC1OC21CC1,0.2118
O=C(C#N)C1OC2CC12,0.1768
CC12CC(=O)C3CN1C23,0.2164
OC1C2C3CC(O)C1N23,0.2859
CC(CC=O)C1(C)CO1,0.2284
CCC1C2CCC12OC,0.3213
CNC1(COC1=O)C#N,0.2379
CC12C3COC1C=CC23,0.2334
CC(N1CC1)C(C)(C)C,0.3083
CC1(CO1)C1COC1=O,0.2742
O=CCC1=CC2CC1C2,0.1961
CN1CC=CC(=O)C=C1,0.1647
OCC#CC(C=O)C#N,0.214
CCCc1c(ocn1)C,0.2371
CCNCC(=O)OC=N,0.2084
CC1CCCC(CO)O1,0.3344
COCCC(C=O)C=O,0.1982
CCc1c(nc([nH]1)O)O,0.2337
O=CN1C2CC2C1=O,0.2253
CC(CO)N1C2CCC12,0.326
N#CCC12CN1C1CC21,0.267
O=CCC1NC(=O)C=C1,0.2027
CN(C)c1nccnn1,0.1636
CC1CC(=O)N(C)C1C,0.2713
CCC1CN=C(O1)C#N,0.2186
O=C1CC2COC1C=C2,0.1995
CC1C2C3(O)CC1C23O,0.2943
CN(C)C1COC1C#N,0.2351
C1C2NC2C2=CC=NN12,0.2478
N#CC12CC(O1)C=CC2,0.2346
CC1C2C3C4CC4C2N13,0.3091
CC(C)c1c[nH]cc1N,0.2322
CCC1(CC)CC1C=O,0.2264
C1CC(=O)NC2(C1)CC2,0.2622
CC1COC(=N)C1CO,0.2691
Cc1c(con1)C(=N)N,0.2227
CC1=CC(CC#C)OC1,0.2454
CC1(C)OCC2(O)CC12,0.3194
CN1CC1(CO)CC#N,0.2669
CCC(=O)C1COC1=O,0.2288
OCC1OC1CNC=O,0.2821
CC1CC(C)(O)C=C1,0.265
CC1OC(C)(C#C)C1O,0.2773
OC1CC=C(C1)C=O,0.1941
OC12CC1(C=CC2)C#N,0.2367
C1C2OC34CC(C3)C4C12,0.3212
C1CC1C1CCCCO1,0.332
c1cnc(=O)cc(n1)N,0.1386
O=CC1C2CC1(C2)C#C,0.2156
COCC12CC3C1N3C2,0.3151
CCC12CCC1C2C=O,0.2173
OC1C=CCC(=O)C=C1,0.1801
CCC(CC)N=COC,0.2703
CC1C2C(C)CC12C=O,0.2254
CC(O)C1OC1CO,0.3261
CCC1(CN1)C#CCO,0.2696
COC12CC(C1)C2(C)O,0.3221
CCC(=O)NC(=N)C=O,0.1827
CC#CC1OC(C)C=C1,0.2511
CCC1COC(CO)O1,0.3299
C1CC1(CC(=O)CO)O,0.2303
COC1CC2(CO2)C1,0.3228
CCOC(C)CCO,0.3272
COC1CC(C1)C1CO1,0.3273
CN=C1C2OC2C2CN12,0.2274
CCC1=CC(O)C(=O)N1,0.2108
CC(O)CCNC=O,0.2808
CCC(C)C(=O)C(C)=O,0.1552
Cc1cc(cc(c1)N)C,0.207
OC(CC=O)C(=O)C=O,0.134
CCC(C)C1=CNN=C1,0.2584
CC12C3CC1=CC(=O)N23,0.1497
N=C1NC(=O)C(=C1)C#N,0.1748
CC12CC3(C1)C=CCC23,0.2485
CCn1c(nc(n1)C)N,0.249
COC1C2CC1OCO2,0.3212
C1C2CC11COCCN21,0.3151
CC12COC(C1O)C2=O,0.1958
CC12C(O)C3C1C=CC23,0.2223
C1CC12COC(=O)OC2,0.3221
OC(C=O)C1(O)CC1,0.2181
O=C1CC2OCCC12,0.2113
C1Cn2c(nc(n2)O)N1,0.2419
C#CCn1nc(nn1)N,0.2155
N#CCC1=CCC2CC12,0.242
CNC1(CCC1)C#N,0.266
CC12CN3CC(C13)C2=O,0.2031
CC1C(CO)OC1C#C,0.2658
OCC#CC1CO1,0.2687
CCN=c1[nH]c(co1)O,0.2252
c1cc(=O)[nH]cc1C=O,0.1786
C1CC1(C(=O)N)O,0.2686
CC1CCOCC2OC12,0.3296
OC1C2COC1C=C2,0.2476
CC(=O)C1OC1CC#C,0.2212
OC12CC1C=C1CCC21,0.2291
N=COCCOC=O,0.2704
OCC1=CC2CC1C=C2,0.2155
COC1C(O)C1(N)C#N,0.2652
CC1(OC1(C)C#N)C#C,0.2722
CN1N=NOC(=N)C1=N,0.201
CC(COC=N)CC=O,0.2292
c1c[nH]c(c1O)NC=O,0.1847
CC1NC(=O)C(O)C1C,0.2599
O=C1CCC2C3CC3N12,0.2457
NC(CC([O-])=O)C(N)=[NH2+],0.1251
CC1OC(C=O)C1C=O,0.2022
CCC1(CC1)C(=O)C=O,0.1569
CC1CC2(C1)CC=CC2,0.264
OC12CC3C1OCC3C2,0.3079
CC(C#N)N1CCC1=O,0.2665
CCC(=O)c1ncon1,0.1949
C1c2c([nH]nc2N)CO1,0.2363
CC1=CC2C3OC1C23C,0.2258
CC1C2OCC(C#N)C12,0.2794
COC12C(N)C1OC2=O,0.2329
C[NH2+]C1(CC([O-])=O)CC1,0.2755
CC(C)COC1(CC1)C,0.3275
CCC#CC1C2CCN12,0.26
CCC1CCOC1CC,0.3262
O=CC#CC1CC=CC1,0.1971
COCC1CC1(C)OC,0.3287
CN1CC23CC4C2CC134,0.2691
c1c(ocn1)C(=O)C#N,0.1765
CC1(C)CC1(C#C)C#N,0.2692
C1CN=C2OC3C(N1)C23,0.2185
OCC(=O)CC1CN1,0.2182
Cc1c(ccn1C)C#C,0.215
CC1OC=NCC1=O,0.203
O=COCC1CC1C#N,0.2838
OC1C2C3OC4C(C23)C14,0.3087
O=CC12CN1C=CC2=O,0.1817
CC1OC2CCC=C12,0.2438
CCC(CCO)C(C)O,0.3273
Cn1cnc(nc1=O)N,0.2142
CC1=CC(C)(O)C(O)C1,0.2554
CCC(O)(C#C)C(C)O,0.2795
CC12OC3C(N=C1N)C23,0.2286
C1C(=C(CN1)C#N)C#N,0.173
C1C2C=CC3CCOC123,0.2321
COCC1OCOC1C,0.3275
CC1(O)CCC(=O)C1O,0.2214
c1nc(c2n1CC2)CO,0.2496
OC1C(NC1C#N)C#N,0.2557
CC1CCNC=CC1=O,0.1865
C#CC(=O)CNCC#N,0.1772
COCC1CC(=O)O1,0.2699
C1C2C=CC3=C2N1C=C3,0.1798
CN1C=C(CC1=O)C#N,0.1837
OC1C2N=CN(C=O)C12,0.2099
CC1CC2OC12CCO,0.3225
C#CC1(CC2NC12)C#C,0.2688
CC1NC11C2CC1OC2,0.3159
CC1OCC=CC1=NO,0.1945
CCC1=C2COC2CC1,0.2376
CC1OC11C(C)CC1O,0.3074
CCC1(CC1CO)OC,0.3233
CC(OC1CC1C)C=O,0.2218
CC1N(C)C2C(O)C12O,0.2562
CCN=C(C=O)OCC,0.1691
CC1N2C(C=O)C2C1=O,0.1828
C1C2N1CC13CCC21N3,0.2931
C1CC23CCOC2CC13,0.3247
CCC(O)C1(C)OC1C,0.3199
CC1(CC1)C12CC(C1)O2,0.3248
C1C2C1C1(CO1)C1CN21,0.2912
FC1=CC(=N)NN=C1,0.1608
Cc1cn(cn1)CCO,0.2479
C1CC2C1CC1CCC21,0.3425
c1c(cn[nH]1)COC=O,0.2571
C1OC2COC1C=C2,0.2444
CC(CCO)CCO,0.3381
CNc1c(nno1)OC,0.1906
OC1C2CC3(O)CC2C13,0.3165
CC(=O)N1CC=CC1=N,0.2016
O=C1COC(CO1)C#N,0.2617
C#CC12CC3C(C1)C23,0.2832
N=C1OC2CC=CCC12,0.2617
CNC(=O)N(C=O)C=O,0.2139
CC12CN1CC=C2CO,0.2362
N=C1ON=CN=C1C#N,0.1484
CC1CN2C=CN=C2C1,0.2504
CC1(Cn2c1cnc2)C,0.2553
OC1COC(OC1)C#N,0.2892
CC1=CC(=O)N=NO1,0.2023
OCC#CC1(CO1)C#C,0.2516
C1C2CN1C1=C2OC=N1,0.2136
CC1CC2(CN2)C11CN1,0.2984
OC12COCC11CC2N1,0.3071
NC(=O)C1CC(CO)C1,0.2708
OCC(=O)C1CN=CO1,0.2203
OCC12CC(C1)(C2)C#C,0.2996
NC(=[NH2+])CC([O-])=O,0.2387
CN1CC1C(N)CC#N,0.277
O=CC1(CCC1)C1CO1,0.2254
N=C1NC2CC(O1)C2=O,0.188
CC12CC1CCC2CO,0.3333
CC#Cc1nc[nH]n1,0.2235
N#CC12C3OC1C=CC23,0.2268
C1CC(=O)C(=O)C=C1,0.1491
CN=C1OC(=O)OC1C,0.2673
CC(C)(C)CC(O)CO,0.3104
C1CC(C1)N=C2CCO2,0.27
CN=COCC(=O)N,0.2472
COCC1OC1C1CC1,0.3369
CC(=O)CCC1COC1,0.231
Cn1c(=O)c(ccn1)N,0.1752
CCC12CC1OC=N2,0.2599
CC(C)Cc1cnco1,0.241
ON=C1C=CCC1C#C,0.1932
CC12CC1C(O)C=CC2,0.2639
CC[NH2+]CC(O)C([O-])=O,0.2657
OC1C2CC1C2OC=O,0.2783
FC1=COC=NC1=N,0.2037
O=CNCC1COC1=O,0.2534
CC(=O)NC1(COC1)C,0.2732
OC12COC3C1CCC23,0.2815
C1C2C3CC(CO3)CN12,0.299
CCCc1coc(n1)O,0.2479
CN1C=NNC(=N)C1=N,0.1874
Cc1c(c[nH]c1CO)O,0.2203
c1nc(no1)CC2CC2,0.2647
CC1CC(O)C(O)C1=O,0.2251
c1c2c([nH]c(n2)N)n[nH]1,0.2121
CC(C)(O)C1OCC1O,0.2816
N#CC1OC2CC1CO2,0.2822
Cc1ccncc1C=O,0.1771
O=CC12CC1OCCC2,0.2292
CC12OC1C1CN1C2=N,0.235
OC1CC=CC(O)C1O,0.2569
C1C2NC2C2OC1C=C2,0.2542
O=CC1=NC2CC2CO1,0.1842
CC(C)O,0.3351
CC12CC(O)C1C1CN21,0.2792
NC(C#N)C1CC1C#C,0.2816
O=CC1=CC2(CN2)CC1,0.1802
COC1CN(C1)C=O,0.2659
C1C(=CNC(=O)N1)CO,0.2226
CC12OC3CC1C2CC3,0.2987
C1CC1(C(=O)NC=O)N,0.2164
COCC1CC2CCC12,0.3317
O=C1CC2C3COC3C12,0.2178
CC(C#C)C1OC1C=O,0.2146
CCC#CC1CC1OC,0.2797
c1c(c(c([nH]1)O)N)CO,0.2266
CCCC1(CC1)C(C)C,0.3467
CC1C2CCC=CC1O2,0.2458
CC1(CCCCC1)OC,0.3228
CN1C2C3C1C2C3(C)C,0.2884
CC1=CCC2CC12C=O,0.2076
NC(=O)C(CO)C1CC1,0.2706
CCC(O)C(O)C#N,0.2892
COC1C=CCOC1=O,0.2376
NC1C2C(O)C2OC1=O,0.2486
CC1C2CCC(C=O)N12,0.2073
CC1(C(=CCO1)C#N)C,0.2048
CC(=O)C1(C)COC=N1,0.2218
COC1C2CCC1C2C,0.3347
CC1(C)C=C2CN3C2C13,0.1737
CCC1=CC2CN2C1=O,0.2002
N#CC1=CCCC11CO1,0.2159
O=C1NC2C1C=CC2=O,0.177
CC12CC1C1OCC21O,0.2904
COCC1CC2CC12O,0.3238
COC(=O)C1CC1C#N,0.2724
COC(CCC#N)C=O,0.2127
C#CC#CCC(=O)CO,0.2203
N=C1OCC1OCC=O,0.2293
CCOCCCC(C)C,0.3323
CCn1c(nnc1C)C,0.2608
CC1(O)CC=CC11CO1,0.2486
CC1(O)CN2CC12C#N,0.2563
OC(CC#C)C#CC#N,0.2228
NC1=NC2C3OC1OC23,0.2323
CC1=CCC(C)(C1)C#N,0.2616
CCC(O)C(=O)OC,0.2694
CC12CC3OC1C3O2,0.3117
CC12OC(C=C1)C(=N)O2,0.2375
O=CCOC1CCCO1,0.2295
C1CC2C3CC(C3)C12,0.3631
CC12CNCC1(N2)C#N,0.2709
CCC1NC1(C)C#N,0.2848
CCC1OCC11CCC1,0.3138
COC(C)C(O)C#CC,0.2928
NC(=O)C1CC1(O)C#C,0.2346
N=C1OCOC1C#C,0.2756
CCC(=O)N(C=O)C=O,0.2119
CCN(CC=O)C(=O)C,0.2114
CCC1NC(=N)NC1=O,0.2344
CC(=O)c1ccno1,0.1933
CCCC(CC=O)C=O,0.2186
N1C2C3NC4C2OC4C13,0.2704
C1CC(O1)C1=NC=NO1,0.2305
CC1OC2C(OC=N)C12,0.2717
Cn1cnc2c1cn[nH]2,0.2177
CCOC(C)C(=O)OC,0.2545
OC1C2CCC3CN3C12,0.2671
CNc1n[nH]c(=O)n1C,0.2473
N#CC1CN=CNC=N1,0.222
CNC(=O)C#CC#C,0.1986
CC(OC1CC1)C#C,0.2814
CC1(OC(=N)C1N)C#C,0.2606
CC(C)C1C2C3CC3C12,0.2836
COC12CC1(C)C1CC21,0.3357
CCC1C(C)CC1=NO,0.2487
CC(C)C1OCOC1C,0.3261
NC(=O)C1C(O)C1C#N,0.2504
CCOC=NCC(C)O,0.2617
FC1=CC(=N)N=NO1,0.2237
OC12C3NC1C(=O)C23,0.2193
CC12CN1CCNC2=O,0.2498
CC1(O)CC2COC2C1,0.3198
CCC1CCC1C#CC,0.292
CC1=CC2CC(C2)C=C1,0.1806
C1CC12C=CCN=CO2,0.2501
CC1CC2CNC(=O)C12,0.2657
COc1c(cc[nH]1)O,0.2306
CCC(=O)C1OCC1=O,0.1995
CC1C2OC2C2CC12C,0.3297
CC(O)C(=O)C(F)(F)F,0.2172
C1CC(=O)C=C1N,0.2078
C#CC1C2CC1C2C#N,0.2865
OC1CC(=O)OC1=N,0.2596
CC1C(O)C1(C)C=O,0.227
OC1(CC1)C1CC(=O)O1,0.2825
CC1(C)C2C3NC3C12,0.2732
CCC#CCOCC,0.2847
C1CC(=O)C2(C1=O)CC2,0.1982
CCC12NC1C1C2N1C,0.262
CC12NC1C1OCC=C21,0.2237
CCC1OC1(CO)C=O,0.2121
CN(C)C(=O)C(O)C#N,0.2613
CC#CCOC(=O)C#C,0.2171
OC1C(O)C2C3OC3C12,0.2989
O=C1NCC(CC#N)O1,0.2979
CC1CCN1C(C)=O,0.2645
CN=C1OC2(CC12)C#N,0.2506
OCC12CC1CC21CN1,0.297
C1Oc2c(nc([nH]2)O)O1,0.2031
CCCC(NC=O)C=O,0.2175
CC(CO)C(=O)CO,0.2366
CC1(CN1)C(=O)C1CN1,0.2203
CC(O)C1CN1C(N)=O,0.2767
OC1C2CC1(C2)N1CC1,0.2951
C1COC(=N1)CC=O,0.2287
O=COC1OCCC1=O,0.2145
OC12CCC1C1COC21,0.3008
N#CC1CCC2CCN12,0.2558
CC1=CC(O)(CC1)C#N,0.2485
C1C(OCO1)(C#N)C#N,0.2722
OC12CC1COC(=O)C2,0.2723
Cc1c(=O)[nH]ncn1,0.172
Cn1cnc2c1nco2,0.2058
CCCC1C(C)C1OC,0.3133
CNC(C)C1=NC=NO1,0.2127
C(C=O)C#CCC=O,0.2203
CCC(CC(N)=O)C=O,0.2306
OCC12CC(C=C1)C2=O,0.2449
CC1=CCOCCCC1,0.246
CCOCC1C2COC12,0.3156
CNc1nccnn1,0.1661
C1CC11C2C3C4C3N1C24,0.3021
NC(=O)C12CN1CC2,0.2578
CN1C(=N)OCCC1=O,0.2414
CC1CC2C3COC1C23,0.3152
C1OC2C3C4CC12OC34,0.3047
C1C=Cn2c1n[nH]c2=O,0.196
O=C1C2NC2C=C1C#N,0.169
CCC1(O)C2CC1CC2,0.3232
CC1(C)CC2OCC12,0.3153
N=C1COCCC(=O)O1,0.243
CC1(O)CN=COC1=O,0.2354
CN=c1cccncn1,0.1538
OC12C3C4N3C1C24C#C,0.2335
OC1COCC1(O)C#C,0.2624
OC1CC2CCC2C1,0.3279
CC(C#N)C#CC(N)=O,0.2322
COc1cocn1,0.2194
CN(C)C1CNC1=O,0.2358
OCC12CCC(O1)C2O,0.3177
CCc1cc[nH]c1CC,0.2386
CC1CCC(O)C(O)C1,0.3029
OCCCC(O)CO,0.3173
c1c(n[nH]n1)OCCO,0.2359
OCCC12CC1OC2=N,0.2737
N=COC1CC1OC=N,0.2757
CC12OC1C(O)CC=C2,0.2411
CC1CC2C(CC#N)C12,0.3085
CC(C#N)C(C)(O)C#N,0.3116
CC(CN1CC1)C(N)=O,0.2649
CC1CC2(CO)CC12C,0.316
CC1C2CC(O)C1C2O,0.3187
C(=O)C#CC(=O)C(=N)N,0.1693
C(C#N)C(=O)NC(=N)N,0.2138
C#CC1=CCCC12CC2,0.2017
C(C=O)N(C=N)C=O,0.2093
CN1C(C#C)C1(C)C#C,0.2421
CC1NC11CC(C1)C#N,0.2838
CC1C2CN=COC12C,0.2731
O=CC1CC2CC3C2N13,0.2203
Cn1c(cnn1)CC=O,0.2066
C1=C(C(=O)C(=O)N1)C=O,0.134
C#CC1C2CCC1OC2,0.2871
CN1CC(=O)C2C(O)C12,0.1944
CC(C#C)N1N=CC=N1,0.2564
NC(=O)C1NCC1C#N,0.247
CC1N2CC=CC12CO,0.2288
[NH3+]CC(=O)[N-]C(=N)C#N,0.2193
OC1=CC(=N)N=CC=C1,0.1422
CCCC(OC)C#N,0.3043
CCNC(=O)CC(=O)N,0.2542
O=CC12NC1C1CCC21,0.1988
CC(C)C#CCOC=O,0.2673
N#CC12CC1C1OC21,0.2611
OC12C3CC1(O)CCC23,0.2904
OC1CC(=O)COC1=O,0.2206
OC1CCNC(=O)OC1,0.2864
CC1CC2(C1)CCC2,0.3528
CC1OCC(=O)C1=O,0.1346
CC1(CO)COC1C#N,0.2786
CC1OCC2CCC12O,0.3124
CC(NCCC#N)C#C,0.2735
OCC12CC1(CO2)C#N,0.2717
ON=C1CC2CC1O2,0.2555
Cc1c(=O)c(non1)C,0.1679
CC1C2C3CC2(C=O)C13,0.2168
COC1(CC(=O)C1)C=O,0.209
O=C1CCN2C(C#N)C12,0.2141
OCC1C2CC3OC3C12,0.3129
COC(=O)NCCC#C,0.2978
N=C1OC2C3C=CC1C23,0.2283
CC12C3CC1OCC2O3,0.3121
CC1CC2CCCOC12,0.3201
CC#CC(C)OC(C)C,0.2933
CC(C)(C)C#CCC#N,0.2876
O=C1OC=C2C3CC3N12,0.2225
CC1C2CCOC1CO2,0.3215
CCC(O)C(C)C1CO1,0.3236
Cn1cccnc1=O,0.18
CN1CC1C1(CN1)C#C,0.2557
c1cnc-2nn[nH]nc12,0.1543
CN1C(CN=C1N)C#N,0.2363
CC12CCC1C2(O)C#C,0.2713
CC1=CC2OC(=O)C2C1,0.2538
Cc1cocc1N(C)C,0.2231
COC1C2C=CC1C2C,0.2393
CCCC(C#C)C1CC1,0.313
COC(C)C(=O)C(C)C,0.2106
Cc1cn(nc1O)C,0.2385
CCC1(COC)CCO1,0.3159
CCC1=C(C)CC2CC12,0.24
CC12CC3(C)CC1(O)C23,0.303
CC1(O)CCOC11CC1,0.3013
O=CC1=C2NCC2OC1,0.1816
CC1C2CCC1(N2)C#N,0.2644
CCC1C2C(O)C(=N)N12,0.2407
CC12C3OC3C1(C)C2O,0.3008
OCC12CC1C=CC2=O,0.1882
CC#Cc1c(cn[nH]1)N,0.1877
OC12C3C1C1=CC3C2C1,0.1174
CCC#CC1CN1,0.2665
OCC12CC1COCO2,0.3181
CC12C3CCC11CN2C31,0.3014
CCOCC1(CO1)C=O,0.221
CC1=CC=CC=CC1O,0.1794
FC(F)(F)C1(CO1)C#N,0.3042
OC1C2CC3(CCC3)C12,0.3172
OC1CC2(CO2)C11CN1,0.2944
c1c2c(nc[nH]2)oc1N,0.1955
CCN1CC1(C=O)C#N,0.1976
N=C1N=CNC=C1C#C,0.1683
c1coc2c1c(c[nH]2)O,0.2157
[NH3+]CCC1=N[N-]C(=O)O1,0.234
O=C1NC2CC2NC1=O,0.2119
CCOC=NC(C)(C)C,0.2705
C(C1CC1)C1CCC=C1,0.2622
N=C1CN2N=CN=C2N1,0.2174
CCCC12CC(C1)C=C2,0.2387
c1cc(=O)[nH]cc1C#N,0.1754
N#CCOC1C2COC12,0.2587
Cc1cc(coc1=O)F,0.1698
CC1C2CC3N1C23CO,0.3104
CC(C)C(CO)C#N,0.3095
N#CC12CCC1COC2,0.2966
C(C(=O)N(C=N)C=N)O,0.2301
NC12CC1(OC2=N)C#C,0.2298
OC12C(CC1=O)C2C=O,0.2134
CC12COCC1C2CO,0.317
Cc1cnn(c1C)C,0.2472
CC1(CC2OCC12)C#C,0.292
CC1(CO)CC2CC2O1,0.3156
C1C2CC1C=CCC=C2,0.2367
CCC1C(C)OCC1=O,0.2128
O=C1C2CC1(CC#C)C2,0.2508
CC1OC2C3C4C2C1N34,0.3115
C1CC2CC3NC3C2=C1,0.2426
C1CC(=NO)CC(=O)C1,0.2142
CC12CC=C(C#N)C1O2,0.2107
NC1=COC=C([O-])C1=[NH2+],0.1323
CC1CC2CCCC1O2,0.3117
C1C2CC3NC3COC12,0.3005
CC1(CN1)C(=O)CC#C,0.2222
C1CN=COC(=O)C1=O,0.1853
CC1(C)OC1(C)C1CN1,0.3269
CC12CC(CC=O)C1O2,0.2266
CC12C3C4N=C(C=C14)N23,0.1101
[O-]C(=O)C1[NH2+]CC1C#N,0.258
O=C1CC2(CC2C#C)O1,0.2627
COC1C2C(C)N2C1C,0.2951
CC(N)C(C)(C#N)C#N,0.2609
CC1(OC1C=O)C#N,0.2101
CC1COC(=N)C(=N)N1,0.1996
CC1CC(=O)NC(C)=N1,0.2366
CC1C2C3NC3C(=O)N12,0.2234
CCN=C(C(=O)CO)N,0.183
CC1(C#N)C2CC1O2,0.2843
OC1C2CCC(N2)C1=O,0.2024
CC12OC1C1C2CC1=O,0.2135
CC1CCC11C2COC12,0.3043
COC1=NC2CC2(C)N1,0.2703
Cc1c(cno1)N(=O)=O,0.2021
CC1C(C#N)C2CC12C,0.2992
CC(C)(C)C1CC(=O)N1,0.28
c1c(c2n(c1O)CC2)O,0.2197
CCCc1cc(c[nH]1)C,0.2412
N=C1OC(CC=O)C=C1,0.2107
O=C1CC=C2COC12,0.2118
CC(=O)C1(CCCC1)O,0.2194
CC1=CC2C3C4OC13C24,0.219
CC1(CN1CC(=O)N)C,0.2707
CC1(CCCC1=O)C#C,0.2117
C1OCC23OC=NC2C13,0.2553
OCC1C2C3C4C3N2C14,0.2886
C(=O)C(C=O)(C#N)O,0.1917
CC1(C)OC2CC(=O)C12,0.2167
c1c(nc([nH]1)CC#N)N,0.2137
OC1C2C1C1N=COC21,0.2653
CC1=CC2(CN2C1)C=O,0.2022
CC(=O)C(O)C(O)C=O,0.2192
CCC12CC(C)(O1)C=C2,0.2342
CCCC(=O)C(C)C#C,0.2248
CC1CCC11OC1C#N,0.2835
CC(=O)N1CCCC1,0.2676
CC1CCOCC1=NO,0.2499
Cc1c(oc(=O)[nH]1)C,0.238
Cc1nc(cn1C)NC,0.2121
CCC1(C)CN1C1CC1,0.3064
CCOC(=O)N1CCC1,0.2909
C1CC1(CC=O)OC=O,0.2233
CC1(C#N)C(N)C1N,0.2686
OC1C(=O)CC11COC1,0.2132
CCCCC1OC1C#C,0.2805
OC1CCC(C1)C1CC1,0.3331
CC1N(C=O)C11CCC1,0.2535
CN(C)C(=O)N1CCC1,0.2802
CC1(O)CC(O)C11CN1,0.3025
CCC1C2C(CO)CN12,0.2925
CC1CC(=O)C1(O)C=O,0.2043
CC12COC(CO1)CO2,0.336
OCC1(CO1)C(=O)C#C,0.1956
CC(C1CO1)C1CN1C,0.308
CC1(CC1O)C(F)(F)F,0.3407
CC12CC(C1)(C2)C1CC1,0.3544
COc1c[nH]c(n1)OC,0.2346
CC1CNC2=C1ON=C2,0.196
Cn1c(=O)[nH]c(=O)cn1,0.1937
CN1C2C1C(=O)CC2=O,0.2072
CC1=CC(C=O)C2CC12,0.2128
CC1(CN1)C(O)C1CN1,0.3044
OCC12CNC1C(=O)O2,0.2376
COC(C)C1COC1C,0.3058
CC(=O)Cc1cnoc1,0.2265
C1C2OCC11CC=CC21,0.2427
O=CN1CCC1C1CO1,0.265
N#CCC1OC2COC12,0.2993
CCc1ccccc1F,0.2326
C1CC2(C1)C=CC(=O)O2,0.222
Cn1ccc(c1OC)N,0.2194
OC1C2CC(=CC12)C#N,0.1947
CC(=NO)CCOC=O,0.2519
CC1COC1C(C)=O,0.2147
CC(O)C1CC(=O)O1,0.2861
C1CCCC(CC1)O,0.331
OC1CC=CC2OC12,0.2396
CC1CCNC(C1)C#N,0.2794
N=C1COC(O1)C#N,0.2858
CC1(C)CC2OCC=C12,0.2341
CCN=C1OC2CC12N,0.2614
CCC1C(OC)C1OC,0.2975
CC(C)C12CC1OC2C,0.3002
CC(C#C)C1(CC1)C#N,0.2986
CC1C2OC2C2C1N2C,0.2956
CN(C)C(C)(CO)C=O,0.2027
O=C1NCC11OCC=C1,0.2244
CC(C)C1(O)COC1=N,0.2819
CC1(CC=O)NC1C#C,0.2064
CC(C)C(C)CC#N,0.3481
c1cc(oc1C=O)N,0.1678
CC12CC3C(C#C)C1N23,0.284
CC1OC1C1COCO1,0.3414
CC12C3C4CC(C1C4)N23,0.3173
CC1C2CN1C2(C)C=O,0.2061
N=C1OC2CC12N1CC1,0.255
N=C1OCC2CC1CO2,0.2842
CCn1c(=O)cccn1,0.1724
CNC(=O)C(=O)N(C)C,0.2068
OCCC12CN1CC=C2,0.2304
OC1C2C3N2CC=C13,0.1681
C1C2OCCOC12,0.3093
CC1CC=C(C)C(C)O1,0.2607
CC1C2CC3C=CC1N23,0.218
OC1=NC=CNC1=N,0.1631
C1CC23COCC2C3O1,0.3178
CC1OC2CC2(CO)O1,0.3249
OC1CCCC(=O)C1O,0.2121
CCC(=O)C1CC2CC12,0.2228
Cc1c(ocnc1=O)C,0.2085
CC12CC1CC(N2)C#N,0.2615
OC1CCC2NC2C1O,0.3025
N=COC1=COC(=O)O1,0.2291
CCC12C3OC4C(C14)C23,0.3094
Cc1c(coc1N)C#N,0.1877
CC(=NC)OC(=O)C=O,0.1763
CC(C=O)C1(O)COC1,0.2196
CC#CC1C2CC=CC12,0.2358
CC1NC(=O)C1C=O,0.222
CC1=CCCC(O)C1,0.2619
C1OC1C12OC1C1NC21,0.2749
CC(C)C1OC2CC12,0.3119
COCC12NC1CC2=O,0.2207
NC12C3CC1N3C2C#N,0.2624
CC1OC2CC(C)(O)C12,0.2986
CC(O)C1=CC(=O)CC1,0.1924
C1OCC2NC2CC=C1,0.2436
Cc1ncc(o1)OC,0.23
CN1C2CC2N=C1C=O,0.1515
C1CC1CC(=O)CC#N,0.2212
CCc1cc(on1)C,0.247
CC(C)(CCC=O)O,0.2303
Cc1cc([nH]c1O)C=O,0.1712
NC(C#N)C1COC1=O,0.2579
C1C2CC=C3C=CC1C23,0.1951
CCNc1ccc([nH]1)O,0.2342
CN1C2CC3(CCO3)C12,0.2948
OC1C2OCC2NC1=O,0.2681
c1c2n(nn1)CCCO2,0.2371
C[NH2+]CC(O)C([O-])=O,0.2654
O=C1C2C3OC1OC23,0.2018
OC1(CC1)C1(CO1)C#C,0.2716
C1N=COC2C3OC1C23,0.2609
CCOCC1CC1C,0.3368
C1OC1C1OCC11CC1,0.3044
C[NH2+]CC(=N[O-])C1CO1,0.1544
COC1CC1C,0.3346
NC(=O)CC12CCC1O2,0.269
O1C2C3C1C21OC=NC31,0.2494
CCn1c(cnn1)CO,0.2473
OCC1COC1CC#N,0.2906
C(#N)c1c(c(n[nH]1)N)N,0.181
CC#Cc1cn[nH]n1,0.2177
CC1OC2CNC12C#C,0.2506
CC(C=O)C(N)=O,0.2073
OC1C2C3OC1C(O)C23,0.3013
OC12CCC1(NC2)C#N,0.2462
Cc1c(cnc(n1)F)F,0.2137
OC1CCC2CN3C2C13,0.2927
CC1(O)C2C3C1CC23O,0.317
COC(=O)C=O,0.1821
CC1C2CC11OCC1C2,0.3173
CCC12C3C4N1C2C34C,0.2753
CC1(C)C2C3OC3C12C,0.2814
CNc1nc(co1)N,0.2222
c1cc([nH]c1C(=O)N)O,0.1907
CC1CCC(C)C(=O)N1,0.2672
CC1(O)C2CC3(CO3)C12,0.3184
C(C(=O)CO)O,0.2348
COC1C=CCOC1C,0.2488
CC(C)(C)C(=O)CC#N,0.2312
CC1=C(C=CC=CC1)C,0.1817
CC1(CC1)CCNC=O,0.2832
CC#CC1OC2CC12,0.2599
O=C1NC=NCC2CN12,0.2435
CC#CC1OCC11CC1,0.2686
C1CC=CC(=O)COC1,0.1794
CC1=CC(CC1)C#C,0.2587
CC1COC(CC#N)O1,0.3041
Cn1c(nc(n1)C#C)N,0.2144
CC1OCCC=C1CO,0.26
O=C1NC2C(C3CO3)C12,0.2525
N#CCCC1CCCO1,0.2991
CC1C2CCCC2C1=O,0.2146
NC=[NH+]C1=COC(=O)[N-]1,0.0984
CC1C=CC2CCC12,0.258
OC1CCC2NC12C=O,0.2141
CC1OCOC11CC1O,0.3136
O=C1CC2C1COC2=O,0.2175
CC1C2CC(C)C12C#C,0.2657
OCC(C=O)C1CC1O,0.2054
C1C=CCC2OC2C=C1,0.2432
C#CC12C3CC1CCC23,0.2698
C#CC1=CNC(=O)C1,0.1819
CCCN1C2COCC12,0.3047
OC1C=CC2CC12C#N,0.2428
CC(C)C1(C)CC=CC1,0.2654
CC1CC(C)=CC1CO,0.2485
C1NC23C=CCC2OC13,0.2179
CC1C(N1C)C(=O)CO,0.2184
COCC1(CN1)C1CC1,0.3167
C1COCOC(=N1)CO,0.2624
CC(C=O)C1=NNC=C1,0.2182
CCC1(C)CC1C1CO1,0.3415
OCC12CC(O1)C2=NO,0.2558
c1c(cc(nc1O)O)N,0.2258
C#CC(=NCC#N)N,0.2223
CC(=N)OCC1(C)CO1,0.2936
CC1OCC(CO1)C=O,0.2189
OC1CC11N=CNC1=N,0.2069
CN1C(C=O)C(O)C1=N,0.1967
CCC1CC(C)CC1=O,0.2189
c1c(c(n[nH]1)CO)N,0.2181
N=C1NC=CCNC1=O,0.2053
C#Cc1c(nc(o1)O)N,0.1884
CCC#CC#CC1CC1,0.2138
c1c(c[nH]c1N)N2CC2,0.2271
CC1CCC=C2CCC12,0.2552
CC(C)C(O)C(C)C#N,0.3098
c1c(nc(o1)CCO)O,0.2207
CC1CN1C(=O)C(N)=O,0.1969
CC12CC(O1)C21CO1,0.3265
NC(=O)C(=O)C(O)C#C,0.173
CCc1c(c([nH]n1)N)O,0.2353
O=C1CCC2C(C#C)N12,0.2335
OCC12CC(C=O)C1N2,0.2135
N=C1OCCC1C1CO1,0.28
CC12CC(O1)C(C)(O)C2,0.3088
Cc1ncc(c(n1)F)O,0.2091
C1CC23OC12CC1OC31,0.3228
Cc1cn(cc1N)C,0.2264
N#CCC1C=CC2OC12,0.2441
C(C1CO1)C12CCC1N2,0.3265
CC1CC2(C)COC12,0.3109
COc1c(nno1)CO,0.2136
CC12OC3(C)COC1C23,0.2948
OC12CC(CC1)C2C#C,0.2968
c12c(nc([nH]1)N)onn2,0.1834
[O-]C(=O)C12CC(C1)C[NH2+]2,0.2245
O=CC1COCC=C1,0.2138
Cc1cc(cnc1)C,0.2239
OC1C(O)C11CN2CC12,0.2615
C(C=O)NCC(=O)C#N,0.1608
CC1CCCOC1,0.329
C1CCc2c(non2)C1,0.2492
CCC1C2NC2C1=NO,0.2383
CC1(C(=O)C=CN1C)C,0.1829
CC1CCC1OC(C)=O,0.2832
CC1C2C3(C)NC3C12O,0.2756
ON=C1CC2CC12C#C,0.237
CC1=CC(O)C2CC2C1,0.2578
CCC(O)C12CC1CC2,0.3162
CC1CC1C1CC(=O)O1,0.2833
C#CC1(CC1)C1CCO1,0.2866
N=COCC1CCO1,0.2783
c1(c(nnoc1=O)N)F,0.1596
Cc1c([nH]nn1)CCO,0.2444
CCOC1OCC=C1C,0.2611
C1CC1N1C2C3NC3C12,0.2642
CCC1CC(O)C(C)=C1,0.2574
CC1OC2C(C)OC12,0.3116
CCC#CC(CC)C#N,0.2855
CC12COC1C21CCO1,0.2712
OCCN1C2CC1C2O,0.2984
OC1CN2CC1C(=O)C2,0.2015
N1C2C1C1OC3C2OC13,0.289
Cn1c(cnn1)N2CC2,0.2356
OCCC12CC3C1CN23,0.3062
CCC(C)(O)CC#CC,0.2898
OC1C(CC1C#N)C#N,0.2938
c1cn2ccnc2cn1,0.1814
OC12C3CCN=C1NC23,0.1907
CCC1CC=CC1CC,0.261
CC1CC(O1)C1CO1,0.326
N=C1C2OC3C4C3N1C24,0.2149
CC#CCC1CN1C=O,0.2499
NC1(COC1)C(O)C#N,0.2613
CC1N=CNC1=N,0.228
COC(C#C)C(O)C=O,0.2276
CC1(NC=O)C2CCC12,0.2727
CC12CC3C1OC=NC23,0.2583
CCOC1C2CC1N2C,0.3056
CC12NC1(CC=C2)C#N,0.245
CC1CC1OC1COC1,0.3186
CCC(OC(C)=O)C#N,0.2849
O=COC1CC1C#N,0.2762
CCC#CC1C2CN1C2,0.2583
CC1C2OC3CCC3C12,0.3058
CCC(=O)C(=O)NC=O,0.1638
O=C1COC2CC2CO1,0.2661
c1nc(no1)N(=O)=O,0.2032
CC1(C)CC(O1)C1CN1,0.309
CC1(C)COC(C1)C=O,0.2155
C1C2CC11COC=NC21,0.261
CC1OC2CC1(O)CO2,0.3065
CNC(=O)C(N)C#CC,0.2596
CC12CC3CN1C2C3=O,0.2191
CC12C3C4CN1CC2N34,0.277
CC(O)C12CCC1C2O,0.3097
CC12CC1(C)COC2,0.3292
CN1C2C3OC4C3C2C14,0.2369
C#CCOC1CN2CC12,0.2658
COCCCC(C)C#N,0.2986
CC1(O)C(O)C1CCO,0.2947
CC1=C(C)CC(O)C1,0.255
CCC1CC(C)C(C)C1,0.3698
CC1CCC1CCC#N,0.3353
CC#CC1(O)C(C)C1C,0.2652
CC(=O)C1C2OC1C=C2,0.2049
C#CC(C#C)(C#C)N,0.2608
COC1CC(C)(C)CO1,0.339
CC1CC2OC(C)C12C,0.3066
CCC1C2CC(=O)C12O,0.2217
OCC(C1CN1)N1CC1,0.313
COCC(O)C1CN1,0.3125
CCC1CC=CC1=NO,0.1937
OCC1(CCOC1)C=O,0.2238
CC1(CC1)c2cnno2,0.2211
N#CC1OC2CNC1C2,0.2634
O=C1CC=CC11CO1,0.2054
ON=C1CN2CC12,0.2344
CCC1OC(C)CC1C,0.3199
C(#N)c1c(nno1)N,0.1727
CC1C=CNC(=N)C1=O,0.1606
c1cnc(=O)ncc1N,0.166
O=C1OCC1CN1CC1,0.2593
OC12CC(C1)(CC2)C#C,0.2969
CCC1CCC(=O)C1C,0.2187
CC12OC(=O)C1CC2O,0.2787
CC1=CC=CCC(=O)C1,0.2012
N=C1OC2(COC12)C=O,0.2141
CN1C(C=O)C1C#C,0.1939
CC1N2CC2(C)CC1=O,0.2022
CC1CC(C)=CC2NC12,0.2392
O=CCN1CC1CC#N,0.2239
CC12CC1NC(=O)N2,0.2845
CC1CNC1C#N,0.2655
CC1C2C3C2C1C3C#N,0.3074
CCC1COC(C1)OC,0.3392
CC1(C)OCCC(=N)O1,0.2765
CNc1nc(co1)OC,0.2212
C#CC12C3CC4C(C13)N24,0.2503
NC(=O)C1CCC(=O)N1,0.2544
Cc1c(nc[nH]1)C(=O)C,0.2046
COC(C#N)C(C)C#N,0.3007
CCC12C3C1C1C3OC21,0.3231
c1c(c(cnc1F)O)F,0.2068
Cc1ccc(=O)cnc1,0.1523
Cc1cc2n(n1)CCC2,0.2594
CC(CC#N)OCC=O,0.2289
CC12CC(O)(C#C)C1O2,0.2745
c1nncn1CC#N,0.2505
c1c(nno1)C#CCO,0.2032
CCC1CC(O)C2NC12,0.3072
C1CCC(=O)C1,0.2226
C1CC2C3OC2C3CO1,0.3072
CC(C)(C#C)N1CC1,0.2817
NC1(CC#N)CC2NC12,0.2712
O=C1COC2CCC=C12,0.1754
COC1=NOC(=N)N1C,0.251
CC1C2CC3CCC3C12,0.3228
CC12CC3C1N3CCC2,0.3087
N#CC1CC2(COC2)O1,0.2567
CC1=CC2CC1(C)C2,0.2366
C(c1c(nn[nH]1)CO)O,0.2438
CC1CCC2COC1O2,0.3227
Cc1c(c(n[nH]1)O)N,0.245
C1CC2(CCC=CC2)O1,0.2658
CCC(C)(O)CC(N)=O,0.2704
Cn1cc(cn1)N,0.2212
O=C1CCC2CC1CO2,0.2249
Cn1nc(nn1)CC#N,0.2623
OCC#CC1CC1CO,0.2712
OC(CCCC=O)C#C,0.2283
Cc1coc(nc1=O)O,0.2155
CC(O)(CC1CN1)C#N,0.2627
CC1C2C(C)C(=O)C12C,0.2232
O=CN1C2C3N4C3C1C24,0.2526
C1C2C3CC4C1C4CC23,0.3173
OCC12OC1C1OCC21,0.2907
CC12CC(N=CO1)C2=O,0.1974
C1CNC=CC1=NO,0.1798
C1CC23CCC(CC2)C13,0.3313
CCC1COC1C1CN1,0.312
CCC12CC1OCOC2,0.3284
OC1C2OCCCOC12,0.2963
OC1CCCOC=NC1,0.2538
OC1C=CC(=O)C2CC12,0.1883
CN1CC1(C)C1(C)CC1,0.305
CCC1C2(O)COC12C,0.2895
COc1ncnn1C=O,0.2124
CC1(O)C2C3C2C2C3C12,0.2895
Cc1ccn(c1)C=O,0.1922
Cc1c([nH]c(n1)O)NC,0.2409
CC1OCC2CC12,0.3382
OC1=CC=C(F)OC1=N,0.1657
C#CC1CN(C1)C(=O)N,0.273
CC#CCC1(CN1)C#C,0.283
NCC1=NC(=N)C=NO1,0.1883
CC1CCOC2CC2O1,0.3155
CC1OC(=N)N(C)C1=N,0.2471
CCN1CC11COC1C,0.3086
c1cnnc(n1)NC=N,0.1606
CC1C2OC1C2C1CO1,0.3223
CC1C2C1C1(CO1)C2=O,0.2153
NC1=N[N-]C(=[NH2+])N=C1N,0.1724
CC12CN1C(=O)NC2,0.2882
c1nnn(n1)CC2CC2,0.2654
c1cnc(cn1)C=O,0.1655
C1COC(=N1)C(F)(F)F,0.2591
C1OC1C1OCC2NC12,0.3146
c1ccc(cc1)C=O,0.1921
OC1CC2(COC2)C=C1,0.2487
O=CC12NC1COC2=O,0.2077
CC12CN(C1)CC2=O,0.2055
NC1COCOC1=O,0.2492
CC1OC2=CNN=C2O1,0.2255
C#CC#Cc1ccno1,0.1735
CC1CC2NC2C(C)O1,0.3096
CC(C#N)C1CC2NC12,0.285
CC1C(O)C(C=O)N1C,0.1892
CN1CCC(O)C1C#N,0.2539
OC12CC(OC1)C2=O,0.2036
O=C1C2C3CC1OC23,0.2074
CC(C)Oc1n[nH]nn1,0.2275
c1c(onn1)C#CC#N,0.1794
COC(=O)N1CC=CC1,0.2431
C(C1CN1)C1=NOC=N1,0.2191
COC1CC(CO)C1O,0.3179
CN=C1NC=CC11CO1,0.189
CC12OC1CC2(C)C,0.3255
CC1CC(O)CC1(C)O,0.3288
CC(C)C(=O)C#CC#C,0.1827
CC1=CC2C(O)C2C1,0.2345
O=CNC1CC2(CN2)C1,0.2736
CC1NC(=O)C(C=O)=C1,0.1688
CC1CC2(C)C=CCC12,0.2601
CC(O)C1CC=CC1O,0.254
N=C1OC=CN1CC#N,0.2205
CC12CCC1(CO)CO2,0.2967
CC1C2CC(C=O)C12,0.2207
CC1(CO1)C1(O)CC1,0.3236
c1c(n2c(o1)ncn2)N,0.2228
CC1COC(=O)C11CC1,0.2769
NC1=NC2CC2(O)CO1,0.2526
CC12CC3OCC1OC23,0.2971
COc1c([nH]cn1)C#N,0.1989
OC1CC1C1CC(=O)C1,0.2216
CC1=NC(=N)OC=C1F,0.1625
COC1C=CCC1C#N,0.2551
OC12CC3CC(C13)C2=O,0.2241
CC1C(C)C11CC2NC12,0.306
CCC(C)CC(C)=O,0.2337
CC1N(C)C(=O)C11CC1,0.2737
C1Cn2c1c(c(n2)N)N,0.2163
O=CC(=O)C12CC1OC2,0.1514
N=C1OC23CC(C2)NC13,0.2525
OC1CC2CC(C2)C=C1,0.2512
N=C1C=NON=C1C=O,0.1617
CC(C)C1CC2OC2C1,0.3348
CCOCC1COC1,0.3274
COC12CN3C4C3C1C24,0.2996
O=CC1(NCC=C1)C#N,0.2005
CCC1(O)C(C)C1C,0.3138
c1c(c2c([nH]1)cn[nH]2)O,0.2016
C1C2C=C3CN4C1C2C34,0.1803
Cc1c(=NC)ccon1,0.1848
C1CC1C2=CCNC2=O,0.2207
CC(O)C1CC2(C)OC12,0.3136
CC12CC1(OC2)C1CO1,0.2953
CC1CC(=O)OCCO1,0.271
CCN1C(=O)C2CC12C,0.2483
CCC(=O)C1NC1C#C,0.2207
C1CC(C1)(CC=O)C=O,0.2276
CN=c1[nH]cc(o1)C#C,0.173
O=C1CC=C2COC2C1,0.2165
C1C2CC3C4C3C2C14,0.33
C1CC11C2CC1C=C2,0.2368
CCC12C3CC(C13)C2=O,0.2432
CC(C)COC(=N)C=O,0.1938
CC1C2CC1(OC2)C=O,0.2125
OC1C2C3CC1(C#N)N23,0.2658
COC1OCC=CC=C1,0.1916
C#CCC1=CCOC1,0.2437
COC1(CC=CC1)C=O,0.2137
CCC1C(C#N)N1CC,0.2606
CNC(=O)C1(CO1)C#C,0.2536
N#CC12CC1C1CN21,0.2483
CC1CC(=O)C11CN1C,0.2013
CC(C)(O)C1CC1O,0.3115
O=C1CN2C(C3CC3)C12,0.2167
COC1C2C3C(O)C2C13,0.3207
NC12CC1N1CC21C#N,0.2395
CC(C)(C(C)(C)OC)O,0.3214
C1COC(=O)OCC=C1,0.2502
COC1C2C3C1OC23C,0.3047
CC#CC1OC(=N)C1N,0.2602
COCC1CC2C(C)N12,0.3042
CC1(C)OCC2CC1O2,0.3162
C#CC12CC(CO1)C=C2,0.2412
CC(C#C)C1CCC1,0.3124
COC1C=CC(C)C1O,0.2615
CC1N2C3COC3C12C,0.2745
CNC(=O)COC(=O)N,0.2779
NC(=O)CC1(CN1)C=O,0.2091
CC1(C)CC(O)C11CO1,0.3102
CC#CC1OCOC1=O,0.256
OC1(CC2CC12)C#C,0.286
C#CC12CC(C1)N1CC21,0.2726
O=CC12CC1CC(=O)O2,0.2296
c1[nH]c(=O)c(c(n1)F)F,0.1929
CC(C)Nc1cc[nH]n1,0.2241
C1CC1CNC(=O)N,0.3006
C1CC1C#CC1CCO1,0.2604
C1CNc2c1c([nH]n2)O,0.2389
O=CC1(CC#N)CCO1,0.2126
CC(CCC#C)C1CC1,0.3145
CC1CN1C1CC(C)C1,0.3015
CCOCC(=NO)C,0.2554
OCC(OCC#C)C#N,0.2757
COC1CC2OC1C2=O,0.2343
N#CC1NCC11CCN1,0.2491
CC(=O)COC(=O)NC,0.233
CC1=COC(=N)C(O)=N1,0.1658
Cc1c(ccc(n1)O)O,0.1893
C1OCC2=CCOCC12,0.2519
c1c(cn(n1)CCO)O,0.2303
COC(C)C(=NO)C#C,0.2072
CCOc1c[nH]c(=O)[nH]1,0.2375
CCCC1=CCC2CC12,0.2464
CC12NC1C(C)(O)C2O,0.3063
CC1CCC=CCCO1,0.2522
OC1C(O)C2(CC2)C1O,0.2942
COC1=NC2C3CN1C23,0.2445
C1C=CC2CC=CC12,0.2636
C#CC1=CC2CCC1O2,0.2027
NC(CO)C(F)(F)F,0.3104
O=CNC1COC2CC12,0.2667
CC12NC1(CO)CC2O,0.3124
C1C2NC22COC=NC12,0.2611
CC(=O)N(C)C1(CC1)C,0.2621
OCC1CC2CC1C2,0.3407
c1cn(nn1)CCC=O,0.2202
OC12CC3OCC1(O)C23,0.2802
CC12CC=C(CO)C1O2,0.2447
C#CC12CC1OCC2,0.2759
CC(C)(C)CCCCO,0.3359
O=C1CCCCC2OC12,0.2185
CC1=CCC(=O)CC1=O,0.1898
OC12CCC1COC2=N,0.2784
COC(C#N)C(N)CO,0.2625
C1CC23NC4C2NC34C1,0.2851
OC12CC1N1N=CC=C21,0.2282
CC(=NO)C1OCC=C1,0.2356
C1C2N1C1CC22OCC12,0.2861
CCC1CC(C)(N1)C#N,0.2692
Cc1cn[nH]c1CC=O,0.2016
COC1CC1(C)CO,0.3105
CCC1=CCCNC1=O,0.2122
c1c[nH]c2c1onn2,0.1928
CC1OC2CC2C11CN1,0.304
C1OC1C1=CCC2OC12,0.2322
CC(=O)CC1NCC1=O,0.2145
NC(=O)N1CCC1C=O,0.211
O=C1CC2CN2C11CC1,0.2073
CC12CC3(CO3)C1N2,0.3338
c1c(cn[nH]1)OC=O,0.2441
CC(C(N)C#N)N1CC1,0.2787
CN=C1C=NNC(C)=N1,0.1728
OC1CCOCC11CN1,0.2957
CC1OCC1(O)CCO,0.3024
C1C2CC11C=CCC21,0.249
NC1(C#N)C2C3OC1C23,0.2687
O=C1CCOC1C1CC1,0.2135
CN1C2C(O)C1C2C=O,0.2069
CNc1ncnc(n1)F,0.2166
Cc1c(c(no1)O)C#N,0.2304
CC1=C(COC1=O)C=O,0.1758
CC1CC1C1CN=CO1,0.2722
CCn1cc(cc1C)C,0.2379
CC(=O)C#CC(=O)C#N,0.1694
C1=CNC(=O)C1=NO,0.149
c1[nH]c(=O)nc(n1)F,0.2124
CC1(C)NC11COC1=N,0.2632
CC12OC3CC1CC2O3,0.3365
CC1CC1(O)C(O)C#N,0.2926
CNC1=CN=CC(=N)O1,0.1484
CC1(C)COCC2CN12,0.2943
OCC1OCC1C#C,0.2835
COC(C)C1NC1C#C,0.2681
CCC1C2COCC12,0.3244
CC1=CN(CCC1)C=O,0.2101
CC1CN2C1CC2=O,0.2377
COc1c(nco1)C#C,0.2109
OC(CNC=[NH2+])C([O-])=O,0.2585
CCCC1(CCC1)OC,0.3204
COCC1N2CC1(O)C2,0.3124
CC1C2C(=O)NC12C=O,0.2149
CC1C2C1C1=CN=NN21,0.2365
C1OC23C=CC(C=C2)C13,0.212
COC12CC1(O)COC2,0.3126
OC12CC1(O)C(C2)C#C,0.2751
N=COC(=O)C1CC1,0.251
O=CC1C2CC1C2,0.2206
CC12OCC11CC2OC1,0.2746
CC1CCC(CC=O)C1,0.2285
CC1(O)CN2C(C#N)C12,0.257
CNc1cc([nH]n1)C=O,0.1474
NC(=O)CN1CC1CO,0.2732
c1c(c(ncn1)N)CO,0.2202
CC1(O)CCCOC1=O,0.2673
CC1C2C3OC4C3C1C24,0.3143
c1cn(nc1N)C=O,0.1896
C#Cc1c(c(on1)N)N,0.1907
COC12CC1(O)C1OC21,0.3054
CC12CC(C)(C)C1(C)O2,0.3157
CC1C2C1C1OCOC21,0.3344
CC12OC1C1C3CN1C23,0.2962
CC1N2C3C(O)C2C13C,0.2908
COCCn1cnnc1,0.2661
OC12CC1CC=C2,0.2485
CC1CC11C2CC1C2O,0.3339
CC1COC1CNC=O,0.2785
COCC(=O)C(C)C#N,0.2322
CCC(CC)C(C)C=O,0.2264
CCC(C)N(C)C=O,0.2725
CC1CC1,0.3738
CC1CN1C1CC(O)C1,0.3143
CC1C2CC2C(O)C1=O,0.2205
O=CC1CC(=O)CC=C1,0.2066
OC1(CC2NC12)C1CC1,0.3127
CC12C3CC1(CN23)C#N,0.2637
CCC1(CC2CN12)C#N,0.2754
CC1CC11C(C)CC1O,0.3221
CC1C2OCC2C1C=O,0.2142
CCC(O)C(=O)CC#C,0.2279
CCc1cnn(c1)CC,0.2524
O=C1CC23CC(C2)CC13,0.2261
Cn1ccnc1CC=O,0.187
COC12CC(C1)(C2)C=O,0.223
CC1CC11CCC(C)C1,0.3391
c1nc(no1)OCCO,0.2485
CC1(C=CC(=O)CO1)C,0.1773
CCCC1(CC1)OC=O,0.2762
C(CC1COC1)C1CO1,0.3219
CCc1cc([nH]n1)C,0.2574
C#CC12CN(C1)CCO2,0.2539
OC1CN2C(C#N)C12,0.271
O=C1OCC1CC#C,0.2704
OC(C#N)C1CN1,0.2604
OCC12CCC1N1CC21,0.2879
CCC1C2C(=O)NC12C,0.2519
O=C1CCC2NC2C1,0.2236
O=CC1C2CC3CC3C12,0.2175
CCOC1(C)CC1CO,0.3231
c1c(c[nH]c1N)CCO,0.2368
CC1(CC1)C(=O)CC#C,0.221
CC(O)C1CCC1=O,0.22
CC1(C#N)C2OCC12O,0.2692
C1COC2C3OC3C2C1,0.3166
CC(C)(C#CC#C)O,0.2261
CC1OCC2=NNN=C12,0.2322
C1NC11C2C3CCN2C13,0.3151
CC1CC23CC2(CO3)O1,0.2791
CCC1C(=O)OC1(C)C,0.2779
CC1CCC(=O)CC1O,0.2213
CC12CC(C1)(C#N)C2O,0.3013
CC1NC1C1CN=CO1,0.2719
CC1CN2C3C4OC13C24,0.276
c1cnn(c1)CCO,0.261
COCC1OCC(=N)O1,0.2926
CCC12COC1CCO2,0.3219
C1CC1C(=O)OC2CC2,0.2807
CC(=O)C1=CNC(=O)C1,0.1793
COC12CC1C(=O)C2,0.2314
CCC12CC1C1CN1C2,0.2968
OC1CC1N1C=NC=N1,0.2663
CC(=O)C12COCC1O2,0.217
OCC12CC3C(C=C1)C23,0.2396
N#CC1CC11CCOC1,0.2868
CC12CCN3C(C13)C2=O,0.2185
CCN=C(C#N)N1CC1,0.2065
CC1C2C3OCOC2C13,0.3388
CC(=O)n1cc(nc1)O,0.1729
C1CC11C2NC1C21CO1,0.3205
OC1C2CC1C2CC#N,0.3028
CC1CC(C)(CC#C)C1,0.3091
C#Cc1cnn(n1)C=O,0.1895
c1c(coc1N)C#N,0.1927
O=CNCC1OCC1=O,0.2128
COCC(C)C1(C)CC1,0.3358
OC1C2NC2C(O)C1O,0.3094
C1OC1C12CC1C1CN21,0.2788
[O-]C(=O)C1[NH2+]CC2NC12,0.264
CC(C)CCCC(=O)N,0.2788
CCC1OC1(C#C)C#N,0.2599
c1coc2c1c(c[nH]2)N,0.2122
CCC(C)(C)C(C)(C)C,0.3606
Cc1c(cc(o1)N)CO,0.2139
CCC1=NC=CC(=N)O1,0.181
OC1C2CC1(O)C(O)C2,0.3094
CC(C)C1CN1C(N)=O,0.2862
CC12OCC1C(=O)C=C2,0.1883
COC(=O)N1CC(=O)C1,0.2199
OC(C#N)C1=CC=CO1,0.2253
NC(=O)C1C2CC3C2N13,0.2689
CC1CN1C1=COC=N1,0.215
CCC1OCCC11CC1,0.3292
COC1CC2COCC12,0.3113
CC(CC(C)=O)N1CC1,0.2298
c1c(non1)CN2CC2,0.2137
OC(CC=O)C(O)C=O,0.1957
COC(C)C1OC1CO,0.3294
CC1=CC2C3CC2C1O3,0.2454
CCC1(O)C2OCOC12,0.3031
CC(C)(CO)CC1CO1,0.3316
Cn1ccc(n1)CC=O,0.2161
CC1C(=O)C2C(O)C12O,0.2273
CCc1ncc(o1)C=O,0.1927
CC(O)C1OC11COC1,0.3122
COC1COC(C)C1=O,0.1961
COC1(CC1C)C(N)=O,0.2655
N=CN1CC2NC2C1=O,0.2175
C1C2C3CCC1OC23,0.3024
CC1(CC1)C(=O)C(=N)N,0.1952
CC1C2N1CC2(O)C#C,0.2552
OC12CC1OCC1NC21,0.3009
C1C2C3CC4OC4C2C13,0.3419
Cn1ccn2c1nnc2,0.2146
CC1C2CC(N1C)C2=O,0.2002
O=CC1OC=NCC=C1,0.2128
C1CN1CC2OCCO2,0.3233
CC(C)C1C2CC2C1=O,0.2255
CC12CC(CC1=O)O2,0.2131
CC(O)CCCC(N)=O,0.2782
CC1OC(C)(C#C)C1C,0.281
OC1CCOC1C1CO1,0.3272
CC1CC2CC(O2)C1C,0.3143
CC1CC11COC1(C)C,0.3178
CC(O)C(C=O)C(C)=O,0.2047
Cc1nc(c(o1)C#N)O,0.1974
FC1=C(F)C(=N)OC=C1,0.1715
CC1COC2=C1C=NO2,0.226
CN(C=NCC#N)C=O,0.2364
CN1CC(N)C(C1)C#N,0.2554
CC1(C)CC1C1CCO1,0.3235
C1C=C(C(=O)CN1)C#N,0.1553
CCC1(O)CC1C1CO1,0.3251
CC1CC(O)CC1C,0.3298
OC1CC1C(=O)OC=N,0.2237
O=C1C2CC1C1(CO1)C2,0.2293
CC12C(OC1=N)C2C#N,0.2678
CC12CC3OC(=O)C1C23,0.2657
OC12CC1C=C(C2)C=O,0.1906
CCOCC1C2CCN12,0.3063
c1nc2n(n1)CC=C2,0.1965
CC1N(C)C1(C)CCO,0.2902
COC(C#N)C(=O)CO,0.2302
O=C1C=CC2CC=CN12,0.1757
O=CC1(C#N)C2CC1O2,0.2021
c1c(oc(n1)N2CC2)N,0.2176
CC1NC(=O)C11CN1C,0.2554
CC(O)C1(O)C(O)C1O,0.2884
CC1=C(C(=O)CC1)C,0.1988
CC(O)C12CC(C1)CC2,0.3271
CCNC(=NC)C=O,0.1611
CCCC(C)OC=O,0.2847
C(CCOC=O)CO,0.2833
CC12CN1C(C=C2)C#N,0.2312
CCCc1ncccn1,0.2086
N=C(CC1CO1)OC=O,0.2495
c1c(nnnn1)N2CC2,0.1715
N=C1OC(OC=O)C=C1,0.2187
CCC12C3CC=C1CN23,0.1729
NC1=NCC(C#C)C1=O,0.1782
C#CC1C2CC1(C2)C#N,0.2792
N#CC12CC1OCO2,0.2619
C1C2CC1N=COCC2,0.2434
CCC1OC11CC(C)C1,0.3293
CC12CC3C4C1C2N34,0.2958
CC1=CCOC(=N)C1,0.2571
CC1=CC2CC2(C)CC1,0.2398
CC1CCOC1C,0.3208
CCC1COCC(=O)O1,0.2614
CC1C2OC(=N)CC12C,0.2708
CN(CC1CN1C)C=O,0.2657
N#CCC12COC1CO2,0.2784
CC12COC(CN1)OC2,0.2859
C1C2CN=C3OCC3C12,0.2655
OC(C#N)C1CC1C#N,0.3003
CCCc1cnc[nH]1,0.2486
CCC(=N)OC(=O)CO,0.2435
c1cc(c(nc1)O)F,0.2105
Cc1c[nH]c(c1OC)O,0.2374
CC1C=CC2NC2C=C1,0.231
c1cncc(c1CO)O,0.2152
Cc1cccnc1F,0.2248
OCC12COC1C1CN21,0.2831
CC1(CO)C2NC1C2O,0.2967
CC(C#C)N1CC(=O)C1,0.2153
c1c[nH]c(c1O)CCO,0.228
COC(C=O)C(=O)C#C,0.1819
COC12C3C1C1(C)C2N31,0.2774
N=C1ON=NC(=N1)C#N,0.1455
O=CC1(C=O)C2CCC12,0.208
CC#CC(C)NC(N)=O,0.2862
CC1C2C3N1CC23C#C,0.2592
OC1CC2N=COC12,0.2639
COC1CC(C1)C#C,0.2967
CC12CC(C)(O1)C2C#C,0.2768
CCCC1OC1(C)C#N,0.3003
CC1C2OC3C2C13O,0.2884
O1N=NC=C2N=CN=C12,0.1287
C1C=CCN1C(=O)N,0.2398
N=C1CC2OCCC2O1,0.2827
c1c2cn[nH]c2ncn1,0.2003
CCC1(NCC1C)C#N,0.2723
OCC1N2CCC12C#N,0.2555
OC12C3C1N1CCC3C21,0.287
CCC1C(C)(O)C1(C)O,0.2854
COC1C(C)C1C(N)=O,0.2661
Cn1c(c(cn1)O)N,0.2281
CC1CC2C1COC2=O,0.2696
C1OC1C12COC1CN2,0.2793
COC1CC2CCC2O1,0.3324
CC(C)OC(CO)C=O,0.2135
c1c(n[nH]n1)C2CC2,0.2438
CCN1CCN=C1OC,0.2661
CC12CC(N1)(C=O)C2O,0.2087
C1OC11CC2C=CCC12,0.2627
CCCC(C#C)C1CO1,0.307
COC(=O)C(C=O)C#C,0.2147
CCC1C2CC1C(=O)N2,0.26
O=C1CC2C=CCCN12,0.2456
C1C2CCCC3OC3C12,0.3356
CNc1cnc(cn1)N,0.1563
CC1C2C(O)C2C1C,0.3163
CC(C#C)C1C(C)C1O,0.2997
CCC(CC)COCC,0.3361
Cn1c(c(cn1)N)C#C,0.1857
COC(=O)C(O)CCO,0.266
CC1OC2CC(O)C12C,0.3036
C1C2CC3=CNN=C3C12,0.2469
C1CC1C2CCOCC2,0.3332
OC1(CC1CC#N)C#C,0.2738
N#CC1=CCOC2CC12,0.2111
N=CN1CC2CC2C1=O,0.2249
C1C=CC(=O)OCC1=O,0.1931
CN=C1OCCOC1C,0.2593
Cn1cc(nc1)N,0.2207
CCC1(C)CC2OC12,0.3327
CC1(CCCO1)C1CO1,0.3285
OC12C=CCC1NC2=N,0.2441
NC1=C(O)N=CC(=N)O1,0.1285
C1OC2C11OC22COC12,0.1989
OC12CC1CC2=O,0.2253
CCCN(C=O)C(=O)N,0.2531
CC1C2(C)CC1(C)C2=O,0.2441
CC1(CCCC1=O)C=O,0.2009
CC1(C)COC2COC12,0.3231
CC1OC2C(N)C12C#N,0.2504
CC(=O)C1(CO1)C1CC1,0.2229
CCC(C)(C)C(C)(C)O,0.3247
CC(CCN1CC1)C#C,0.2909
COc1cnn[nH]c1=O,0.1833
C[NH+]1CC(CC([O-])=O)C1,0.2542
c1cnc[nH]c1=O,0.1966
COC12CC3CC1C2C3,0.323
CCC1=CCC2(C1)CC2,0.2586
CNC1C(O)C1C#N,0.2497
CC1OCC2=NOC=C12,0.2366
CC1=NCC=CC(=O)N1,0.2058
CC1NC2C(C#N)C12N,0.2635
CC1C2C3OC2C13C,0.3081
CC1=CC2OC2C1(C)O,0.2391
C1C(CO1)OC(=O)C#N,0.1947
CCc1[nH]c(c(n1)C)O,0.233
CNC(C)(COC)C#N,0.2686
CC1C2CC(=O)C(C)N12,0.1997
Cc1cc2c(o1)OCC2,0.2162
N=C1OC2CC11CCC21,0.2696
CCC(=O)C(OC)C=O,0.1988
C1CC1(CCN2CC2)O,0.2932
N#CCC1OCC=C1,0.2481
COC1CCC(O)C1=O,0.1979
COCc1c(nn[nH]1)N,0.2167
CC1(O)C2CC1CCC2,0.3177
O1C=NC2C3C=CC2C13,0.2265
COCC(C)N=COC,0.2693
CC1CC(O)C2OCC12,0.31
CCc1cc(n[nH]1)NC,0.2216
CC12OC3(C)C1COC23,0.3137
C1CC2CC(CCO2)O1,0.3102
CC12OC1C(O)C2C#N,0.2887
C(C#CC(=O)C#N)O,0.1885
c1c[nH]c(c(c1=O)O)F,0.1932
CC1=NON=C1C1CN1,0.211
C1C=CNC(=O)OCO1,0.2263
CC1C2C(OC12C)C#N,0.262
CC1CNC(=N1)C#N,0.1986
CC(=O)C1(CC1)C,0.2319
CC#CCC(C)(C)C#C,0.2882
CC1C=CCC1C(C)=O,0.2265
CC1CN1CC#C,0.2667
C(C#CC#N)C(=O)C=O,0.1548
CC1C2OC1(CO)C2=O,0.2426
NC(=O)CC1COC=N1,0.2381
CC12CCC1OCOC2,0.3234
CC1OC2CC(C2)C1C,0.3115
CCC#CC1(CC)CO1,0.2786
CCC1C2N1CC21CO1,0.3099
N=C1OC2C3CC(C3)C12,0.2868
O=C1CC2CCC12,0.2181
CC1(C)OC=NC1C#N,0.2709
CCC1CC2CC12C#C,0.2691
C1C=CC2COCOC12,0.2595
CC1CCC2(C)OC12C,0.3291
CCC1C(O)C1(O)CO,0.2795
CC1(CC1O)C#N,0.3108
C1CC12C(=O)COC2=O,0.2135
CC1CC(O)C2(CN2)C1,0.3048
CC(O)(C=O)C#CC#N,0.2001
CC1CN1C1CC1C=O,0.221
CC1(O)C2C3CC1CC23,0.3301
CC(=O)COC1CCC1,0.2326
Cc1ncoc(=O)n1,0.2026
Cn1cc(c(=O)cn1)N,0.1681
COc1c(oc(n1)N)O,0.2165
CC1CN1C(CO)C=O,0.2203
CCc1c(cccn1)C,0.2266
CC12CC1CNC2=O,0.2701
CC1C2C1C(=O)C2C#C,0.2181
N#CC12CC3OC1C23,0.2677
OC1C2NC1C2C=O,0.205
C1CC(=O)CC(=C1)CO,0.2233
Cc1conc1COC,0.2458
N=C1NN=NC(=O)C=N1,0.1543
N#CCC1CC11COC1,0.2841
CC(=O)COC(=N)C#N,0.2058
C1CC1C1OCC11CC1,0.3146
ON=C1CC2CC2C1,0.2505
C1C2CC3=C(NC=C3)N12,0.2325
O=C1NCC2(CC12)C#N,0.2547
CN1C2CC3(O)CC1C23,0.2787
CC(O)C1=CC=NO1,0.2447
C1CC(C1)C#CC(=O)N,0.2301
CCC12CC1(OC2)C#C,0.2416
CC1(C)OC2CC(O)C12,0.3031
c1c2c(oc1N)CCN2,0.2044
CCC(C)(O)C(C)C=O,0.2266
CC1OC(=N)OC11CC1,0.3051
CC(O)C(=O)C1CCO1,0.2157
CC12CC(O)(CO1)C2O,0.2985
CC1CC11C2C3CN1C23,0.3118
O=CC1CCC=C1,0.2167
CC(CC#N)NCC#C,0.2721
CC1CC2C=CC(=O)C12,0.1878
C#CCOc1cnc[nH]1,0.2214
C1C2COCC3CC3C12,0.3201
CC1(CCC(=O)CO1)C,0.2107
CC1[NH2+]CC=C1C([O-])=O,0.1581
CC12N=COC1CC2=O,0.2063
CC(C)(OC=O)C1CO1,0.2751
COCC1NC1CC#C,0.3018
CC1CC(=O)OC(C)=N1,0.2496
C#CC12CCC1CCO2,0.2847
OC1C(OC1=O)C1CO1,0.2607
CC1CN1C1CC1CO,0.3057
C(CC1CO1)CC1CO1,0.3565
O=CCC1C=CCC1=O,0.2142
CC1CCC1CC1CC1,0.3476
CC1C2NC2C11CO1,0.3043
c1nc2n(n1)nco2,0.2356
CC1(C)CC2OC12C#N,0.2736
COC1(C)C2CC1OC2,0.3153
CCC(O)CCNC=O,0.2808
c1c[nH]c(c1N)O,0.2392
CC1OC2CC2O1,0.3401
CC(=O)Oc1ccn[nH]1,0.2114
OC12CC1CN=COC2,0.2563
Cc1c(cccc1N)N,0.2079
O=C1NC=CC2CN12,0.209
CC(C)(C)CC(O)C=O,0.2357
Cn1c(ccn1)C#N,0.2222
O=CC1(CC1C#N)C=O,0.206
CN=C1CC(=N)OCO1,0.2625
NC1C(=O)OC2CC12O,0.2523
CCC1NC(=O)OC1=N,0.2703
N#CC1C2COC1C=C2,0.2404
OC12C=CC3CC1OC23,0.2404
C1CC2(C1)COCO2,0.3314
C1CN1CCCN2CC2,0.3201
CCC1C(O)C(C)C1O,0.296
C#CC#CC1(CC1)CO,0.2169
COC(C)C(=O)CC#C,0.2265
N#CC1(CC2CC12)C#N,0.2937
CC1OCCC1(C)C#N,0.2933
N=C1OCC2COC12,0.2609
COC=NC1CC1(C)C,0.2458
O=C1CCC11CC2NC12,0.202
C(C1CN1)N1N=NN=N1,0.2092
OCC1CCCCCO1,0.3293
C1CC2(CC2)C(=O)C1=O,0.1448
CC(O)CC1NC1C=O,0.2162
CC#CCCC(=O)OC,0.2588
CCOC1CCC2CC12,0.3253
CC#CC1(CO)CN1,0.2735
O1C2C1C1OC2C2OC12,0.3109
C(=O)C(=O)C(=O)C(=N)N,0.1453
CC1(CO1)C1NC1C=O,0.2196
c1cnoc(=O)c1O,0.1825
CC1C2C=CC1C2(C)O,0.2374
c1nc(c2n1CCC2)O,0.2244
CC1CC2CCC1C=C2,0.2635
C1CC(O1)C1=NON=N1,0.195
CC1CC2(C)C(O)C12C,0.3064
C1OC11CC2OCOC12,0.2996
CC12COC1CC=C2,0.261
N#CC1CC2C3OC2C13,0.2739
C1OC2C3COC12C=C3,0.2417
NC(=O)CC1CCCO1,0.2709
COC12C3CN(C13)C2C,0.2979
C1C(=CC(=O)N1)CCO,0.2162
CC12C=CC3C4C(C14)N23,0.2215
C1CN1C12CC1C=CC2,0.232
c1nc(c(o1)CO)O,0.2172
CC1COCOC(=N)O1,0.2952
c1c(c([nH]n1)N)CC=O,0.1771
CC12CC1C1CC2C1=O,0.2364
CC1=CC(O)C(C1)C#C,0.253
CC1=CCCOC1C#C,0.2594
CC(C)C1OC=NC1C,0.2658
C1C(=O)NC(=CN1)C=O,0.1626
CC(OC=O)C#CC=O,0.203
[NH3+]C1C(O)C1(O)C([O-])=O,0.196
C1COC1=NCC=O,0.2242
CCCC12NC1C1CC21,0.284
CC(O)C12CC1OC2=N,0.2784
CC1N=C(N)COC1=O,0.2459
NC(=O)C1C2COCC12,0.2691
CC1=CC2C3OC2C13,0.2243
C1CC1C#CC#CCO,0.2119
COC12C(O)C1OC2C,0.2909
CC1CC1(CC#N)C#N,0.3094
CC1(CC2(C)CO2)CO1,0.3417
CCC1CN1CC(N)=O,0.2714
C#CC1=NC2CC(C2)O1,0.2177
CC12OC1C1COC21,0.2972
CN1C2COC2C1=N,0.246
C1CC11OC2COC12,0.293
CC1C(CC11CO1)C=O,0.2254
CC12OC3C4CC1C2C34,0.3023
OCC(=O)C1OCC1O,0.2042
c1c(=O)n(ncn1)C=O,0.1502
CC1(CO)C2CC1O2,0.3048
C1CC2C3COC2C1C3,0.312
OC1CC2CC3NC3C12,0.2985
O1N=NC2=C1ON=N2,0.1794
CN1C2C3OC2C13C#C,0.2427
CNC1C(C)OC1C#N,0.2409
CN(C=O)C(C=O)C#C,0.1978
OC(CC#C)C(=O)C=O,0.1569
CN=COCCC#N,0.2742
CCCCC12CC1OC2,0.3031
OC1COC(C1)C1CO1,0.322
CN1CC2(C1)CCCO2,0.2844
c1c(ocn1)C#CC#N,0.177
CN=C1ON=NNC1=N,0.204
CC1(CC=O)CO1,0.2243
CC12CCC(C1)C(=O)O2,0.2758
CCC1=CC(C)C(=O)C1,0.2227
CC1(O)C2OC(=N)C12O,0.2538
OC1CC2=CNC=C2C1,0.2424
CN1CC2OC2(C1)C#C,0.2328
CNC1=NC(C)CC1=O,0.1759
CC1OCCC1CC#C,0.2962
O=C1N=NN2CCC2=N1,0.168
CC1OC11COC1C=O,0.217
CC(O)C#CC#C,0.2248
N=C1OCC=CC11CO1,0.2421
O=CN1C2CCC2C1=O,0.2175
OCC12C3NC1COC23,0.2707
OC1C(O)C(C#C)C1O,0.2749
c1cnn(c1)C(=O)C=O,0.1657
CC1CC11CC2CC2O1,0.3073
OC1C2OCOC12C#N,0.2584
OCC12CCC1(O)CC2,0.3112
c1c[nH]nc-2ncnc12,0.1726
CC1C(O)CCC1C=O,0.2255
CN=C(CC#N)NC=O,0.2294
COC(CC#C)C#CC,0.2865
N#CC12CC1C1CC1O2,0.2701
COC1=C(O)OC(=N)O1,0.2437
CC1(C)CC11CCC=C1,0.244
OC1(CC1C#C)C=O,0.2006
CC1C2N3CC2(C)C13,0.3165
O=C1COC(CO1)C#C,0.26
[O-]C(=O)C12CC1CC[NH2+]2,0.2654
CC1(C)CC1C1CCC1,0.335
CCC1NC11COC1C,0.3091
C#Cc1ncccn1,0.2006
CN1C2C3COC2C13,0.3027
O=CC1C2C(CN12)C=O,0.2031
c1c-2ncnc2ocn1,0.1722
OC1C2CC1(C#C)C2O,0.2944
CC1(O)C=CCC1CO,0.2603
ON=C1C2OC3CC2C13,0.2445
CCC1C(C)OC1=O,0.2794
CC(C=O)C1C2CCC12,0.2235
O=C1C=C2CC3OC1C23,0.1695
C1CC(=CCC=C1)CO,0.2529
CC1=C(N)C(=N)N=NN1,0.1581
CC(O)C(CCO)=NO,0.245
CCC1C(C)C2CC12O,0.3114
CC12OCC3CC1C2C3,0.2976
CC1(C)N2CC1(C2)C=O,0.1867
OC1CC2OCC3C1C23,0.3049
CC1C(O)C2OCC12O,0.2958
COC(CC#CC)C=O,0.2069
CC12C3CC1C(C)(C)C23,0.3245
CC12OC3(CC1C23)C=O,0.1991
CC#CCc1ncno1,0.235
ON=C1CCCC1C#N,0.245
CC1(C#N)C2CN1C2,0.2602
COC(C)C1COC=N1,0.2679
CC1CC1(O)C1CC1,0.3251
CCC12CC(C=C1)C2C,0.2364
CCC(=O)CCCC=O,0.2236
CC1C=CC2=C1ON=C2,0.1992
COC1=CN=NOC1=N,0.1704
CC(CCO)C1CN1C,0.2984
N=C1OCC2(OC12)C#N,0.2545
NC(C#N)C1CCCO1,0.2807
C1CN(C1)CC(F)(F)F,0.3071
Cc1ccnc(n1)NC,0.1901
OC(C#N)C1=CNN=C1,0.2525
C1CC2(C1)CC(C2)O,0.3333
OC1CC2CC12CC#N,0.2891
CC12OC1C1NC1C=C2,0.2396
Cc1c(ccc(=O)[nH]1)O,0.1559
CNc1cc(oc1N)N,0.21
CC1(C)NC1C1CC1O,0.3088
NC1C(NC11CC1)C#N,0.2495
CC(=O)C(O)C(F)(F)F,0.2417
CCC1COC11CC1,0.3015
C1Cc2c(nno2)C=C1,0.1867
NC1=C(OC=N)N=NO1,0.2007
CCC1CN(C)C(=O)N1,0.2902
C1C=C(COC=N1)CO,0.2344
N#CC1CC2CN2C1,0.273
CC1C([NH3+])C1C([O-])=O,0.2721
C#CC1OC23CC(C2)C13,0.2584
OC1CC2CCC1C2,0.3331
Cn1nc(nn1)C=O,0.1988
CN1CC(O)C(=O)C1=N,0.1637
CC12C3OC1COC23,0.2882
C1OC(=O)C=CC(=O)O1,0.1958
CC1(C)CN2CC12C#N,0.2563
CCOC1CC11COC1,0.3099
COC1CNC1(C)C=O,0.1975
CN=C1CC(C)C(C)O1,0.2755
OC1CCCNCC1=O,0.1976
O=C1NCC1C#CC#C,0.2161
OCC(=O)C1OC2CC12,0.2177
OC(C=O)C#CC#N,0.2129
Cc1c(oncc1=O)C,0.1848
N#CC12NC3C(C=C1)C23,0.2175
C1NC11CCN2CC12,0.3076
COCC(C)OCC#C,0.2867
CC12CC1(O)C(C2)C#C,0.2901
COC1OCCC1(C)C,0.3356
CC1=CC(=O)OCC=C1,0.1842
OCC1N2CC1(CO)C2,0.2948
COC12CC1(OC2)C#C,0.2427
C1c2c(onn2)N=CO1,0.1826
CCCOC(C=O)C#C,0.2056
c1[nH]c2c(n1)[nH]c(n2)O,0.2119
COCC1=CCC(=O)N1,0.2125
OCC1CC2NC2C1O,0.2999
OC1=COC(=N)C(=O)O1,0.1603
c1nn(c(=O)o1)CCO,0.2417
CNC(C)C(F)(F)F,0.3089
CC(O)C1(C)CC(=O)C1,0.2215
CC1(CC#C)CCCO1,0.2919
OCC1(CC#C)CC1O,0.3063
CC#CC(C#C)C(C)=O,0.221
CCC1NC1(C)CO,0.3052
C1CC1COC(=O)CN,0.2619
CC1(CC=O)CCC1O,0.2247
Cc1c(oc(=O)o1)C#C,0.1997
O=CNC1C2C3OC3C12,0.2684
CC1C=CC2C1N2C=O,0.239
CC1C=CC2C1OC2=N,0.2571
CC(O)C(=O)OCC=O,0.2293
N#CC1NC11CC=CC1,0.2666
C1COc2c(nno2)O1,0.1932
C1C2(CO1)COCOC2,0.325
OC12CC(C1)C(=N)OC2,0.2873
CC1(C)OC1CNC=O,0.2822
CC(C=O)C1CC(C)C1,0.2249
CCC1(O)CCOC1,0.3024
O=C1CCN2CC2CO1,0.258
CC1CC(O)(C1)C#N,0.3007
CC(=O)NC(=O)OC=N,0.2352
NC12C3C1N1C3C21C#N,0.2343
CC12NC1CC2(C)CO,0.2928
CC12CC(C1)O2,0.3319
CC1CCC2OCC2C1,0.3193
CCN(C)C(C=O)C#N,0.202
CC1C2CCC(C#N)N12,0.2695
OCC1(O)C2CC1CC2,0.3138
OC1C2CC=CC(O)C12,0.2515
CCCC(=NO)C1CN1,0.2341
O=C1C2CC(C#N)C1N2,0.236
CC1CC(N)=CC(=O)N1,0.2099
N=C1C2CC3N1C23C#N,0.2642
c1c2n(nn1)C=CCN2,0.185
C[NH2+]CC(=NO)C([O-])=O,0.1622
N=C1COCOC(=O)N1,0.2486
OCC1CN=CO1,0.269
NC(=O)N1CC1CC#C,0.2803
Cn1cncc1NC=O,0.2024
COC1OC(=O)CC=C1,0.2586
CC1(CO)CCC2NC12,0.3031
CC1NC(C(N)=O)C1=O,0.2031
O=CC12CC(O1)C(=O)C2,0.1912
COCCC1CCC1O,0.3207
CC1(CO)CC2(CN2)C1,0.3042
OC1CC2C1NC2=O,0.2697
OCC12OC3CCC1C23,0.2945
OCCCCC(O)C=O,0.228
C1C2CC34COC3C1C24,0.3096
CC12CCCC=CC1N2,0.2308
CC12CC3N4C1C4C23C,0.2929
CCC(CO)C(C)C#N,0.2903
COC(C#N)C(N)=O,0.25
COCC1CCCOC1,0.3271
CC1=NC(=N)OC(=O)O1,0.2286
CCc1c(cno1)C,0.2386
OCC#CC1CCC=C1,0.2573
CC(O)CCC(C)=O,0.2354
CCC(C)N(CC)C=O,0.2671
COCC1C2CC2C1O,0.3158
CC1OC(C)C(O)C1O,0.2906
C1NC11COCC2OC12,0.3156
O=C1NC2CC1COC2,0.266
CC#CCC(=O)C(=O)N,0.1736
CC1OC2COC2C1O,0.3019
N#CC1CC11C2CN1C2,0.2793
CCC#CC(O)C1CN1,0.2684
CCN=C(C#N)NC=N,0.1969
CC(O)CC1OC1C#N,0.2755
Cc1cc(cn1C)C#C,0.216
CC1=C(C(=O)CC1)CO,0.1944
CC1=C2CN3C(C23)C1O,0.1689
N#CC12C3CN1CCC23,0.2571
OC1CC1C1C2CCN12,0.2943
CC(CO)C(C)(C)CO,0.3324
CN=C1C(O)CN1C=N,0.2147
Cc1c(nn[nH]1)N(C)C,0.2048
OC(C#C)C1=NC=CO1,0.2428
CC1(COC1)C(=O)NC,0.2741
CC1CC2(COC2)C1C,0.3033
C1OC11C=CC2CC1C2,0.2399
CCC12OCC3C1CC23,0.3285
CCOC(C)(C=O)C#C,0.2052
CN1CC2(C)OC(=O)C12,0.2305
CC(=O)C1(C)CC1CO,0.2278
Cc1coc(cc1=O)N,0.2057
COCC1CC2NC12C,0.2995
CCC12C3NC1C(=O)C23,0.2215
C1CC11C2OC3CN1C23,0.2761
CC12CC(C1)C1OC21,0.3368
C1CC(C1)N2CC2,0.3125
CCCc1cc([nH]n1)C,0.257
CC1CCC2=C1C=NN2,0.2477
c1c(c(n[nH]1)N)CCO,0.2256
C1OC2OCC3OC1C23,0.3243
CCCCC1COC1,0.3205
COC12C3CC(C13)C2O,0.3089
CC1CCCOCC1,0.3243
O=C1CC(CN1)C1CC1,0.2744
COCCNCCC#N,0.2746
CC12C=CC3(O)C1NC23,0.2217
CC(C)C(C[NH3+])C([O-])=O,0.2744
c1c(c(cnc1N)F)O,0.2026
OCCCC(O)C=O,0.2292
CC1(CC1C1CC1)C#N,0.3032
CCOC(CC)C#C,0.3013
c1c(c(c(o1)N)O)N,0.2204
C1CN1CC(C=O)C=O,0.1974
OC(CCCC#C)C#C,0.2882
NC(=O)C(=N)OC=O,0.2162
N=C1OC2(CC2)C11CO1,0.2585
CCC1C2C3C(C)C2C13,0.3672
Cc1nc(no1)CC=O,0.2224
CC1C(C)C11CC2OC12,0.3263
N=COCC1(CC1)C=O,0.2243
CC1C2CC2(C)C1CO,0.317
CCC1OC1C(C)C#N,0.3078
N=C1COC(=N)N1C=O,0.228
CC1CC1N=CNC=O,0.2134
OC1(CC1C1CN1)C#N,0.2584
N=C1NC(=O)CC2NC12,0.2374
O=CNC12CC(C1)C2,0.2766
C#Cc1cn[nH]c1N,0.2227
COCCC1=CCCC1,0.2583
CCC1(C)C(O)C1(C)C,0.3084
C1C2CCCC3OC2C13,0.3142
CC(O)CC1CC1(C)O,0.3106
CC12C3C4C5C(C5N13)C24,0.3077
CCC1(CCC=C1)C#N,0.2604
CC1C2NC2(CO)C1O,0.2891
CCC1CC2CC1(C)O2,0.3222
CCC12CN1C(=O)NC2,0.2882
OC1COC23CC12CC3,0.275
CC(=O)C1NC1(C)C#N,0.2155
CN=C1CC=CCCO1,0.2479
CC12CC1C(=N)OC2=O,0.252
C1C2OC3=NCCOC123,0.2607
NC(=O)C1=CCC(O)C1,0.2183
N=CN1CCN=C1C=O,0.1804
O=CC12NC(C=C1)C=C2,0.1897
OCC1CC11C2CN1C2,0.2959
CN=C1NN=CN=C1O,0.1663
CC1C(OC=O)C1(C)C,0.2729
CC1NC1C12CCC1N2,0.3102
CC1CNC(=O)C1CO,0.2734
C1C2C1C1CC2CC=C1,0.2616
CC1(NC(=N)C1O)C#C,0.2664
CC1=CC2(C)CC2C1=O,0.1896
CC12CC3C1C2C1CN31,0.3164
C1OC1C1C2C3CC2N13,0.3175
C#CC1CCOC2CC12,0.2976
CC(C)C1OCC11CN1,0.3066
CCC1CC2OC12,0.338
CC#CC1=C(CCC1)C,0.2034
CN=COCC1CCO1,0.2721
CC1C2OC(C)=NC12C,0.2566
CC12OC1C1CC2C1,0.3382
N#CC1CC2NC2CN1,0.2792
C(C#N)C(C=O)C=O,0.2077
NC1(COC2CC12)C#N,0.2725
CC1=CC2N3CC2(O)C13,0.2199
c1c(nno1)CC(=O)N,0.2307
O=CC1=CCC2(CN2)C1,0.1901
CC1=CCCC2(C)NC12,0.2402
CCOCC,0.3414
Cc1c(cco1)N(=O)=O,0.177
CCN=C1CCC(=O)N1,0.2417
N#CCC12C3C4C(C13)N24,0.2531
C1CC1CC#CC(=O)N,0.234
OC1C2OC3C2C3C1=O,0.2112
CC1C=CC(C#N)C1C,0.2623
C#CC12OC1CC21CN1,0.2571
CC1OCC2C3CC1N23,0.3146
OC12CC3CC1CC23O,0.282
CCC1C=CC2CC12O,0.2445
OC1C2C(C1O)N2C=O,0.245
C1CC2C3CC=CC2C13,0.2484
CC12CC3COC(C1)C23,0.3167
CC1OCC2OC12,0.3436
OC1C(NCC1=O)C=O,0.197
CC1C2OC(C)C(=O)C12,0.2198
CC(C)CC1COC1C,0.3157
NC(=O)C1=NC2CC2N1,0.1895
CC1C2CC3C(C)C3C12,0.3004
CCC(CC1CO1)=NO,0.2517
C(C(=O)C(=O)NC=O)O,0.1639
CC(C=O)C1=CC=CO1,0.1941
CC(C)C(OC=O)C=O,0.2228
c1c2c([nH]n1)OCCC2,0.2465
COc1coc(=O)o1,0.2556
CC(=NO)C1=CCOC1,0.191
CC12CC(C)(C1)C2,0.3864
OC1CC11OCC1O,0.2937
C1CC11OC2C3OC3C12,0.2829
C#CC1(CC(=O)C1)O,0.2185
OCC1(O)CC11COC1,0.2965
N=C1OCOC2CC12,0.272
C1COc2n1nc(n2)N,0.2375
O=CCC(=O)CC1CO1,0.2126
CN1CC(=O)CC2CC12,0.2065
C1C2OC3CCC2C1O3,0.3196
CC1=C(CCC1=O)C#N,0.1742
C1COC2(C1)CCOC2,0.3145
NC1=C(N=CO1)C1CN1,0.2097
CC1(NCC1C#N)C#N,0.2582
C(#CC(=O)C#N)C#N,0.1789
CC(O)C1(O)CC2OC12,0.304
OC12CC3C1COC3C2,0.3123
CC1(O)C2OC1C21CC1,0.3018
OC1CN2C=CN=C2C1,0.2497
CC1OCCC2(C)OC12,0.3373
Cc1cc(cnc1)O,0.2087
CCCC(O)C(C)OC,0.3285
CC1CC(C#C)C2OC12,0.3049
O=C1CC2OC3C2C13,0.2245
CCC1CNC(C1)C#N,0.2711
N#CC1C2CCCCC12,0.3047
CC1CCC(CO1)C#C,0.2994
NC1=C(ON=N1)C1CO1,0.1834
OC12CCC1NC2C#N,0.2556
ON=C1CC2CC12,0.2464
CC1(CC#C)COC=N1,0.2678
C1CC1C12CC1CCO2,0.3058
CC1=C(CCC1=O)C=O,0.1581
COC(=O)N1C2CCC12,0.2725
OC1CNC(=O)C11CC1,0.2705
C#Cc1c(oc(=O)[nH]1)O,0.1966
CCC1NC1C#N,0.2923
O=C1CC2CN3CC3C12,0.2032
CC(O)C(C#N)N(C)C,0.2615
CN1C=C(CC1=O)CO,0.2037
c1cnc(cn1)N=CN,0.1757
CC1(C)C2C3C2C1C3O,0.3229
COC(=NC)N1CC1C,0.264
OC12CC1C(=O)OCC2,0.26
CC12C3CCN1C(=O)C23,0.2429
CC12NC1CC=C2C#N,0.2063
CC(=O)NCCNC=O,0.2697
CN=C1OC2CNC1C2,0.2628
CCN1C2C3CC3(O)C12,0.2984
N=C1CCOC(O1)C#N,0.2816
OC1COCC=C1C#N,0.2239
COC1(C#N)C2CC1N2,0.2703
CC1(CCO1)C#CC#C,0.2212
CCC1OCOC1(C)C,0.3252
OC1CC(=O)C(O)C=C1,0.1942
CCOCC1CC1OC,0.333
C1C2C3C4C5CC1(C24)N35,0.2968
CC12CC3C=CC1OC23,0.2361
CC1CC2=NON=C2O1,0.2216
C(C=O)NCC(=O)C=O,0.1344
CC1(C)C2C=CC(O)C12,0.234
CC(C)C12CC1C(O)C2,0.3219
COC1C2C3C2N(C)C13,0.2777
c1cn[nH]c1N2CC2,0.2415
CC1N2CC(O)CC12C,0.282
COC(C#C)C(C)CO,0.2918
CN1CC23CC4N2CC134,0.2502
COC(=O)N,0.3244
c1c2c(no1)CCC=C2,0.2039
CC1(CCCNC1=O)C,0.2683
CC(O)CC1=CNN=N1,0.2507
OC1C(O)C1CC1CO1,0.285
CC1C(C)C11CCOC1,0.3275
CC12OCC1CC1CC21,0.3164
COCC#CC(O)C#C,0.2647
C1CC1OC(=O)C#N,0.2323
CC1C2CCN2C1C=O,0.19
N#CC1CC2C3CC3N12,0.2454
CC1(CC1C#C)C#C,0.2625
CCC1CC2CC2C1,0.3381
CC(C)C1CNC1C#N,0.263
OC1C=CC2=C1ON=C2,0.1851
CC12C3CC1N3CC2=O,0.2048
CC1CC2OC2(C1)C#C,0.2782
CC1=CC(CC1)C#N,0.2598
CCC1CC1(O)CCO,0.3176
c1c([nH]c(c1N)N)C#N,0.1859
C1C2COCC=CCN12,0.2232
CCC(=O)C(C)(C)C#N,0.2314
O=C1OC2CC11OCC21,0.2495
NC1=C(O)OC(=N)N1,0.2266
Cn1c(c(nn1)N)OC,0.2238
NC(=O)OC1CNC1=O,0.2745
CC(CO)(CC#C)C#N,0.2994
N#CC1CN(C1)C1CC1,0.2638
CN=COCCNC=O,0.2457
Cc1[nH]c(c(n1)O)OC,0.216
c1c2n(cn1)C(=O)CN2,0.1702
O=CN1CC2(CC12)C#N,0.2511
CC1=C(C[NH3+])C=C([O-])O1,0.1516
CC1=CNC(=N)C(F)=N1,0.1583
O=C(C#N)C1NC2CC12,0.1571
CC12CN1CC(O)C2O,0.2917
Cn1c(ccc1O)O,0.2308
COC1C2C3NC2C13O,0.3094
OC1CC(O)(C=C1)C#N,0.2418
O=CCOC(C=O)C#N,0.208
COCC(=O)OCC=O,0.2283
CCC12NC1C1OC21C,0.2764
Cc1c(c(nn1C)O)N,0.2391
CC1CC(O)C2(CC2)C1,0.3193
C#CCC(CO)CO,0.2997
CC1(CCC=C1)N1CC1,0.2422
CC1N(C=O)C2CC12O,0.2598
CCC(O)(C#C)C1CN1,0.2661
C#CC(=O)NC(=O)CN,0.188
COC1C(C)NC1=NC,0.2513
CCC(C)NC(C)=O,0.2781
c1cc2n(c1)C(=O)NC2,0.2158
CCC#CCC(C)(C)C,0.2976
C#CC12C3C4C1CC2N34,0.2516
CCC#CC(C#C)C#N,0.2836
C1CN1C12CC(C1)C2,0.3199
OC12CC1C1CC1C=C2,0.2454
CN(C)C(=O)C1CC1O,0.2474
O=CC12NC3C1NC23,0.2007
C#Cc1cccnc1N,0.1754
CC1(CCO)CC2NC12,0.3064
OC1C2CCC22COC12,0.2949
CCCOCC1CO1,0.3411
CC(C)CC(=O)C=O,0.1561
c1cnc([nH]1)C2COC2,0.2448
CC(CCC1CO1)C#C,0.3144
CC12CC3CN1C23,0.3286
ON=C1CC2CC1CO2,0.2515
OC12CC1(CC2=O)C=O,0.1943
Cc1cnc(cn1)N,0.1823
COC(C)C1COC1=O,0.2748
CCOC1CCC1OC,0.3155
CCc1c(cnn1C)C,0.2463
CN1Cc2ccoc2C1,0.224
c1c[nH]c(c1C=O)C=O,0.1698
OC1CC(O)(C1)C#C,0.2792
CCC1CCNC1C#N,0.2699
CC1NC1C1=NNC=C1,0.2527
CC1CC2CC(C)C12O,0.3115
O=C1NCC2N=COC12,0.2483
CC12CNC(=O)CC1N2,0.2683
CC1CC(CN)(O1)C#N,0.2643
OCC1(CC#C)CO1,0.3015
CCOc1cnc([nH]1)O,0.2504
CC(C)(C=O)N=COC,0.2189
CC1OC2CCC1OC2,0.3133
C(CO)C#CC(F)(F)F,0.2961
O=CN1CC1C1CCO1,0.2521
C#CC1COC1C1CN1,0.2771
Cc1c([nH]nc1N)C#N,0.188
CC1(C)CC2C(CO)C12,0.3245
CCC(CO)CCOC,0.3245
CC(C)C12OC3CC1C23,0.3088
CCCCC1CCC=C1,0.2628
CC(C)OC1CC1C,0.3134
N#CC1OCC11CO1,0.2747
OCCOC(C#C)C#N,0.2566
Cc1cc2c(o1)cn[nH]2,0.2078
COC1CC1(O)C#C,0.2592
C1C2C=CC11CCOC21,0.2354
COC1C2CC1(O2)C#C,0.2501
OC1CN=COCC=C1,0.2437
C(C1CO1)C1=NOC=N1,0.2457
CC1COCC1C#C,0.3016
CC(=N)NC(=O)NC=N,0.2355
OC1CC(=N)OC11CC1,0.2735
C1OC2C1N1C3CC1C23,0.3095
CCC1(C)CCCC=C1,0.2666
N#CC12CC3C(CC1)N23,0.2709
CC1C=CC2NC12C,0.2419
N#CC1CC2CN1C2,0.2716
CCC1(C#N)C(N)C1N,0.2636
CC1OC(C#N)C1N,0.2586
c1c(=O)c(noc1F)N,0.1909
NC(C#N)C1=CN=CO1,0.2329
CCN=COC1COC1,0.2726
CN=C(c1cnno1)N,0.1954
OC1C2C=CCC=CC12,0.2342
COc1c(ocn1)CN,0.211
CCOC1(C)CC1O,0.316
COCC12CN(C1)C2,0.3059
Cn1cncc1N(=O)=O,0.1798
NC(C#C)(C#N)C1CC1,0.2719
CC1C2CC2OC2CC12,0.2909
c1c[nH]cc1NCCO,0.2272
CC1CC(O)(C1)C=O,0.2299
CC(=O)N1C=CC2CC12,0.2031
CC1CC23CN(C2)C13C,0.2568
C#CC1C2CC2C1C#C,0.286
C#CC12NC3C4C1N4C23,0.2463
ON=C1CCC2(CO2)C1,0.2469
CCC1CC2COC2C1,0.3187
O=C1NC2CC(C2)CO1,0.2923
CC1CC1(C=O)C(C)=O,0.2159
CCCC1=CC2CC1O2,0.2326
CC12C3CN(C13)C2=O,0.243
O=CN1CCN2CC2C1,0.2521
C#CC1NC1C#CC#N,0.2186
CC1C2C3NC3C(O)C12,0.293
C1N2CC3CC12CCO3,0.3144
CCC12CC3C1C1C2N31,0.2954
CC(O)C1NC1C,0.3164
CCOc1cc([nH]n1)N,0.2453
CC(=O)C1(COC1)C#C,0.2228
Cn1cc(c(n1)C=O)N,0.1751
COC12CC(=O)C1C2C,0.2293
c1c(ocn1)N,0.2251
CCCCOCC#C,0.2889
c1cnc2ncnn2c1,0.192
CC(C)(COC)OC=O,0.2801
Cc1c(cc(=O)on1)N,0.1787
CC1CC(CC=O)C1C,0.2276
Cc1cc[nH]c1C(C)C,0.2429
COC1C2C3C1C(=O)N23,0.2449
CCCC1OC(=O)C=C1,0.2243
C1CC=CCOCC=C1,0.2556
OCC1C(O)C2CCN12,0.2644
N=CN1CC(C#C)C1=O,0.2221
C1C(=O)CNC=C1C=O,0.1857
COC(C)C1CC(C)O1,0.3263
CC12CC1C1(O)COC21,0.2918
CC1(C)CCC11CO1,0.3356
O=C1OCC11C2CC1C2,0.269
C#CCC#CC1CN1,0.265
O=CC1(CC1C#N)C#C,0.2166
CC1CC1CO,0.3366
C#CCC1NCC1C#N,0.2647
CC(C)Cc1nnon1,0.2432
CC12COC1CC21CO1,0.3079
CCC12NC3CC1OC23,0.2978
CCCC(C)(CO)CO,0.3109
CC1C2C3NC3(C#C)C12,0.2777
c1c(c(=O)[nH]c(n1)N)N,0.1706
COC1CC(OC)C1O,0.3129
CC(CO)C1=NNN=N1,0.2445
c1nn2c(o1)nc(n2)O,0.2117
OCC1CNC(=N1)C#N,0.1952
N=C1NC(=N)C(=O)C=C1,0.1399
CC(CCO)NC=O,0.2814
COC(C#C)C1(O)CC1,0.2798
CC1C(O)C(C)C11CC1,0.3117
OC1CN2C3CC12C=C3,0.2211
CCN1C(C)C(C)C1=O,0.2744
C1OC23C1C1C2COC31,0.2896
C1C(=C(C(=O)O1)N)C=O,0.1678
CC1(NC2CC12O)C=O,0.2002
c1c(c(=O)oc(n1)F)F,0.1916
CC1OC(C)C(C)(C)O1,0.3261
CNc1ccnc(=O)[nH]1,0.1851
OCC1CC(=O)C1O,0.2223
COC(=O)C1(CO1)C#C,0.2479
O=CC12C3NC(C13)C2=O,0.1944
C1CC1C(=O)C2(CC2)O,0.2211
CCc1cn(c(n1)C)C,0.241
O=C1OCC2NC12,0.2526
CCc1c(cco1)OC,0.2159
CCC12CC(=O)C1CO2,0.2177
C1C=CC2OC2C=C1,0.2321
O=C1CNC(=O)C2OC12,0.207
CC1(CCC=CC1)C=O,0.2219
O=C1C2CC11OCC1O2,0.1971
CC#CC12CC(C1)C2,0.2933
C1CC2OC2CCC=C1,0.2642
CC1=C(CO)C(=N)OC1,0.2193
O=CC12CC1OC1CC21,0.2226
N#CC12C=CC3C1CC23,0.2265
CC1OC(C)C2(O)CC12,0.3204
CC1CC(C1)(C#C)C#N,0.2906
OC12C3C1N1C3C(=O)C21,0.2041
OC1CC1N1N=CN=N1,0.221
C#CC1OC11CC=CC1,0.2661
O=C(CC#C)C1CO1,0.2116
C#CC1(CCCC1)C=O,0.2228
CC1C(C)N(C)C1C=O,0.1973
COC1CN2CC12C,0.3043
O=CCNC(C=O)C#C,0.1996
CC(O)CCOC(N)=O,0.3212
Cc1[nH]nc(n1)O,0.2468
NC(=O)C1CN=C(N)O1,0.2563
CC#CCC(C=O)C#N,0.2046
OC1CC2C(C1)C2C#N,0.2954
N#CC1C2CC1C2(C)C,0.3288
CC1(CC1)OC(=N)C#C,0.235
C1CC2C3N=COC23C1,0.2542
CN=c1cc([nH]cn1)F,0.1848
[O-]N=C(CNC=[NH2+])C=O,0.1599
CC1=CC2C3OC(C1)C23,0.2363
CC1(O)CN2N=CN=C12,0.2713
O=CC1CCC2(CC2)O1,0.2055
NC(=O)NC(C=O)C#C,0.2157
OC1COC2CC12C#C,0.2691
NC1=NNC(=O)NC1=N,0.1766
OC1CC(OC=O)C1=O,0.2071
O=CCC1OC1CC=O,0.2219
O=C1C(CC1C#N)C#N,0.2168
CC1CC2OC2C1C#N,0.3094
CC12CC1COC(=N)C2,0.283
c1cocc1NCC#N,0.2265
c1nc(=O)c(no1)C#N,0.1717
c1(c(n[nH]n1)O)O,0.2219
Cc1[nH]c(nc(=O)n1)N,0.213
c1nc2c(o1)CC(=O)N2,0.1967
c1c[nH]nc1C#CC=O,0.1826
CC12CC1(C)NC(=O)N2,0.2844
CC1NC1(C)C1CCO1,0.3079
CN1CC1(CC#N)C=O,0.2162
C1CC(C=C1)(C#N)C#N,0.2618
O=C1CCOC1CC#C,0.2115
CCC12CC1(O)C1CN21,0.3024
CC1(COC1CO)C=O,0.2206
c1c2c([nH]n1)nc([nH]2)O,0.2217
c1nc(=O)nc(o1)O,0.2169
CC1C(C)C(=O)CC1=O,0.1992
OC1CC2CC=CCC12,0.2557
CC12CC(C1)OC2C=O,0.2118
CCC#CC(C)(C)C=O,0.217
CC1C(C)C2CCCC12,0.3373
O=C1CC2CC=CC1N2,0.1997
c1c(=O)occ(n1)C=O,0.1687
OC12CC1C(=O)NC2,0.2647
CC1(CC1CO)C#C,0.2923
CC1CCN2CC2CO1,0.299
CC(=O)OC1CCCO1,0.2806
COC1CC=CCC1O,0.2627
c1cncnc(=O)c1N,0.1655
O=CC12CN1CC=CC2,0.215
CC1OCC(C)C(=N)O1,0.2784
CC1OC(=O)C1(O)C=O,0.2111
c1cnc-2[nH]nncc12,0.1489
CC1(C)C2OC(=N)OC12,0.3007
OC12CCN3CC1C23,0.2886
O=C1CC2(CO2)C=C1,0.1881
C1C2CC3C4OCC12C34,0.319
c1c(cnc(n1)N)O,0.1755
OC1CCC(O)C(=O)C1,0.2124
OC12C3CC1(C3)OC2=N,0.2355
c1cc2n(c1)C(=O)OC2,0.213
CC12CCC11CCC1O2,0.3003
CC1(C)OCOC2CC12,0.3297
NC1(CNC1=O)C#C,0.241
CCC1OC(C=O)C=C1,0.2029
COCCC1(CO)CO1,0.3406
CCC12OC1C1OC21C,0.2929
Cc1nc(=O)ncn1C,0.2032
CC1(O)CC1NCC#N,0.2584
CCC12CC1(C)C(O)C2,0.3126
OC12CC3(COC13)OC2,0.2848
C1C2CC3C4COC12C34,0.317
CCc1cn(c(=O)[nH]1)C,0.2255
CC1(CC(=O)CO)CO1,0.2346
CC1(O)CC1(N)CC#N,0.2746
N#CC1C2C=CC1C2=O,0.2457
CN(C)C(C)(CO)C#N,0.2543
c1c(oc(=O)o1)CCO,0.2498
C1C2C3C4NC4C1CN23,0.2937
c1nc2c(o1)ocn2,0.2211
CC(CO)C(=O)N(C)C,0.2682
OCC1C2OC2C1CO,0.3193
CC#Cc1c(cc[nH]1)C,0.1991
COC1(C)C2NC1C2=O,0.2409
N#CC1CCC1C1CC1,0.3116
Cc1c(nc(cn1)F)F,0.2045
CC(CCO)C#CC#N,0.2446
CCOC=NCC#N,0.2721
CCC1(C)C=CCC1=O,0.2211
NC1=NC(=N)OC(=O)N1,0.2242
CCC1OCC(C)CO1,0.3385
Cc1nc(oc(=O)n1)N,0.2113
CCC12CCC1C(=O)O2,0.2778
OCCCC(=O)OC=N,0.25
Cn1c(ccn1)CC#N,0.2543
CC1C(=N)OCC=C1C,0.2553
C#CC12CNC1CO2,0.2457
CCC1N=C(N)NC1=O,0.2383
Cc1c(c(oc1N)N)N,0.2152
CN1CC1CC(O)C#N,0.2444
CN1C(=O)C2CC1(C)C2,0.2557
CC1(O)C=CCC2CC12,0.2568
OC12C3CC1(O)C(=O)C23,0.2424
CC1CCN(C)C1C#N,0.2597
CC1C2C=CC3CC2C13,0.2467
CC(C)(C#C)OCC=O,0.2292
CCC12CN1C1CC21,0.292
Cc1ncccn1,0.2082
OC(C#C)C1=CNN=N1,0.2552
C#CC1C2CC1N=CO2,0.2476
CCC1=CCC2CC1O2,0.2389
CC1(C)C2OCC12O,0.2836
CC12C3OC1C=CC23,0.2249
CN1CC1C(=O)CC#N,0.1992
OC(C=O)C1CN1C=O,0.2139
CC1(C#N)C(O)C1CO,0.2856
C1OC1C1C2C3CN2C13,0.3157
CCC12CC1(C)C(C)O2,0.3066
CCC1CC2(CN2)C1O,0.3033
Cc1c2c(co1)CCN2,0.2112
CC1C2CCC(C2)C1=O,0.2216
CCCC1NC1C(N)=O,0.2635
CCC1COC11CC1O,0.2894
CCOCC1OCC1O,0.301
c1[nH]nc(n1)OC2CC2,0.245
O=CNC1C2C3C1CN23,0.2628
CCCC(O)C(O)CC,0.3166
CCc1[nH]c(nn1)CC,0.2631
CC(C)CC1OC1C#N,0.2936
C1CN1C(C#N)C#N,0.2608
CN1CC1C(=O)CCO,0.203
c1cc2cnccn2c1,0.1685
CCC(=O)NCC1CN1,0.2749
OCC12C3CC(N13)C2=O,0.2342
CC12CCC1C21COC1,0.3112
C1C2CC3OC4C2C1C34,0.3081
CCCCNC(=N)C#N,0.2111
CC1N=CNC(=O)C1O,0.2251
CC1=CC(O)COCC1,0.2477
CC(C)C1(CO1)C(C)=O,0.2223
CCC(C)(C)C1(CC1)C,0.3382
Cc1[nH]c(c(n1)O)C#C,0.1919
CC(CO)C1CNC1=O,0.2787
C#CC1C2CC3OC1C23,0.2782
C1C2C3OCC=C1C23,0.2105
C#Cc1cc(no1)O,0.2036
CC1CN(C=O)C1=O,0.2176
CC(C#N)C(C)C(N)=O,0.2667
OC1C=CCC2OC12,0.2662
C1CCC(C1)C#CC=O,0.2044
CC1CC2C3C(CN23)O1,0.3164
CC(CO)N1CC1C#N,0.2692
C1OC1C12CC(C1)C2,0.3566
CC12C3CC4C(CC14)N23,0.332
CC(C)N1C(C)C1C=O,0.1947
OC1CC(=O)C2COC12,0.2157
N=CN1CC=CCC1=O,0.2344
CC12NC1C=CC2(C)O,0.2383
C1C=CC23OC12CC=C3,0.226
c1c(c(ncn1)CO)O,0.2008
CC1CC2(NC12)C1CN1,0.2938
COCC1OCC1C=O,0.2128
CCOC(C)C(C)CO,0.324
O=CCC(OC=O)C=O,0.2086
CC1=NC(C[NH3+])=C([O-])O1,0.1816
CCc1ncc(nn1)N,0.1657
CC1(CC1)C(O)C#C,0.2946
FC1=NC(=N)N=NO1,0.2447
CC1=CCC(=O)C1,0.2245
c1nc([nH]n1)N2CC2,0.2571
CC1(CC#C)OC1CO,0.3046
CCC(N)(C#N)C1CN1,0.2707
CC1OC(OC1=N)C#C,0.2845
CC1CC2NC(C1)C2=O,0.2273
CC12CCOC1CC2=O,0.2106
COC(CO)CCC#N,0.3051
c1c(n[nH]c1N)C2CC2,0.2423
Cc1cc(nn1C=O)O,0.2012
CC1=C(CN2CC12)C=O,0.173
CC12C3C1C1OC2OC31,0.356
CC(=O)C12CC1C(=O)O2,0.2199
CC1C2C3N1C(C)C23O,0.2867
CC(=O)CC1CC1C=O,0.2277
O=CC1OC1C(=O)C=O,0.1452
CCOC(=O)NC(=N)N,0.2486
CC1(CC1)C(=O)C1CN1,0.228
c1c([nH]cn1)C2CCC2,0.2454
CC12CC3(COC3C1)O2,0.3183
CC(CNC=O)C#N,0.2804
OC1C(=N)NC=C1C#C,0.1785
C#CC12CC(C1)C21CN1,0.2745
CC12CC3C=CC1C23,0.2347
CN=C(C(=O)N1CC1)N,0.2031
CC1CCC(O)(C1)C#C,0.2992
N=COC12C3C4C1N4C23,0.2345
CC12CC1C1N=COC21,0.266
CN(C=N)C(=N)C(=O)N,0.1966
CC1N2CC3C1(C)C23C,0.3007
C(=O)c1c(oc(n1)O)N,0.1809
C#CCC1CC1C1CC1,0.3037
CC12CC=CC3OC1C23,0.224
CCC1CC(N)C(=O)O1,0.2537
CC1(C)OCCC11CN1,0.3108
N#CC1=CCC2CCC12,0.2187
NC1=NC(OC=N)=CN1,0.2195
CC1([NH3+])CC1(N)C([O-])=O,0.269
CC1OC2CC3C2C13C,0.3214
OC1C=CC2=C1C=CN2,0.1677
C1OC1C1CCC11CO1,0.3244
CC1C2OC(=O)OC12C,0.3159
CC12CC1N(C2)C=O,0.2577
C1C2CC3CC(CC12)O3,0.3138
COCCC1COC1=O,0.2654
COCC(=O)C#CC#N,0.1782
NC1=NC(=N)OC=N1,0.1878
CC12NC1CCNC2=O,0.2586
C1C(CO1)C(=O)C(=O)N,0.1762
CC1=CCC=CC(=C1)C,0.1874
CN=C1NN=NC=C1C,0.1618
CCCC(CO)C=O,0.2278
N#CCC1C2C3CN2C13,0.2772
NC(=O)C1NC=CC1=O,0.1875
CC1C2C(O)C2C1=O,0.2262
COC12C(O)C1CC2=O,0.2195
CCCC(C)C(C)CC,0.3749
CC1(CC1)c2[nH]ccn2,0.2435
COC1OC2C3OC2C13,0.3114
CNC(=O)COC=N,0.2546
CCC1CC(C)C(=O)N1,0.2725
C#Cc1c[nH]nc1C#C,0.2135
O1C2C3C2C2C1C1C3N21,0.3021
COC=NCC(N)C#N,0.2477
CC1(CC(O)CO1)C#N,0.2969
O=C1NC2C3CC1C2O3,0.2672
CC#CC12CN3C1CC23,0.2768
CC(O)C1C2CCOC12,0.3165
C1CCC(C1)CNC=O,0.2824
c1nc2c(o1)OCO2,0.1946
CC(C#C)C1COCO1,0.2973
CCC1(O)CC(C1)C#C,0.2994
CC12C3C4C1C(O)C2N34,0.2865
c1c[nH]cc1NCC=O,0.1639
CC1=CC=CCC(=O)N1,0.1896
CCC12CNC1C2C#N,0.2658
CCC(OC)C(N)=O,0.2651
CC12CC3OC3(C)C1N2,0.3254
O=C1OCC2OCC2O1,0.3001
CCCC(O)CC1CC1,0.3237
C#CC1(CCC1)NC=O,0.2687
COC1OCCC11CO1,0.332
CC1(C)CC11COC=N1,0.2476
C#CCC1NC1C#N,0.2779
CCC1C2COCC1O2,0.309
CC(O)C(C)O,0.3208
N=COCC1COC1=N,0.271
CCC1=NCCN1C=O,0.2252
CC1(C)C2CCC(=O)C12,0.2221
OC1C2CN3CC1C23,0.2705
CC(O)C1(O)CCC1C,0.3122
CCC1=CCC(C)OC1,0.2609
CC1CC(C)(C)C1=O,0.2161
N=C1OC2C1CC21CC1,0.2832
C(=Nc1nc(on1)N)N,0.2125
COCCC#CC(=O)N,0.235
CN1C2CC2C(O)C1=O,0.2521
Cc1cnc(cn1)O,0.1939
COCCn1ccnc1,0.2532
CNC(=O)NCC1CO1,0.305
O=CC12OCC3C1CC23,0.2128
OC12CCC3CCC1C23,0.3218
CC1C2CCOC(=N)C12,0.2692
OC1C2CC2NCC1=O,0.1895
c1cc(ccc1C=O)F,0.1947
c1cc(nc(c1F)O)O,0.1974
C1CC23OC2CN=C3O1,0.2482
CC(CO)N1CC1C,0.3165
CC1OC2C3OC2C13C,0.3089
OCCC(O)C=O,0.2314
c1nc2c([nH]nc2o1)N,0.1991
N#CCC12CC3C1OC23,0.2792
OC(CC=O)CC#C,0.222
CC1CC2=CC(=O)NC12,0.2131
OC1C(CC11CC1)C=O,0.2204
CN=CN1CC(N)C1=N,0.2154
CNCC(=O)C#N,0.1552
OC1CCNC(=N)C1=O,0.184
CC(=O)C12C3C4C3C1C24,0.2176
C1CC2(CC3OC23)O1,0.3099
C(#N)c1c(nn[nH]1)N,0.1873
CCC(C)(O)COC=O,0.2861
CC1OCC1(O)C(C)=O,0.214
O1CC23COC2CC13,0.3077
O=C1OC(CC=C1)C#C,0.2156
COC(=O)C1NCC1O,0.2238
CC1NC2C(N)C12C#N,0.2477
CCCC1OCC2NC12,0.3116
CN(CC#N)C1CC1O,0.2487
CCC1CC(O)C1=O,0.2202
OC1CC2C(CC12)C#C,0.2947
O=CC1C2CCOCC12,0.2174
CCC1=CC2C3CN2C13,0.2105
N#CC12CC(N1)C=C2,0.2371
C1OC2C3OC4C1C2C34,0.2893
CC(O)CC#CC#N,0.2409
CC12C3C(CN13)C2=NO,0.2433
C1C(CO1)(C(F)(F)F)N,0.3174
CC(C)(C=O)C1CO1,0.2216
CCOCC(C)COC,0.3335
CC1C2C3C(CO)N2C13,0.3067
CC1CC(=O)CC=C1C,0.2235
CC1C2C3CN2C13,0.3091
OC12COC3C1COC23,0.2812
CC1(C)NC1C(O)CO,0.3014
CC1=CC=C(N1)OC=N,0.208
CC12CN1CC(=O)CC2,0.199
CC12CC(O1)C2(N)C#N,0.2722
CCCCc1ccc[nH]1,0.2422
CC(C)CCC(F)(F)F,0.4015
CC1=C(C)C2CC2(O)C1,0.2378
O=C1NCC(C=C1)C#N,0.2044
C#Cc1c(c(no1)O)N,0.1805
CC1(O)CN2CC2C=C1,0.2258
[NH3+]CC1=C([O-])OC(O)=N1,0.1801
NC(C#N)C12CN(C1)C2,0.2592
Cn1ccc2c1cn[nH]2,0.212
C(C#CC(=O)C=O)O,0.1505
CCCc1cc(co1)N,0.2192
CC12C=CC3C4C3N1C24,0.2364
C1C2C3OCC=CC1C23,0.2536
CC1NC11C2CC1(C)O2,0.3004
CN=CNc1nnon1,0.1865
OC1C2NC2C2OCC12,0.2976
CC1=CCOCOC1=N,0.2161
CC#CCC(O)C#CC,0.2743
C1CC1(CC=O)N2CC2,0.2015
COCc1ccncc1,0.23
CC#Cc1cc([nH]c1)O,0.2073
C1C2CC3=CC1N1C2C31,0.1708
CC1C2OC=NC(C)C12,0.2704
CC1C2NC2C1(C)C#C,0.2865
CC12CCC1OC2CO,0.3031
CNC1(CCC=C1)C#N,0.2405
CCC1C(C)C1C=O,0.2248
c1cc(cnc1)C#N,0.2123
c1cc(n(c1)C=O)CO,0.1824
CC(C)(C)C(C)(C)C#C,0.318
C1C2NC3=C(N=NO3)C12,0.161
CC1(C)NC1C#CC=O,0.1976
C1C2NC3=C(ON=N3)C12,0.1753
CC1(O)C2NC(=N)OC12,0.2806
CC12CN3C4C(O1)C4C23,0.2734
CC1(OCC1=O)C1CC1,0.2221
C1CC1C(=O)CN2CC2,0.2255
Cc1c([nH]nc1O)C,0.2441
CCC1C2OCCC12O,0.3015
C1CC1C1CCN=CO1,0.2735
CC1N=COC11CC1,0.2587
O=C1CNC2C3OC2C13,0.206
CC1(C#C)C2CC2C1=O,0.2159
CCCC(=O)CC1CO1,0.2336
CNc1ccnc(=O)o1,0.1796
CCC12OC1C(=O)C2O,0.1961
CC1C(CC1C#N)C=O,0.2201
CC12CC(O)C1N1CC21,0.273
CN1C(=O)C=C(C)C1=N,0.1837
Cn1cc(nc1C#C)N,0.1759
OC1(C#N)C2CC1CC2,0.3017
OC1C2COC=NCC12,0.2632
CC12COC1COC2,0.3207
N=CN1CCN=C1C#N,0.184
CCc1cn2c(n1)CC2,0.2533
COCC12CC=CC1N2,0.236
c1coc(n1)C(=O)CO,0.1942
CC12C(O)C3C1CC23,0.321
O=CCC12CN1CCC2,0.2165
CC12C3CC1C3OC2=O,0.2656
OCC1=CCC(O)C1,0.2609
CC#CC(=O)C1COC1,0.1954
C1CC23COCC(O2)C13,0.3216
CC1C2CC(C)C(=O)C12,0.2215
CN=C1ON=CN=C1N,0.177
C1C2C3OC4C3N1CC24,0.2945
CC12N3CC1(O)C2(O)C3,0.2636
c1cn2cnnc2[nH]1,0.2196
CC(O)C(C)OC=O,0.2779
OC1=C(C=CN1)C1CO1,0.2387
N#CC1CCC(=C1)C#N,0.2219
Cc1cc(n[nH]1)N(=O)=O,0.1961
NC(=O)C1NCC11CN1,0.2432
CC1CNCC(=O)C1=O,0.1545
C#CC#Cc1cnon1,0.1828
CN1CC2CC1C(=O)O2,0.2312
C1OC11CC2NC12,0.3059
Cc1c[nH]c(=O)cc1O,0.1853
CC1(O)C2NC1(C)C2O,0.2984
CC1OC(C)(C)C2CC12,0.3286
CC12COC3CC3C1N2,0.3142
C1CC12CC3(C2O)CC3,0.326
CC12CC1(CC=O)OC2,0.2118
Cc1c([nH]nc1NC)C,0.2268
CC1(C)C2C3N2CC13O,0.2901
CC(C)(O)C(O)C#N,0.2883
[NH3+]CC(O)[C-](C#N)C#N,0.1479
COc1c(cccn1)O,0.2038
CC1C=CC(O)C2CC12,0.2613
OC1C2COC1OCC2,0.318
COC(=O)N1CC1C,0.2904
CC1C2CC3C(O)C2C13,0.3184
CC12C3C1C1C3C21C#N,0.252
CC(C=O)C1=NC=NN1,0.2179
c1c(cn[nH]1)NC(=O)N,0.2317
C1CC1COC=O,0.285
OCCC12CC1C(=N)O2,0.2794
C#CCC12C3CC1CN23,0.287
CC(C)c1cc(no1)N,0.2357
O=C1OCC11CC=CC1,0.2648
OCC(OC1CC1)C#N,0.2914
OC1C2OCC12O,0.2891
OC12CC1C(=O)COC2,0.2117
O=C1C2C=CC1C21CN1,0.2418
[NH3+]CC1=C([O-])N=NO1,0.1533
C1=CC(=O)c2c1nn[nH]2,0.1389
CC(C)C1CCCCO1,0.326
CC1CC11COC1C=O,0.2092
N=C1NC2=NCCC2O1,0.2471
OC12CC3(C=O)C1NC23,0.1983
CN1C=NC(=N)C=C1C,0.1882
COC1CC2(CN2)CO1,0.3266
CC1C2COCOC12,0.3278
N=COCC1=CN=CO1,0.2376
O=CC1C2CC2C11CC1,0.2198
CC1(CCOC1)N1CC1,0.3122
C#CC1OCC2OCC12,0.2822
CC(O)CC1C(C)C1C,0.3186
C1CN1c2c(non2)N,0.2137
Cc1cc(ncn1)NC,0.2113
CCCC1(CC1)NC=O,0.2757
CCc1cnoc1C,0.2383
CN1C2CCC2OC1=O,0.2998
C1CC=CCCC#CC1,0.2376
CCN=C1CC=CCO1,0.2526
C1OC11C=C2CC3C2C13,0.1754
[NH3+]CC1OC(=O)[C-]1C#N,0.1844
CN=COc1cnco1,0.2329
CCC(C#N)C(O)CO,0.3127
NC(=O)C(O)C(=O)C=O,0.1434
CCC(C)(C#N)C1CN1,0.282
C1CC(=O)N(C1)CC=O,0.2124
CC1C2COCC(C)N12,0.2883
C1CC2C3C4C(N24)C3=C1,0.2055
O=C1COC2C3CC12O3,0.2055
CC1OC2CC2(C)C1C,0.2979
c1c([nH]nn1)C2(CC2)O,0.2451
CC1OCOC1C1CC1,0.3355
Cc1c[nH]c2c1[nH]nn2,0.2059
C1NC11CN2N=NC=C12,0.2503
C#CC12C3CC1=CCC23,0.1777
CC(C)(CO)N1CC1,0.2953
C#CC1CCOC=N1,0.2687
Cc1cc([nH]n1)C=O,0.1941
CC1(O)C2CC3OC3C12,0.3179
CC1OC(C#N)C2OC12,0.2935
CC1C(C)C1(O)CO,0.303
CC(C)CC1(O)CC1C,0.3147
OCC(O)C(=O)N1CC1,0.2398
OC1(CCC1C#N)C#N,0.2966
OC1C2C3OC=NC2C13,0.2607
CC(O)C1(C)CCC1O,0.3182
CC1(CC=O)CN=CO1,0.221
CC#C[C-](C#N)C(N)=[NH2+],0.1859
CNC12C3NC(C13)C2=O,0.2205
C1CC11C2C3CC1N23,0.3106
N=COCCNCC#N,0.2652
CNC(=NCC#C)OC,0.2671
OC1(C#C)C2C3CC1N23,0.2743
CCC(O)C12CC(C1)O2,0.3204
CC1CNC(=O)OC=N1,0.2506
CNc1ccccc1O,0.2003
NC(=[NH2+])C#CC([O-])=O,0.1245
COC(CCC=O)C=O,0.2069
Cn1cc(cn1)C(=O)N,0.2373
CC(CO)OC(C)(C)C,0.3105
Cc1cc(c(o1)N)O,0.2107
[NH3+]CC1(CC([O-])=O)CN1,0.1715
c1cocc1NC2CC2,0.2174
O=C1CC2OC3CN1C23,0.2457
CC12C3CC(CN13)C2O,0.3026
CC(C#N)C1=CN=NO1,0.2352
CC(NC(=O)C#C)C#C,0.2289
C1CC2(C1)CC1CCC21,0.3335
NC(=[NH2+])C(CO)=N[O-],0.1374
CC1C(=O)NC2CC12O,0.2647
CC1CCOC(C)CC1,0.3233
CCC1(CC1C#N)C#C,0.2689
C1OC11CCC11COC1,0.3091
O=C1CCC1C1COC1,0.216
COCC12CC3C(O1)C23,0.3035
CC12OCC11CC2C=C1,0.2325
CCC(CC(C)C)C=O,0.226
OC1C2CCC12OC=O,0.2654
N#CC12CNC1C1CN21,0.2525
O=CNCCC1CCO1,0.2783
CCc1noc(=O)n1C,0.2512
CC1OCC(C)=C1C#C,0.2037
CCC1=NC(CO1)C=O,0.2134
c1c(nc(o1)CO)CO,0.2404
OC1CC2OC=NC12,0.2538
CC1(C)CC(O)C=C1,0.2595
CC(O)C1OC2CC12,0.3029
CC12CC3(O)C1N2C3=N,0.2731
CN1CC11CCC2OC12,0.3137
CCCC12COC1C2O,0.2907
COC1CCC11CC1,0.3267
CN=C1OCC11CN1C,0.2534
CC1=CC2CC3(C)C2C13,0.2341
N=C1CNCC(O1)C=O,0.2023
CC12CCC(OC1)C2O,0.3176
COc1conn1,0.2023
CC1C(C)C23CC(O2)C13,0.2972
CC1C2C1C1(O)CC21O,0.27
CN1CC1C1=CCCC1,0.2378
CCC1(COCO1)CC,0.3281
CC(CO)C1CCOC1,0.313
CN1C2C3NC3(C=O)C12,0.2041
CC1CC(O1)C1CCO1,0.3176
c1cc(ccc1C=O)N,0.1744
O=C1OC2C(NC12)C#C,0.24
O=C1CC23CC12OCO3,0.2151
CC1NC11CN2CC12,0.2941
CCN1CC1C1CC1,0.3057
COC1C2OC3C2C13C,0.3032
CCOCC(=O)C#C,0.2082
CC(C)OC(CO)C#C,0.2922
CCNc1nc(co1)O,0.2261
CN1CC(O)C(O)C1=O,0.2702
CC1C2OC3C4C(C23)N14,0.2827
CC(C#N)C1(C)CN1,0.2789
COC(C)C1OC1C,0.3302
CC1OCC23CN(C2)C13,0.2877
C(COC(=O)CO)C=O,0.2277
C(c1nnn(n1)C=O)N,0.1702
C#CCC12CC1CC=C2,0.2497
CC12CC(CC1)(O2)C=O,0.2181
CCC1=CC(=O)CC1O,0.1916
CC12CC1C(C2)C1CO1,0.3407
CC(=O)C(=O)CC(=O)N,0.1495
OCC12CC3=CCC1C23,0.1765
CC(C)(CC#CC#C)O,0.2291
CCN=c1n(nco1)C,0.2082
Cc1cc(=O)[nH]c(n1)O,0.204
OC12CC1C1CC21C#C,0.2326
O=C1COCC2NC12,0.2095
c1cc(=O)[nH]nc1N,0.1559
CN(C=O)c1ccno1,0.2094
CC1=CCN(CC1=O)C,0.1745
CC1C(=NO)C2CC12C,0.2431
C1CC23CC(CCC12)O3,0.3048
CC1(O)C2CC3OC2C13,0.3072
CCC1COCC11CN1,0.3061
CCOC1OC(=N)C=C1,0.2201
COC(=O)CCN1CC1,0.2519
OC12CC=CC1CC=C2,0.2564
COC(C)(C#C)C#N,0.2774
CCCC(=O)OCCC,0.286
CC(C)C12CC1C1CC21,0.2863
NC(C#C)C1=CNN=N1,0.2363
c1nc(nc(n1)N)C=O,0.1751
CC12CCCOC1C2O,0.3108
O=CC1CC2(CN2)CO1,0.2149
C#CCC1=CCCC1,0.2576
CN=c1cccno1,0.1587
N=C1NC(=N)C=CO1,0.2061
CC(O)CC1CC1C,0.3233
Cn1ncc(n1)O,0.2316
N=COC(C=O)C1CC1,0.2147
O=C1NCC11OC1C#C,0.2506
NC(=O)C1CC2OC12,0.2626
[NH3+]C1CNC=C1C([O-])=O,0.1989
OC12CC(C1)OC21CC1,0.2898
CC(=O)C(=O)NC(=N)C,0.1669
O=COC12CC1C1OC21,0.2474
CC1CC2OCC3C2N13,0.3162
Cc1ccc(n1C)NC,0.2323
c1c[nH]cc(c1=NO)F,0.1728
CC1(CC(=O)C1)CO,0.2222
OC1C2NC(C#N)C12O,0.2506
CC1CC2CC(O2)C1O,0.318
CC(=O)C(O)(C=O)C#C,0.1936
CC1(C)NC11C2CC1O2,0.3052
c1conc1OC2CC2,0.2461
OC12CC1C(=O)C1CC21,0.2115
c1(=O)c(noc(n1)O)F,0.1988
CC1OC(C#C)C11CC1,0.272
Cc1c2c(no1)onn2,0.1829
NC(=O)C(CC#N)C=O,0.211
O=C[C-]1C2C[NH2+]C12C=O,0.1296
CC12CN1C1(CO)CC21,0.2854
OC12CC(C1)OC(=O)C2,0.2708
OC1CCC=C1,0.2633
COCC1C2OC2C1=O,0.2151
c1conc1OC(=O)N,0.2519
CC1C2CC3COC3C12,0.31
N#CCC1(CO1)C1CN1,0.2849
NC1C(N)C1(C#C)C#N,0.2419
CC1=CC23CNC2C1O3,0.2107
CCC#CC(=O)C=O,0.1553
C[NH2+]CCOCC([O-])=O,0.2725
O=C1C2NC2C11CN1,0.211
OCC1CC2CC12C=O,0.2204
CC12OC1C1CC2(O)C1,0.3152
CC(C)(C)C1CC1(C)O,0.3167
COC(C)C1=CC=NO1,0.2455
CC1(CCC(=O)C1)C,0.2222
c1cc(cnc1)N,0.1987
CC12C3C4C1C4(C=O)N23,0.2028
CC1CC11CC2CC2C1,0.3467
Cc1[nH]nc(n1)CO,0.2588
CC1C2CCC(CO)N12,0.2879
OC(C#C)C1=CN=CN1,0.2338
NC(=O)C12CC3C1OC23,0.2515
CCn1ccc(=O)nc1,0.2018
CN(C)CC(CO)C#N,0.2522
CCCC(=O)COC,0.2343
OC1C2CC2NC1=O,0.2557
CCNC(C=O)C#N,0.2042
c1c(c2n(n1)CC2)C=O,0.2086
CN1CC2(C1)NC2C=O,0.1971
c1c(nc[nH]1)CCC#N,0.2545
CC1CC(=O)N1CC=O,0.2111
Cc1cc(oc(=O)c1)C,0.1802
CCC1CCCCOC1,0.3234
N=C1NC2=C(OC=N2)O1,0.1913
N=C1CC(CO1)C1CC1,0.2846
CC(=O)C1OCC11CC1,0.2156
CC1CCC(=O)C1C#C,0.2124
FC1=NON=CC1=N,0.1866
CC12C3CC1=CCC23,0.1778
COCC1OC1C=O,0.2186
CC(O)C1C(C)C1(C)C,0.3227
CCCc1cn(nn1)C,0.2486
CC(CC#N)CC1CO1,0.3081
Cc1[nH]nc(n1)NC=N,0.2256
CCC(C)C(O)C(C)O,0.3174
CCC1(C)CC1(O)CC,0.3195
CCC1=CNN=NC1=N,0.1686
CC(O)C(O)C1COC1,0.2977
OCC1OC1CC=O,0.2241
N=C1NC=NC1C1CC1,0.2264
CC(=NO)C1C2CC1O2,0.2371
C(=N)Nc1nc([nH]n1)O,0.2265
CC1OC2CC=CCC12,0.259
CC1OC2C(C#N)C12,0.2843
CC(=O)C12CC(C1)C2,0.2213
CC1C(C)C1(C#N)C#N,0.285
C1C2CC34CCC3(O4)C12,0.3174
CCCC#CC(=O)C=O,0.1553
C1N2C3C=C4C=CC13C24,0.1135
CN1CC23CC(CC12)O3,0.3003
NC(=O)N1CCCC1=N,0.2487
CC1(C)CC(O1)C(N)=O,0.264
OCC1CCC11CC1,0.3365
OC1(CC1CC=O)C#N,0.2253
CCC12CC(C1)COC2,0.3246
CC(CCNC=O)C=O,0.2244
N#CC1NC1C1CN1,0.2562
CC#CC1(O)CNC1=N,0.2548
O=CCC1CCOC1,0.2238
CNc1nc(=O)[nH]nn1,0.1711
Cc1cocc1NC=O,0.2142
COCC1CCN1C=O,0.2666
CC#CC(=O)C1OC1C,0.1985
N=C(C=O)N1CC2CC12,0.1708
OCC(O)C1(CO1)C#N,0.2602
CCc1nccc(n1)N,0.2173
Cc1c(nnn1C)NC,0.2049
CC1(CCC2CC12)C=O,0.2255
CC(=NO)C(CO)C#N,0.2535
CC12CC1(C)OC(=O)O2,0.314
CC1C(=O)C2N(C)C12C,0.2055
CCC(O)(CO)C(N)=O,0.2721
CC1CC(=O)N1C,0.2797
C1OC2CN3C1C3C=C2,0.2133
O=COC1OCC2NC12,0.2726
CC(C)C1=CC(O)CC1,0.2573
OC12CCC11CC2OC1,0.2783
C1CC1OCCCCO,0.3221
CNC(=O)C#C,0.2349
C#CCC1C2C3CC3C12,0.2667
OC12C3C4C5C3C1N5C24,0.2582
CC1COCCC1CO,0.3184
CCCC12CC1OC2,0.303
CC1=CC(CO)NC1=O,0.2201
C(C#CC1CO1)N1CC1,0.2594
Cc1cc(c[nH]1)C=O,0.1902
CC#CCc1cnoc1,0.2405
CNC1=CNN=CC1=N,0.1591
C#CC1C2COC12,0.2806
CCC(O)CC1(C)CC1,0.3159
CC1(C)C2CC1CC2,0.3583
CCC(O)C(=O)C(N)=N,0.1914
OC12C3C4C3C3C1C2C43,0.3062
CC(C)(COC=NC)O,0.2731
CC(O)C1=C(N)OC=C1,0.2165
O=CCCC1CC2CN12,0.2201
CN(C)C(C#C)C#N,0.2391
N=C1OCCC11CN1,0.2626
Cc1ccnc(c1N)O,0.1945
OC1C2CC(O)C12C=O,0.2196
CCCC12C3C4C(C13)N24,0.2811
COCc1ncco1,0.2411
C(N1CC1)C12CC(C1)C2,0.323
CCc1cc(co1)CO,0.2334
N#CC1(C#N)C2CN1C2,0.2356
C1CC1(C=O)OC=O,0.2297
N#CC#CC1NC1C#N,0.2295
C1COC2(C1=O)CC2,0.2152
O=CC1CC11CC2OC12,0.2286
CC1=NNN=C1C1CN1,0.2242
CC1C2CC1(C)CC2=O,0.2278
CCCC12CN1CC2=O,0.2228
OC1CNCC1(O)C#N,0.2417
CC12CCCN1C2C#C,0.2556
CC1OC(C)=NC1C#N,0.2694
CC12OCC1CC1NC21,0.2985
CC1OCC2CC(=O)C12,0.2129
CC1(C)C2CC1(O2)C=O,0.2086
COC(CC1CC1)C#N,0.3011
N#CC1CC2CCC12,0.3167
OCC1(O)CC(=O)C1O,0.2171
CC1(OCC2NC12)C=O,0.2109
COC1CC2C3CC1N23,0.3098
CC12CC(O)(C=C1)C=C2,0.2163
C1C=Cc2c(nn[nH]2)O1,0.1679
OCC12CC1CC2C=O,0.2087
COC1(C)COC1(C)C,0.315
OC(C1CN1)C1(O)CC1,0.3131
OC12CC(C1)(C#N)C2=O,0.2431
COCC12CC1C1CC21,0.2889
Cc1c[nH]nc1N(C)C,0.2253
c1cc(c(=O)oc1)F,0.1776
CCCC1CC2CC2C1,0.3385
C1CC1N=COCC=O,0.2004
C1OC23CC4CC(C12)C34,0.3038
C1CC2(C1)C1CC=CC21,0.243
C#CCNC(=O)N1CC1,0.2736
Cc1c(non1)N2CC2,0.22
C#CC1=CNC(=O)OC1,0.1871
O=CC1COC(=O)C=C1,0.2147
CC12C3CN1CC23CO,0.2858
C1C2C3CC4C1C2CC34,0.3557
OC1CC2CC3CC1C23,0.3219
CC(C)c1cnn(c1)C,0.2525
CC(O)C1(O)CC1C,0.3137
CC12COC1C2C(N)=O,0.2615
CC1(CCC2OC12)C#C,0.3028
OC1CC23CC(C=C2)C13,0.2173
OCC1C2C3C(O)C2C13,0.318
N=COC(=O)C(=O)C#C,0.1675
CC12CN3C(CC13)C2,0.3129
CC1C2OC3C2C3C1=O,0.2242
CCC1CC1C(O)C#N,0.3031
CC12CC3C1C3(C2)C=O,0.2213
O=CC1=CC(=O)ON=N1,0.147
CC(OC1COC1)C#C,0.2799
CCOC1=NC(C)CC1,0.28
O=CC1C2C3CC1CC23,0.2251
C#CCC1(CC1)C2CC2,0.3007
CCC1CC1(CC)C#N,0.315
CC1(CNC1=[NH2+])C([O-])=O,0.1737
CCCOC(C)C#C,0.2929
C#CCOCCCC#N,0.2893
OC1CC2OCC2C1O,0.3208
C1CCC2NC2COC1,0.3007
CC1=CC2C(C1)C2(C)O,0.2342
CCC(C)(OC=O)C#N,0.2769
CC(CO)N(C)C=O,0.2707
O=C1COC2C3CC1C23,0.2067
CCC#CCCCC#N,0.2801
OC1C2C1C1C3CC1C23,0.3212
CN1C2C(O)C1C2=O,0.2343
CC(O)C1N2CC1(C)C2,0.2966
Cc1ccc([nH]1)NC=O,0.1914
OC1COC1CC=O,0.2239
COC1OC2CC1(O)C2,0.3319
C1C2NC3=NNC=C3C12,0.2197
COC(C)C(=O)N(C)C,0.2572
CN1C(=N)NC=NC1=O,0.2091
CCC(=O)NC(C)(C)C,0.2732
CCC(O)CC(C)O,0.3232
CCC12C3CN1CC23O,0.2883
CCC1N2CC(C2)C1=O,0.2053
Cc1c(nn[nH]1)COC,0.2446
CC1=NN(C=O)C(=N)O1,0.2094
CC12NC1C1OCOC21,0.2904
CCC12COC1(C)CO2,0.3006
NC1=C(O)C(=N)NN=N1,0.1507
CC1(CC1CO)NC=O,0.2591
CCC12C3C1C1C3CN21,0.2947
FC(F)(F)C1OCC=C1,0.2532
C1CC=CCC=CC1,0.2314
CCC1C=C(C)CC1C,0.2563
OC1(C#N)C2OCOC12,0.2548
CCC(C)C(=N)NC=O,0.229
CCc1cnc(=O)oc1,0.178
C1CC2C=CCC12,0.2618
O=C1C2CCC1C=C2,0.2366
OC1=CC2=C(N1)ON=N2,0.1273
CCCCC(=O)CC#C,0.2327
CC([NH3+])C1=COC([O-])=C1,0.2283
CC12CC=CC1OC2=O,0.2551
ON=C1C2C3C=CC1N23,0.2009
CC12NC(C=C1)C1OC21,0.2366
CC12CC(CC1O2)C#C,0.3069
CCC1C(C)NC1=O,0.2794
CCC1C2C3CC2(C)N13,0.3136
CC12COC11CC2C=C1,0.2318
CC1(C)C2OC(=N)C12C,0.2742
CCC#CC(O)C(C)=O,0.2177
OC1(CCC1=O)C#C,0.2003
COC1CN2CC2CO1,0.3106
OC12CCC1CNC2=O,0.2629
C#CCN(CCO)C=O,0.2659
NCC1(CC2CN12)C#N,0.2665
CC(C)CC(=O)C1CC1,0.233
C1CC1(C(=O)NC=N)O,0.2222
CC1CCCCC1O,0.3185
CCC1(CC1)C(C)(C)C,0.3384
CCC12C3C1C1(C)C2N31,0.2788
Cc1c[nH]c(n1)C#N,0.2044
CCC(=N)N(C)C(=O)C,0.241
c1[nH]c(c(n1)O)C2CC2,0.2157
CC(C)C1C(C)NC1=O,0.2794
CCC(O)(CO)C=O,0.2244
OCC1C(O)C1CC#N,0.2948
O=C1CC2(CC=CC2)O1,0.2658
N=C1OCCC1C1CN1,0.2662
C1C2CC3CCC(C3)C12,0.3292
CC(=O)C(O)(C#C)C#N,0.2219
CCc1cc(co1)O,0.2234
COC1(CC1)C2CC2,0.3102
CCNc1cncnn1,0.1672
OC12CC3C1N3C2=O,0.2495
COC1C2OC1C21CO1,0.3105
C1CC1(CO)C2COC2,0.3157
CCC1OCCCC1O,0.3217
COC12CCC1OC2C,0.303
CCN=COC(C)C=O,0.2171
CC#CC1NC2CC12O,0.2548
CC12C3C4C3N1C2C4O,0.3002
CC(=O)c1c(n[nH]n1)O,0.1885
C1CN2C1=CCNC2=O,0.2238
OC12CC1C1(COC1)C2,0.3155
C#CCC1CC=CC1,0.265
O=C1OCC2CCNC12,0.242
C(c1nc(no1)O)O,0.2433
OCC12CC1C(O)C2O,0.3068
OC12CC1OC2=O,0.2637
C1C2OC3C4C(C3O2)N14,0.2985
CC(=NO)CCC#C,0.2525
CC1N=C(C)N(C)C1=O,0.2313
CC12CC(C1)C2C#N,0.3251
CCCC1COCC1O,0.3085
OCC1(O)COC2CC12,0.2837
CC(C#C)N1C=CN=N1,0.2562
CN=C1NC2COC12C,0.2443
CC12CC1(CO)C(O)C2,0.3017
c1cnc([nH]1)C#CC#N,0.1729
C1CN1C1C=CC2NC12,0.2224
CCC#CC(=O)C1CO1,0.2009
NC1CC(=O)OC1=N,0.2445
C1C(=O)NC(=N1)C=O,0.1685
OC1C2CNC(C#N)C12,0.2632
CC12C3C4C(N13)C24CO,0.2609
CN1CC1(C)C(O)CO,0.2862
OC1CC1(OC=O)C#C,0.2458
OCC1(O)C2C3CN2C13,0.2804
N=C1CC2(CC3OC23)O1,0.2826
OC1C=CC2OC(=O)C12,0.2554
CC12C3CN1C(=O)C23,0.2445
NC1=CN=C(O)C(=N)N1,0.1588
CC1C2(C)CC1(C2)C#C,0.2997
CC1=CC2(O)CC3C1C23,0.2371
O=CC1NC2CC(=O)C12,0.2047
CCNC(=O)CC1CC1,0.2722
CC1(CC(=O)C(=O)C1)O,0.1462
CC12COC1C1CC2O1,0.3112
CC1NC1C12CCC1O2,0.3078
CCc1c(con1)CO,0.2476
OCC12C3C4N1C2C34O,0.2736
CN=C1CCCOCO1,0.2638
COCC1CC=C(C)C1,0.26
Cc1ccc([nH]1)C,0.2342
CC(=O)C1CC2CC12O,0.218
OCC12COC(C1)C=C2,0.2472
O=C1OCC2C3CC3C12,0.2578
CC1C=CCOC=N1,0.245
C1CC2COCCCC12,0.3203
CC(C)(CNC=O)C#N,0.2787
CC12CC1(C=CC2)C#C,0.2366
CC1=CC2(C)OC1C2O,0.2411
CC1CC2N(CC2=O)C1,0.202
CC1CC(=O)C(N1)C#N,0.201
CC1NC1C#CCO,0.2666
CC12CC(CO1)N=CO2,0.2691
C1CC(=O)C=C(C=C1)N,0.1625
COCC1CC2CC12,0.3403
CCC1=C(CCC1)C#C,0.2053
C1COC(=N1)C(=O)N,0.2209
C(C(CO)O)O,0.3096
OC1CCOCC11CO1,0.3005
O=CC12COC1C1NC21,0.2056
CC1OC1COCC=O,0.2291
Cc1c(c[nH]n1)C(C)C,0.2587
OC1C2CCC2C1C=O,0.2142
OCC12C3CC=C1CN23,0.1742
C(c1c(n[nH]n1)CO)O,0.2505
C1C2COC3CCC2C13,0.3172
ON=C1C2CC1CCC2,0.2538
c1c(c(=O)onn1)C=O,0.1378
C#CCOCC(=O)C#N,0.1877
CC1OC1C1=CNC=N1,0.2469
C1C2CNC3=C2N1N=N3,0.1654
C#Cc1c(cn[nH]1)CO,0.2088
CC1=C(C)C2(C)NC2C1,0.2436
CC12CC(O1)C=CC=C2,0.1764
O=C1CCC(O1)C#N,0.2778
COCC1=NCCO1,0.2616
CCC1(CC1)C1CC1C,0.3271
C1C2N1C1CC22CCC12,0.3021
O=C1CC(N1)C1CCC1,0.2853
Cc1ncc(nn1)N,0.1657
C1CC=CCC(=O)OC1,0.2374
CC1(CCC1)N2CC2,0.3077
CC12OC(C=C1)C=C2,0.2002
CC1OC(=O)OCC=C1,0.2576
CC1CC(C1)(C#C)C#C,0.2859
CCC1C(C=O)C2CN12,0.208
FC1=NC(=N)NN=N1,0.1642
O=CC1=CC2CC1CO2,0.1839
OC1CC(=O)C(=C1)C#N,0.1823
COC1(C)CC(C)C1O,0.3146
C1OC1C12CC=CC1N2,0.237
CC12CC1C(C=C2)C#N,0.2459
CC1=NC2(C)C(O)C2O1,0.2504
CN=C1NN=CC(F)=C1,0.156
COCCCOCC#N,0.2715
Cc1cc(cnc1)N,0.1968
CN=C1C=CCN1C=O,0.1902
OCCC1C2CN2C1=O,0.2327
CC1OCC=CCC=C1,0.241
OC1C(=N)OC11CCC1,0.2798
OC1C2CC(C2)C1O,0.32
CC(=NC1CC1)OC,0.2566
FC1=C(F)C=NC(=N)N1,0.1554
C1C2OC3CC12COC3,0.3149
CC(O)C(C#C)C1CC1,0.3067
CC1C2COCC(C)C12,0.3118
Cn1cc(c(n1)N)CO,0.232
OCC1OCC=CC=C1,0.1907
c1conc1CCO,0.2548
N#CC1C2CN=CN12,0.2387
C#CCCOC(=O)N,0.3164
NC1=C(CO)NC(=N)O1,0.2085
CCC1CC11CCOC1,0.3362
O=C1CN2CC2C2CC12,0.2092
OC1CC11OCC11CC1,0.2853
c1c[nH]cc1OC=O,0.227
CCn1c(=O)[nH]c(n1)C,0.2343
c1c(nnc(n1)C#N)F,0.1688
O=CC1OC2CCOC12,0.2206
OCC1COC2CC12O,0.2913
OCC#CC12CCC1O2,0.2487
CCCC(C)C#C,0.3155
CC1NC1C1=NNN=C1,0.2422
O=C1OCC11NC2CC12,0.2323
CC1(C#N)C2C=CCN12,0.2231
Cc1c(ccnc1F)O,0.2371
CC1(C)OC(=N)C1C#N,0.2833
CC12OC1C(CO)C=C2,0.2464
OC1CCC11CC1C#C,0.2835
CC1=NCC2(O1)CCC2,0.2697
c1nc(c(c(n1)O)F)O,0.2297
CC(C#N)C1NC1(C)C,0.2951
CCC1CC(C#N)C1C,0.3254
CN1CC2OC(=N)CC12,0.2569
c1c[nH]c(c1CO)N,0.228
CN1C2C3CC(C23)C1=O,0.2509
CC1(O)C2CC2C11CC1,0.3192
COC1OCC(C=O)=C1,0.1917
COCCn1cncn1,0.2696
CCN=C1C(=O)CCN1,0.1779
C(CN=CNC=O)C#N,0.2336
OC1CCC(=O)NC=C1,0.2117
ON=C1CC(O)C2OC12,0.2446
CC1C2CC3OC3C1O2,0.3037
CC1OC2CNC12C#N,0.2504
NC1=NC2CC1(O)C2O,0.248
OC1CCC11CC2OC12,0.3226
CC(O)CC1(CN1)C=O,0.2209
CC1(CC1)CC(C)(C)C,0.3286
OC1C2CC3(COC13)C2,0.319
CC(O)C1(C)COC1C,0.3008
CCNc1nccnn1,0.1659
CC1CN2C1C2(C)C=O,0.217
CC1C2OCC(C#C)C12,0.2825
c1c(cn2c1CCC2)O,0.2294
O=C1CC2NC12C1CC1,0.2162
CC1NC11CCC(O)C1,0.3086
OCC1=NOC(=N)C=N1,0.1657
CC12NC1(C=O)C1CC21,0.2201
C1OC2CC3OC3C2O1,0.3187
CC(=O)C1CCOC1=O,0.2263
CCOC12CC3C(C1)C23,0.3194
OC1(CC1)C1OCC=C1,0.2521
CC1CCC2(CC2)OC1,0.3246
O=CNCC1OC2CC12,0.279
C1OC2COC1CCO2,0.3294
CC(C)(CO)C(=O)OC,0.2816
CN1C2C(O)C(O)C12C,0.2876
OCC(=O)CC(O)C#C,0.2335
C#CCC12CC(C1)CC2,0.3137
CC1(C)C2C=CCC12C,0.2423
C#CC1CC11OCC=C1,0.217
CC12CC1(C)C(=O)NC2,0.2685
CC1CC(CCC=O)O1,0.229
NC1(C#N)C2C3OC2C13,0.2711
C1CC2(C1)C1COCC21,0.3279
C1C=CCC1=O,0.2245
CC1=C(COC1)C(=O)C,0.187
CC1COC2C3CC12C3,0.328
CN1CC(=CC1=O)CO,0.2115
C1NC11C2C3OC1C23,0.2954
C1COC1=NCC(=O)N,0.2613
CC1(C)N=CNC1C#N,0.2458
C1COC2(CO1)COC2,0.3114
C(CC1CO1)C1CC1,0.3595
CCC1C2OC1C1CC21,0.3296
Cc1c(cn(c1O)C)N,0.2189
COC1C2C3CC1(C)N23,0.3202
CNC(=O)OC(C)CO,0.3163
CN1C=NC=NC1=N,0.179
CC12CC3C(C13)C(=O)O2,0.2681
CC1CC(C(N)=O)C1=O,0.2081
O=COC(CC#N)C#N,0.2801
NCC1(NC1CO)C#N,0.2685
OCCN1C=NCC1=N,0.2189
COC=NC(CO)C=O,0.2199
N#CC12NC3CC1C23,0.2452
O=C1NC2C(OC12)C#N,0.2416
OCC(O)C1CO1,0.3299
c1cc(oc1)C2(CC2)O,0.2257
CC(C)(C)n1nnnn1,0.2737
C#CC1C2CCCCC12,0.2827
O=C1OC23CN(C2)CC13,0.2512
CC1CN1C1CC(=O)C1,0.2196
CCc1c(cn[nH]1)NC,0.2135
c1c(nc(c(n1)N)F)F,0.1774
Cn1ccc(c1O)C#N,0.2206
CC12CN1C(C2)C1CN1,0.3092
NC(=[NH2+])OC1=CN=N[N-]1,0.2422
C1CC2(C1)CC=CC2,0.2639
OCCC1C2NC1C2=O,0.2501
c1c2c([nH]n1)CC(=O)C2,0.2096
OCC12CN1C(=N)OC2,0.2843
COCC(O)(CO)C=O,0.2175
O=CC1(CC#N)CN1,0.225
CCC12OC1CC=C2,0.2476
OC12CC1C=CNC2=O,0.2123
CN=C1NC2C(C)C12O,0.2437
OCCC(OC=O)C#C,0.2677
C(C=O)C#CCNC=O,0.2175
CC1(CC(=O)CN1)C#C,0.2058
OC(COC=O)CC#N,0.2854
CCC(CO)CC(C)=O,0.2349
CCC1CC1C#CC#N,0.2259
O=CC12CC3CC3C1N2,0.2159
O=CCC1(CN1)C1CN1,0.2086
C1C=C(CO1)C(=O)C#N,0.1517
N#CC1CN1C1CC1,0.2708
OC1(C#C)C2OC2C1=O,0.192
CC(C)C12CC(O)C1N2,0.3142
C1C2NC22CC1COC2,0.3088
CC1(C)CC(=O)C2CC12,0.2258
O=C1NC=CC1CC#C,0.2115
OC1COC2CCC1C2,0.309
OC1COC11CNC1=O,0.2502
CC1(CC2CC2)CO1,0.3448
CCNc1c(ocn1)N,0.2022
CCC1(CC1)N2CC2,0.3069
CC1N(C)C11CC2NC12,0.294
CC12CC1CCOC=N2,0.2522
CC1C2NC2C1C=O,0.2067
CC(=O)CCCC=O,0.2242
O=C1C=CCCC2NC12,0.1895
NC1C2[NH2+]CC12C([O-])=O,0.1756
OC1C2C1C1=CCOC21,0.2272
CC12OCC1OCC=C2,0.2513
CC1C2C(O)C(C)(C)N12,0.2841
C#Cc1c(cn[nH]1)C#N,0.1994
CC(C)C(C)C(=O)C#N,0.2058
CC1CC2CC1OC2=O,0.2757
O=C1CC(CN2CC2)O1,0.2645
CC(C)C#CC#C,0.2318
OCC12CC(O1)C2C#C,0.2838
CC([NH3+])C1=C([O-])C=NN1,0.1397
CNCc1[nH]nc(n1)O,0.2427
[NH3+]C1CCC(C1)C([O-])=O,0.1159
CCC1C(O)C11CCC1,0.3067
CC1(O)CC2OC12C#C,0.2596
C#CC(=N)NC(=O)C#C,0.1983
CC1=CCOC1C#C,0.2533
COC1COC(C1)OC,0.3378
C#CC1COC(O1)C#C,0.2861
CCC(O)C(C)(C)C=O,0.2308
C1C2CCCOCOC12,0.3226
CC1C2C=CCC(C)C12,0.2482
C1CC12C(=O)OCCO2,0.2555
CCC12OCC1(C)C2O,0.2761
O=CC1OC2CN3C2C13,0.2078
CC1(C)C2CC2NC1=O,0.2652
CC(C)C1OCCC1O,0.3
c1(c(n[nH]c1O)N)N,0.254
c1cc([nH]c1N)N,0.2327
N#CC1CC2OC12C#N,0.2754
CN=c1cc([nH]nc1)O,0.1638
CC1C2C3CC2(C#C)N13,0.2551
CC1CC1C1(CC1)C#C,0.2839
CN=COC(=O)C1CO1,0.2314
C1OCC2C3OC3C2=C1,0.2472
CC1C2OC1C2(C)C#N,0.2871
CC(C)CCN(C)C=O,0.2718
CC1OCC1C(C)(C)C,0.3036
CCC1C2C(N2C)C1=O,0.2052
OCCC(C=O)C1CC1,0.2245
Cc1cc(nc(n1)N)F,0.2088
CC(C)C1CC1NC=O,0.2717
CCC(CC)C#CC#C,0.231
CC(C)OCC1NC1C,0.3109
CC1(CCC1)C(=O)NC,0.2744
CC1CC(C)(CO)C1=O,0.2142
OCC1NCC(O)C1=O,0.2029
CN=C1OC(C)C1C=O,0.2167
OC1(C#N)C2C3CN2C13,0.2617
N#CC12CC(C1)N1CC21,0.2702
CC(C#N)C1CCC1=O,0.2207
C(C#CC=O)C(=O)N,0.2047
C1OC2C3CC(C3)CC12,0.3164
CC1C2CN2C1C1CO1,0.3089
OCC1OC(=O)C11CC1,0.276
c1c(=O)ncoc(=O)n1,0.1791
CCN=C(C=O)N(C)C,0.1625
CC(C)N1C2C3NC2C13,0.2812
C1Cn2c1nc(n2)C#N,0.2346
Cc1cn[nH]c1N(=O)=O,0.1814
NC(=O)OC1CC(O)C1,0.3185
OC1C2CC1C1NC21,0.2999
CC1(CC(C1)C(=O)N)C,0.2744
Cc1cc(n[nH]1)OC=O,0.2454
Cc1c2n(cn1)CC2,0.2508
CCc1cc[nH]c1C#N,0.2089
C1CC(C1)(C=O)C=O,0.2114
C1CC12C=CC=CC=C2,0.1736
CC1(CO)NC=CC1=O,0.1902
CC12C(O)C1C1OC21,0.2823
CC1=C(C)C(CC1)C#N,0.2521
CC1CC2OC1C(=O)O2,0.2652
CC12CC1OCC1OC21,0.3378
Cc1ccc(c(c1)C)N,0.2041
O=CNC1(CC1)C1NC1,0.2602
NC1=NCC(=N)OC1=O,0.1898
ON=C1C2CN2C1C=O,0.1919
N#CC12CC(C1)C1CC21,0.3008
CC1COC2C3CN3C12,0.3014
C1CN1C1C2CCOC12,0.2973
C1CC(C1)C1CC2OC12,0.3331
C1NC1C12CC3CC1N23,0.3095
C1OC1C1=CNN=N1,0.2452
C1C2C3C4C5C3C2C1N45,0.3059
CC1CC(C)C1=O,0.2193
CCC1C2N1CCC2=O,0.2121
CN1CC2C1CN2C,0.2882
CC1OC(N)=NC1CO,0.2725
N=C1OCCOC2CC12,0.2522
CCOC1=NCC2OC12,0.2547
CC#Cc1cnc(o1)N,0.1892
CC1C2C3C4OC4C2C13,0.3267
c1nc(on1)CCC=O,0.2259
CC1C(O)C(C#C)C1O,0.2828
OC12CN3C(C13)C2C#C,0.2622
CC(O)C1(C)CC(=O)N1,0.2751
O=C1OC2CC2N2CC12,0.2417
CC1C(C)C1C(C)(C)C,0.3227
CC1(O)C2OC(C=O)C12,0.2076
CC12CCC3(CN3)C1N2,0.3034
C#Cc1[nH]c(c(n1)N)O,0.1866
CC(O)CC#CCC#C,0.2864
COC1=CC(=N)N=CN1,0.1917
N=C1OCC2OC2CO1,0.2852
N=C1OCC1CC#C,0.2824
CCC1(C)NC1C1CO1,0.3128
CC12CC1C(C)(C)C2O,0.3119
CC1(CCC1)OC2CC2,0.3193
c1cnc2c(n1)CCO2,0.1885
CC1(C)C2CC(=O)NC12,0.2638
CC#CC(CO)C1CN1,0.2949
c1c(c(n[nH]1)O)CC=O,0.2106
CC1C2C(C)OC12C#N,0.256
NC1C2OC2C1(N)C#N,0.2544
N#CC1OC11CC2OC12,0.2685
CCC(CC)C1CC1C,0.3407
CC12C=CCC1C2C#N,0.2471
CCC(CC)CO,0.3407
CCCC12CC1OC2=O,0.2755
CC#CC1CC1C#N,0.2651
CNC(=O)C(O)C1CN1,0.2583
N#CC1=NC2CC2CN1,0.1937
CCCC(=O)C(C)CO,0.2299
CC1(C)CC1C#CCO,0.2684
OC1C2CC1C1(CO1)C2,0.3248
c1ccc(cc1)O,0.2201
CC1OC1(C=O)C(C)=O,0.2019
COC(C)CC(O)C#C,0.2845
CC1C2CC3CC1C2C3,0.3476
OCC(COC=N)C=O,0.2189
OC12CCOC1C2C#N,0.275
CC(N=C(N)C#N)C#C,0.2178
C1CC(=O)NC(=O)C=C1,0.1952
CC1(O)CC(C1)C1CC1,0.3234
CCCN=C1NCC1O,0.2575
OC12CN3C1C2OC3=N,0.2601
C(C#N)NC(=O)CO,0.2712
CN=C1NC(=O)ON=N1,0.1744
C1CC(O1)C1CC=CC1,0.2611
NC=NC1=COC(=N)O1,0.1794
CCc1cc([nH]c1)CO,0.2332
CC1C2N1C(C)C2(C)C,0.2975
N#CC1CN2CC12C#N,0.2597
OC1CC2CC(C2)C1,0.3299
CCCC1COC1C#C,0.2732
O=C1CC2(CC2O1)C#C,0.2592
CC#CC(=O)C1CC1O,0.186
OC1=NOC(=N)C=C1,0.161
CCCCCC1(CC1)O,0.3268
Cc1nc(c(o1)N)C#C,0.2032
CC(C)(OC=N)C#C,0.2824
COC12CC3(O)C1CC23,0.3206
NC12CC3OC1(C#N)C23,0.2392
NC1=NOC(=N)N1C=O,0.1978
O=C1OC2C3CC2C3O1,0.3199
CC12CC(N1)C2(O)C#N,0.2903
CC1(O)C(O)C1(O)C#C,0.2485
CNCC(N)(CO)C#N,0.2683
CCc1ccc([nH]1)C=O,0.1797
CC1C2C3N4C1C2C34C,0.3098
CCCC(=NC)NC=O,0.2299
C#CCC#CCC=O,0.2206
O=C1C=CCC1C1CO1,0.1916
CC(CC=O)C(=O)CO,0.2194
NCC(OC1CC1)C#N,0.2717
Cn1c(c(cn1)O)CO,0.2228
C1OC2C1N1CCCC21,0.2777
c1c(=O)cc(oc1N)O,0.2106
O=CC1C=CNC1=O,0.198
O=COC1CC11CCO1,0.2379
C#CC12C3CC1OC23,0.2554
Cc1nccn1C(C)C,0.247
CCOC(=O)C1(CC1)O,0.2574
C1COC(=O)C(=C1)C#N,0.2039
CC1C2CC2NCC1=O,0.2092
COC(=O)C1CN1,0.2592
CC12C3CC3C3C1CC23,0.3482
CC1CCC(C)(O)C1=O,0.2114
c1cnn2c1CCCC2,0.2539
CC1C2C(O)CCC12O,0.3152
CCC1COCC=CC1,0.2641
CNC12CC1COC2=N,0.2472
COc1nccc(n1)N,0.2155
CNc1nc(no1)O,0.2477
CCCC1C(O)CC1=O,0.2199
CCC1(CCC1O)C=O,0.2199
c1c(nnc(n1)O)C#N,0.1641
O=CC1CC1N1CC1,0.2248
C1CC1N2CCC2=O,0.2728
O=CC12CCC1(N2)C#N,0.2113
OC12C3OC4CN(C13)C24,0.2679
CC1C2C1C1(CC1)C2=O,0.2289
CC(O)C1CC2C(C)N12,0.3033
CC1(O)COC1C1CN1,0.3023
O=CC1C=CC2CN1C2,0.2006
c1c(coc1N)C(=O)N,0.1856
C#CCC#CC(F)(F)F,0.2818
Cc1cc([nH]c1O)OC,0.2203
OCC1C(O)CC1C#C,0.2958
CC1CC2OC2C1(C)O,0.3196
CC1(CC#C)C2COC12,0.2847
ON=C1CC2C3CC3C12,0.2454
C1OC23C4C2C2C4C32O1,0.2768
O=C1NCC2NC12,0.255
C#CC12CC1C1COC21,0.259
CN1C2C3C4C3C1C24,0.3057
CC1C2CC1C21CCO1,0.3295
O=C1C2CC1(CC#C)N2,0.2485
C#CCc1c([nH]nn1)N,0.2278
CC(=O)C(=O)C(=O)C=O,0.1285
CCC1(CO1)C#CC=O,0.2016
CN1C2C3NC3(C)C12,0.301
CC(=O)Nc1ncco1,0.2137
C1NC1C12OC1C1NC21,0.2731
CC1=CNC(=O)NC1=N,0.2008
C1C2C=CC11CCCC21,0.2359
CCOc1c(nno1)C,0.2115
C1CC2(COC=NC2)O1,0.2636
OCC1CC=CN1C=O,0.2111
O=CC12CC1OC2=O,0.2231
C#CC1C2CC3CN1C23,0.2372
CCC1(O)C2CC1O2,0.3293
CC12CC3CC(CC13)O2,0.322
CC12NC1C1(C)CC2O1,0.3077
CC12C3CN(CC1O)C23,0.2829
CN1CCc2c1n[nH]n2,0.2014
CC(C)c1cnnnn1,0.1677
CC(C)C1(C)CC1C#C,0.2882
CC1C(O)C11CC(C)C1,0.3073
CC1CC2C(O)C12C=O,0.2175
CC(=N)OCCC#N,0.2965
OC12COC1CC21CC1,0.3025
Cc1c([nH]c(=O)[nH]1)C=O,0.1623
O=C1NC2C(C#N)C12,0.2456
CC1(CC#N)C(O)C1O,0.2736
C1CCC(C1)(CO)O,0.3172
CC1OC(CCO)C1=O,0.2219
CC12CC3C4C(CC14)C23,0.3482
CC(C)CC#CCC=O,0.2186
COCC1(CCO1)C=O,0.2145
CC1C2(O)CC(=O)C12C,0.2272
CC12CC1C1(C)COC21,0.3058
CNc1ncnn1C,0.2449
CC1COCC2OCC12,0.3001
OC12CC1N1N=CN=C21,0.2293
CC1(O)CC11CC(=N)O1,0.2753
CC(C)(C)CN(C)C=O,0.2672
CC1(C=CC(=O)CN1)C,0.1753
c1nc(on1)OC2CC2,0.2556
N#CC1CN2C=CN=C12,0.244
OC1CN2C(C3CO3)C12,0.2902
C1OC2C3NC3C12,0.2935
NC(C#N)C#CC#C,0.2196
CC12C3C4N3C1CC=C24,0.1615
CCc1cnc(nn1)O,0.1638
CC1=C2C(O)CN2N=C1,0.2495
COC1CC(C)C=C1,0.2624
CC(CC#CC#N)C#C,0.2338
NC1=NC=NC(=N)N=C1,0.1693
OC12CC1(O)C(=O)C2,0.2237
C1OC23C1N1C2C=CC31,0.2065
CC(C)C12NC1CC2=O,0.2196
COC12CC1C=CCC2,0.2435
NC(=O)C1OC1CC#C,0.2604
CC1C(O)CN1CC#N,0.2586
OCC1C=CCC1O,0.264
NC1=CC(=O)C2(CO2)C1,0.1995
COCC(C)C#CC=O,0.205
CC1CC=CC1O,0.2621
COC(C)C(C#C)C#N,0.2838
c1cc(cnc1)N(=O)=O,0.1824
c1cnoc1CCO,0.2449
CC1COC2C(C=O)C12,0.2178
CC1COC2=CN=NN12,0.2395
CC(O)C1CC(O)CO1,0.3032
CC1N=COCC=C1C,0.2417
N#CC1CCOC=N1,0.2736
CC1C2CC=CC12CO,0.2455
C#Cc1c([nH]c(n1)O)N,0.2012
C1CC1(CN2CC2)CO,0.3157
CC1(N)C(N)C1(O)C#N,0.2702
C1C(=O)OC1(C=O)C=O,0.206
CN1C2CC=CC12C#C,0.2253
CC1(CC#N)C2CCN12,0.2783
O=C1C2C3C4CC2C1N34,0.23
O=CCC1OCC1C=O,0.2036
CC1NC1C(N)=O,0.264
c1nc(on1)OCCO,0.2585
CCN1CC1CC#CC,0.2804
CC1=CCCC(C1)C#C,0.2606
CCCC(=O)C(=O)N,0.1785
c1c(con1)CC(=O)N,0.2227
OC12CC1C(C2)OC=N,0.2799
O=C1CCC2CN=CN12,0.2271
OC1C(=O)OC11CCC1,0.2639
CC12NC1C1(NC21)C#C,0.2263
CC1CCC1C1(O)CC1,0.2969
CC(=O)CC1(C)CC1O,0.2234
CC1(C#N)C2CC1CC2,0.3247
CC(=O)C1NC1C(C)=O,0.205
OCC1OCC(O1)C#C,0.2741
OCC1C2OC1C21CN1,0.3049
CN=COCC(O)C#N,0.2748
O=C1OCC2CC1C=C2,0.2301
CCC(=O)C#CC=O,0.1952
CCCC12CC3C1CC23,0.3699
CC#CC1NC(C)C1=O,0.2062
C1CN(C=C1)C(=O)CO,0.2076
C1OC11CCCC11CO1,0.3132
COC(=O)NCC1CC1,0.3116
CC12C3OC1C(=O)OC23,0.2377
CN(CC=O)C1CC1,0.1902
CN=COC(=O)C(=N)N,0.1987
CC1OC1C1C2CN1C2,0.3143
C#CC(=O)COC=O,0.1989
C1CC2(C1)CC(C2)CO,0.3366
CCC(O)CC#CC#N,0.2405
N=C1OCOCC1C=O,0.2258
CC1CC1OC=O,0.2771
CCC1(CC)NC1CO,0.3089
CCN(C)C1CNC1=O,0.2359
CC#CCC1OCC1=O,0.2083
O=CCC12CC3CN1C23,0.2152
CC1COC2CC2OC1,0.3149
CC1C2N1C1CCC21O,0.2803
CC12CC(C1O)C(=N)O2,0.2815
CCCc1ccoc1C,0.2333
C1CC1C1NC1C1CN1,0.2979
CC1(OC=O)C(O)C1O,0.2517
CCC(=O)N(CC)CC,0.268
CN1C2C=CC1C1NC21,0.2041
CN(C)c1cnnnn1,0.1699
C1C2CC3=C(N=CN3)C12,0.2329
C#CCn1ccnc1O,0.2331
O=C1NCC(CO1)C#C,0.2896
CCC1OCC11NC1C,0.3038
Cc1ccccc1OC,0.2194
COC(C)C#CC#C,0.224
Cc1c(cnoc1=O)F,0.186
c1c(nnc(n1)O)CO,0.166
COc1cnoc1C#N,0.1896
N#CC12CC(C1)OCO2,0.2818
C#CC1OCC11CC1,0.2699
C1CC(=O)CN(C1)C=O,0.2083
O=C1C2CC2C1C1CO1,0.2251
OC1CC(=O)C1CC#C,0.2176
CC(O)C1(C)COC1=N,0.2902
CCC1OCC(O1)C#N,0.2914
CN1C2CC1C21CO1,0.3052
CC#CCC(O)CCO,0.293
CC1(C(N1)(C#C)C#C)C,0.2496
CC1C2C(=O)C1C21CO1,0.2511
OCC1CNC(C=O)=N1,0.1595
C#CC(CO)CO,0.2967
CCC(C)(C)CC(=O)N,0.2707
CC1(O)C2CNC(=O)C12,0.2655
C1CCC2OC2CC1,0.3339
CC1=CCN2CC2C1O,0.2415
CC1=CC2=C(N1)ON=N2,0.132
[NH3+]CC1CC1CC([O-])=O,0.2747
COC1CC2(CO2)CO1,0.338
CCC(C)CCCC#N,0.3474
OC1COC(=N)C1=O,0.1873
OCC12OCC1OC2=N,0.2556
[NH3+]C1C2OCC12C([O-])=O,0.1496
CC(O)C(C)(C)C1CO1,0.3287
OC1CN2C1=CC=C2O,0.2249
OCC1OCC=CC1=O,0.1783
CC1CC2OC2CC1O,0.3307
CC12C3C4OC1C4(C)N23,0.3061
CC(O)C1=CN=C(C)N1,0.2391
CCC(C)C1(C)CCC1,0.3518
CC12C3C4C(C3C1=O)N24,0.2105
C1OC2C3NC3C2O1,0.2942
CC1=C(CCC1)CC=O,0.2047
c1[nH]c2c(n1)CN=CN2,0.2024
CC1C2C(N2C=O)C1=O,0.2158
CCC12CC3CN1C23C,0.3163
OC1(CC(=O)C1)C1CO1,0.2203
CC1OCC1(C#N)C#N,0.268
CC1=C2CC3(C)C2N3C1,0.161
CC1CC2COCC=C12,0.2572
CCC12C3OC(C13)C2=O,0.2235
ON=C1CC2OCC2=C1,0.1878
CC12CC(C=C1)C21CO1,0.2443
CCOCC(O)C#N,0.2821
C1CCC2C3OC2C3C1,0.3022
CCCCC1(COC1)O,0.3121
CC1C2C3COC3C12O,0.2968
CC1C2C3C(C2CO)N13,0.3065
CC(=O)CO,0.2437
COC1(C)C(C)OC1C,0.3174
C1COC2OC(C1)C=C2,0.247
OC(CC#C)C#C,0.2843
CC(C)(CC#N)COC,0.2994
COC1(CC(O)C1)C#C,0.2825
COC(=O)N(C=N)C=N,0.2421
CC1CCCC(C)(C)C1,0.36
CCC#CCCC#C,0.2901
C1C=CC23N=COC2C13,0.2353
Cc1cnccc1C#C,0.2027
C1C2C3OC1C1OC1C23,0.3163
CNC1CC(O)C1C#N,0.2473
CC1C2CC2C1(C)C,0.3349
O=CCCC1CC2OC12,0.2274
COC1OCCC11CN1,0.3223
CCC1N=C(N)C2OC12,0.2445
CCCCN=C1CCO1,0.2777
CC#CC1CC(O)C1O,0.2841
OCCC12CC(C1)C2O,0.3226
C(=O)N(C=O)C(=O)C#N,0.1905
CCC1(C)CC(=O)O1,0.2845
CCc1cc(c([nH]1)O)N,0.2177
CC12CCC(O)C1(C)O2,0.3167
CC#CC1OC1C(C)C,0.2735
CC1C(C)C1(C#C)C#N,0.27
c1c(c2c([nH]1)cno2)N,0.1832
CC(C)OC(=N)CCO,0.282
COC1CC1CC=O,0.2255
CC1C(C)C11COC1=N,0.2803
O=C1C2CC1C1CC1O2,0.2052
OC1C(C=O)C1N1CC1,0.2113
CC(C)OCC(C)C#C,0.3105
CC12CN(C=O)C1CO2,0.2652
COc1c[nH]c(=O)nc1,0.1602
Cc1c(c(c([nH]1)O)N)N,0.2206
N=COCC1C2CN1C2,0.2698
CCc1ccc(nc1)C,0.2226
CC1N2C3COC1(C)C23,0.3134
CC1=CCOCC1C#N,0.2579
CC1CC2=C(C1)N=NN2,0.2384
C#CC1CC2(CO2)C1,0.3048
CC12CC(=O)C1(C)N2,0.2189
CN1CCC1C(C)=O,0.2076
C1CC1C#CC(=O)N,0.2323
C(C#CC#N)C#CC#N,0.2302
CCN1C(C)C1C(C)O,0.2833
CCC12COC3C1OC23,0.3065
CC12CN(C1)CC2=NO,0.2439
CC1CC(CO)C(=O)O1,0.2664
c1c(c([nH]c1O)O)CO,0.2208
CC(C)(C)C(C)(C)OC,0.3204
C1C2C3C4OCC2C4N13,0.3013
CC1C2C(=O)C1C21CC1,0.2527
c1nc(on1)NC=N,0.2215
O=C1OCC=CC11CN1,0.2437
CC(=O)C(=O)OCC#C,0.1813
C1OC2CC=CC2O1,0.2598
OC1CC11C2C3CN1C23,0.2926
CC1=NC(=N)OC=N1,0.1892
C1C2C1C13CCC1C2C3,0.3367
c1nc-2ncnoc2n1,0.1576
COC1C(=N)N2CC12C,0.2351
O=CNCC1CCC=C1,0.2581
CN1CC2C(O)CN=C12,0.2443
CC12CC3C(C1)C3OC2,0.2947
CC1CC2(CC2)C1CO,0.3323
N=C1CN=C(N1)C#C,0.191
CC(CC(C)=NO)C#N,0.2521
N=C1OCCCC1=O,0.1905
OCC1OC(=N)NC1=O,0.2525
CN1CC1C1=COC=C1,0.2285
C1OC2CC3CCOC123,0.3086
CC1(C)OC(C#N)C1=O,0.2192
CC1C2C(C)COC12C,0.3012
CCC1=CC(=O)ON=N1,0.1719
CN1C2C1C(C)(O)C2O,0.282
CCC1OC(=O)NC=C1,0.2265
CCC1=C(N)OC(=N)O1,0.2358
CCOC1=NCCC1=O,0.187
O=C1OC23CC(C2)CC13,0.2761
CC1NC11C2CC1N2C,0.2964
NC1C(O)C1(N)C#N,0.262
CC1(C)C(O)C1(O)C#C,0.2505
CCC1(CC1)C(C)C#C,0.3097
N=C1CC2CC2C(=O)O1,0.2525
CCC1CC(O)C(C)O1,0.3029
CC1OC2C(O)C12C=O,0.2121
CC1(C)C(O)C1CC#N,0.2977
CCOC(CO)C(C)C,0.3206
N=C1CCNC(=O)O1,0.2677
CCC(C#C)C#CCO,0.2809
CC1(CC1N1CC1)C=O,0.2228
NC1CC1(C#N)N1CC1,0.2547
OCCC1NC1C#N,0.2783
O=CC1C=CCNC1=O,0.2191
CC1COCOC1=N,0.2772
C#CCOc1ncco1,0.2443
c1c(n(nn1)C2CC2)N,0.2321
COCCC1(CN1)C#C,0.285
CN(C)C(=O)OC1CC1,0.2974
CCNC(C=O)C#C,0.1943
CN1C=CC(=C1)C1CN1,0.2413
COC1CC1OC(C)C,0.3104
CC1(C)CC1O,0.3327
CN1C2CC1(C)C1OC21,0.2875
CCC1(C)OCC=C1,0.2487
COC=NCC#C,0.2699
CC(C)(C)OC(=O)C=O,0.1789
OC1CC(O)C11CCO1,0.286
C#CC#CC#CC#C,0.1609
N#CCN1CC1C#N,0.2669
CC(C)(CC=O)CC=O,0.2064
OC1C(=O)C2OC12C#C,0.192
CC1C2OCC1N1CC21,0.3272
CC1CC=CC(C)(C)C1,0.2677
CC1=CCC2OC(=N)C12,0.2526
C(#N)c1nnon1,0.2295
O=CC1CN2C3CC1C23,0.2153
CC12CC1(CC2O)C#N,0.2824
ON=C1CC=C2CNC12,0.2282
c1c(c(c(o1)N)C=O)N,0.1661
CC1(CO)CC=CC1O,0.2605
O=C1C2C3C4CC2C1C34,0.2356
OCC1(O)CNC1C#C,0.2661
CC(C(N)=O)C1(C)CO1,0.2744
CC1=C(CCC1)C1CN1,0.2487
CCCC([NH2+]C)C([O-])=O,0.2681
CCCC1NC(=O)C1O,0.2706
CC1(CO)CCCC1O,0.3094
CCCC(C)C(C)CO,0.3409
c1c(cn2c1OCC2)N,0.2222
CCC1OC1C(N)=O,0.2634
CCCCC1CC1CC,0.3525
CC1NC(=O)C11CC1O,0.2732
OC1C2CC1C(O)C2O,0.3002
CC1C2CC1(O)CCO2,0.3067
CC1OC1(CO)C#C,0.2826
c1nc(on1)NC(=N)N,0.2327
CC1CC(OC=N1)C#N,0.2654
CNC1=CC(=O)NCC1,0.2065
CN=CN1C(C)CC1=O,0.2238
FC1=CN=CNC1=N,0.1795
CNc1c(nc[nH]1)C=O,0.1865
CC1C2N1C1CC21C,0.2886
CC1OCC=C(C)C1O,0.2568
CC1=NC(=CO1)C1CN1,0.2247
CC(C#CCO)C(N)=O,0.262
CCOC1C=CCC1C,0.2584
C1CC12C(=NO)CN2,0.22
OCC1=CNC(=N)O1,0.216
COCC#CC1OC1C,0.2678
COC1CCOC(=O)C1,0.2664
CC1C(O)C1C(C)=O,0.2161
CC1(CCCCN1)C#N,0.2717
CC1=CC(O)=CC(=N)O1,0.1729
CC1OC23CN(C2)CC13,0.3116
COC(=O)NC1COC1,0.3068
OC(C#N)C(C#C)C#C,0.2817
CC1CNC2=CNN=C12,0.2141
CNc1ccc(cc1)N,0.1785
CC12CCOC1C1CC21,0.3223
CCOc1cn[nH]c1C,0.2266
C1=CNC(=O)NC(=O)N1,0.2006
CCCC(CO)OCC,0.3223
CC(OCC[NH3+])C([O-])=O,0.2669
O=C1C(OC1C#N)C#N,0.2194
OC1(CCNC1=O)C#C,0.2568
CCC1(O)C2CN2C1=O,0.2203
OC1C2C3CC3C12C#C,0.2314
OCC1C=CCC1=O,0.2233
C(COC(=O)C(=N)N)O,0.1993
OC12CN3CCC1(O)C23,0.2731
C1OC2C3OC3CC=C12,0.2507
CN1C2CC1(C#C)C2=O,0.2402
c1c2c(n[nH]1)C=CC2,0.2089
CCC(=O)C1OC1(C)C,0.2209
O=C1C2OC2C2CC1C2,0.2116
CCc1ccc(n1C)O,0.2305
CC1[NH2+]C(C)C1C([O-])=O,0.2715
N=C1OCC2OCC2=C1,0.2133
c1c(n(nn1)CC#N)O,0.2391
CN1CC1C1=NC=NO1,0.2119
CC12CC(=O)C1C1NC21,0.2067
CC(C)COC(C)C=O,0.2265
O=CCNC1C2CC1O2,0.2043
C#Cc1ncc(cn1)N,0.1832
COCC1CCC1C#N,0.2887
CC1CCC=CNC1=O,0.2175
CCOC(=NC)C(C)O,0.2678
CCNC(CN)C#N,0.2678
O=COC12CC1COC2,0.267
CN(C)C(=O)C1CC1,0.2629
OC1CC2OC3CC1C23,0.3245
NC1=NCC(N1)C#N,0.244
Cc1c(=O)c(c[nH]n1)N,0.169
CC1=NC(C)(C)C(=N)N1,0.2328
O=C1NC2C3C=CN1C23,0.2115
CC1C2NC2C11CN1,0.3027
CC1(C)CC2(CC12)C=O,0.2265
Cc1cc(c(o1)C#C)N,0.1816
C#CC1(CC1)C#C,0.2667
CC1CC(CC#C)C1,0.3124
CC1(O)C=CCCC1O,0.2653
CC12CC1C(=O)OC=N2,0.24
O=C1NC2C(N1)C2C#N,0.2693
CCCC1N=COC1=O,0.2448
OCC12C=CC3C1CC23,0.2275
CCC#CCC1NC1C,0.2944
c1[nH]c(=O)ncn1,0.1996
c1cnc(cn1)F,0.2082
C#CCC(=O)CC(=O)N,0.213
O=CC1N=CN2CC12,0.2105
CC1C2CC(O2)C1C,0.327
CCC1=C(CCC1)CC,0.2498
CC1NC11C(C)OC1=N,0.2683
CCC(C)C1NC1C#C,0.2811
C#CC(=O)NCCCO,0.2333
CCC1CC(C1)C(C)O,0.3251
O=C1C=CCC1C#C,0.1867
OC12CC3CC1C2C3=O,0.2263
CCOC(=N)OC1CC1,0.314
CC(=O)C1COC=N1,0.2213
CC(C)C(C#N)C(C)=O,0.2271
O=C(C#C)C1CO1,0.1999
Cc1c[nH]c(=O)[nH]1,0.2337
Cn1c(nc(n1)N)N,0.2337
CC1CC2CC2C11CC1,0.3225
CC12CC=CCC1CO2,0.2592
CC1(CC(O)C1O)C=O,0.2201
CC(C1CC1)C(C)=NO,0.2562
CC1(C)C2N1CCC2=O,0.2107
CC(=O)N1CC2CC12C,0.2562
CC(OC=O)C(C)C=O,0.2239
CC1C2NC2C2C1N2C,0.2853
C1OC2COCC2O1,0.3201
N=C1NC(=CO1)C1CO1,0.2072
C1OC2C3CC12OCC3,0.284
C1CN(C1=O)CC(=O)N,0.2485
Cc1c(nn(n1)C)CO,0.2424
CC1OC(=O)CC2OC12,0.2782
OCC1NCC(=O)C1O,0.205
CC(=O)C1(C)CC(O)C1,0.2159
CC(=NC)OC1CC1,0.2697
COC(=O)CCC1CO1,0.2829
CC(CO)N1CC1CO,0.295
[NH3+]C1COC2=C1N=N[N-]2,0.1613
COC12CCC1C2C#N,0.2903
OCCC1C2OC(=O)C12,0.2662
CC12CC3CCC3C1O2,0.3339
Cc1[nH]c(c(n1)NC)O,0.2327
CC1C(C)C2(C)COC12,0.3108
CN=CNc1cn[nH]n1,0.2118
C#CC(=O)OCC=O,0.2083
COC(C)(CN)C#N,0.2712
CCC1OC(CO)C1O,0.2969
C1OC2CC1C1OC1C2,0.3307
C1CC11C2COC1OC2,0.3299
CC1N2C3C1=CCC23C,0.1714
CC1C(C=O)C1C=O,0.2123
O=COC12CC3C1OC23,0.2488
CC1OC1(C#N)C#N,0.2772
OC1CC2OC12C#N,0.2675
CC(=O)NCC(=O)N,0.2535
CC1(CC=C(C1)C=O)C,0.1941
N=C1OC2CC12C#N,0.2762
O=CC1NC2CN3C2C13,0.2097
COC(=O)c1cocn1,0.2271
CNC(=N)c1cnno1,0.173
CC1C2CN3C1(C)C23C,0.312
COC1CCC=CC1,0.2683
Cc1cc(cc(=O)[nH]1)F,0.1846
CC1C2C3NC3C12C,0.277
CC12CC(=O)C1C1CC21,0.2061
CCC12CC1(O)C(O)C2,0.2822
CCC(C[NH2+]C)C([O-])=O,0.2744
Cc1ncc(o1)COC,0.2364
OC1CC1C1=CN=NO1,0.2061
COCCOC(=O)C#C,0.2239
C1CC(C1)OCCC=O,0.2282
O=CCC1C2CN1C2,0.213
CC(=O)C1CN1C(N)=O,0.2173
CNc1c(non1)NC,0.2108
c1[nH]c(=O)on1,0.2527
CNC(=O)C1(CC1)C#C,0.2727
ON=C1C2CC(O2)C1=O,0.1657
CC1(CN(C1)C)O,0.2757
C(#N)C(=N)N,0.2301
CCC1CC2CCC1O2,0.325
C1C(=O)NCC(=O)N1,0.264
CC(COC=O)C1CO1,0.285
CC1=CC(=O)C(=N)OC1,0.1776
NC(=[NH2+])N1CC1C([O-])=O,0.2575
CCc1cccc(n1)O,0.21
CCC1C2C(C)N2C1=O,0.231
CC12OCC1OC2=N,0.2678
CC1CC11CC(=O)N1C,0.265
NC(C#N)C1=NNN=C1,0.2468
O=C1CC2(NC12)C1CC1,0.2168
OC1CC2=CNC(=O)C12,0.2006
CC(C=O)C(C)(C)C,0.2234
CC1C2OC(CO)OC12,0.3284
C#CCCC1NC1C#N,0.2748
COCC1CC=CCO1,0.2675
CN1C2C3OC3C1C2O,0.29
OC1CC2COC(=N)C12,0.2615
OC1=CN2C3CC3C2=N1,0.1989
CC1C2CC(C)CC12O,0.3206
C1CC2CC=CCC2O1,0.2659
CC12COC1C2C#N,0.2841
CC1CC(O)C=C1C,0.2554
CC(CC#N)C(=O)C=O,0.1557
O=CNC1CC1OC=O,0.24
CC12C3CC1C(C)(O)C23,0.3122
CCc1ccc(o1)NC,0.2132
CCN1C=NC=NC1=N,0.1775
O=C1CC2(CCO2)CN1,0.2723
CC1=NC(CO)CCO1,0.264
CC1=COC(O)=NC1=N,0.2126
CC1(CC=O)CN2CC12,0.216
CC1(CC#C)CCC=C1,0.2619
CC1(O)C2C3N2C1C3=O,0.2329
CC(O)CC1CCOC1,0.3032
OC1CC2CC1(O2)C#C,0.2628
CC1=C2CCC2C(O)C1,0.2421
CC1CCC2(CCC2)C1,0.3606
CCC1NC11CC(O)C1,0.3111
OCC#CC1CC=CC1,0.2652
COC(C)C(=N)NC=O,0.2257
O=C1CN2CC3C2C13,0.2055
Cc1c(c(ncn1)F)N,0.2014
C1C2C=CC3CC(O3)C12,0.2363
CC#CC1CC1(O)C#N,0.2545
CCn1c(cc(n1)C)N,0.2427
CNC1C(O)C(O)C1=O,0.189
CC1CC(C)=CC(C)O1,0.2601
O=CC12NC1C1OC21,0.2054
N=C1COC(O1)C1CO1,0.2883
C1CC12C(=O)NCCN2,0.2483
CCC1CN1C1COC1,0.3082
O=COC1CC1CC#C,0.2634
C1CC2CCC=CC2C1,0.2626
C(=O)C(=N)NC=O,0.1674
COCC1NC1C1CN1,0.3017
N#CC1(CN2CC12)C#N,0.2592
CC(CNC=O)CC=O,0.226
CN1CC(C1)C(=O)C#C,0.1589
CCC#CCC,0.2979
CC(C)C1CCC1C,0.3562
CC1(CO)CC(N1)C#N,0.2683
CC(C)(c1cn[nH]n1)O,0.2547
N=C1C=NC(=O)ON=N1,0.1721
CC1N2C(C)CC12C#C,0.2475
OC1C2COC(=N)OC12,0.2996
C#Cc1cc2n(n1)CC2,0.2207
CC1CC11COC(=O)N1,0.2964
C#Cc1cccc(n1)N,0.1784
CCc1c([nH]nc1O)C,0.2434
CC12CCC1CCO2,0.3198
CC1N(C)C11CC(O)C1,0.2922
CC1C2N=CNC12C#C,0.2346
C1OC11CCC2OCC12,0.3207
CC#Cc1cc(c[nH]1)O,0.1885
CCCC(C)CCCO,0.3427
C1C2OCC3C4C2C4N13,0.314
OC1(COC=NC1)C#C,0.2669
N=COCC#N,0.2828
C#CCCCC#CC=O,0.205
C1NC1C1(CO1)C1CN1,0.3121
CC1CC1OCC1CC1,0.3325
CC1=CCOC(=O)C1=O,0.17
OC1C2NC(=O)C(=O)C12,0.1716
CCC(=O)CC(=NO)C,0.2104
CC(O)C1=NOC(N)=C1,0.2326
CC1(O)CCC2CCC12,0.3285
CCC(C#C)C(C)OC,0.3064
O=CC12CC1(CC2)C#C,0.2079
C1CN1c2c(nn[nH]2)N,0.2101
c1c(ocn1)NC2CC2,0.2177
N=C1CNC(=N)N1C=O,0.2151
C1CN=C(NC1=O)CO,0.2389
CC1(COCOC1=O)C,0.27
c1cc(=O)cnc(c1)O,0.1392
CC(C)C1(C)C2CCC12,0.3294
CC(=O)C12CC3C(O1)C23,0.2121
c1([nH]nc(n1)O)N,0.2478
CC1C2C1C1NC2C1=O,0.2318
COC1CC(C=C1)=NO,0.1929
CC12C3C(CO)C1CN23,0.3038
Cc1ccoc1C(C)C,0.2349
Cc1cnc(o1)NC=N,0.2054
CC1CC2CC1(C)C2=O,0.2291
CC(C)c1cccnc1,0.2285
COCC12OC3C1CC23,0.2948
CC1C2C3NC3C12O,0.2778
CC1C2C3CN3C12CO,0.2824
COC(CC#C)C=O,0.2145
NC(=O)C1OC2C(O)C12,0.215
C1CC(=O)CCC1=NO,0.2218
CC1CC(C)C(N1)C#N,0.2679
OC1C2C3C4C=C1C2C34,0.1787
C#CCC(=O)NC(=O)N,0.2397
CC1CC(O)C(=O)C1C,0.221
CC1(CN1CCC=O)C,0.2109
CC1=CC(NC1=O)(C)C,0.2216
OC1C2C(=N)NC12C#N,0.2421
C1NC2C11OC22COC12,0.1956
CCN=C1NC(C)C1O,0.2566
c1c(c2c(o1)nno2)N,0.1727
COC1CC11CN2CC12,0.3084
NC(CC1CO1)C#N,0.2848
CC12CC1C(N)=CC2=O,0.1977
CC1COC(=N1)C#C,0.217
CC1C(C)(C)C1(C)C=O,0.2281
c1coc2c1C(=O)NC2,0.226
OC12CN3C(CC=C1)C23,0.2344
N=COC(=O)C1COC1,0.2267
N1CC1C12OC3C1CC23,0.3084
N=C1C=NNC(=C1)C#C,0.1627
c1c(non1)NC(=O)N,0.2212
C1CC1(CO)OCC=O,0.2267
O=C1C2CC2CC1C#N,0.2228
c1c(nco1)CC(=O)N,0.2455
CC1=CCCC1C#N,0.2598
COC1CCN(C1)C=O,0.2651
CC(C=O)(C#C)C#C,0.2159
CC(=O)CC(=O)CC#N,0.2147
C#CCc1ncno1,0.2497
CC12CC3OCC3C1N2,0.31
C(=O)C(=O)NC=N,0.1621
CC1(CC(O1)C=O)C#N,0.2173
OCC1CC1CNC=O,0.2806
OC1CC(=O)N2CC12,0.2421
CC1OCC1OC=O,0.2605
C1NC1C1C=CC2CN12,0.2288
CC1(CCO1)C#CC=O,0.2016
CC1NC1C(=O)CO,0.2274
CC(C#C)C1NC1C=O,0.2216
N=C1CC=CC(=O)N1,0.2031
CC(C)(O)CC(O)C#N,0.3082
CC12CC(O)(C1)C1OC21,0.3233
CC12OC3C1C3(O)C2O,0.2943
CCC1OCC(=O)C1=O,0.1346
CC1=CCC2OC12C,0.2461
NC(=[NH2+])C1=C([O-])N=CN1,0.1624
CC1OC(=N)C2CC12,0.2789
CC#CC1OCC1(C)O,0.2676
CC1CC2OC(N)=NC12,0.2747
C1CC11CC2CC1CO2,0.3272
CC1CNCC(N1)C#N,0.2402
Cc1c2c(c[nH]1)CCO2,0.223
COC(C)C(=O)OC=N,0.2275
C1OC2C=CCOC12,0.2521
C1CC1NC(=O)N,0.2939
CC1COC(CO)C1O,0.3014
Cn1c2c(n[nH]n2)nn1,0.2029
OC1(CC#N)C2CC1O2,0.2771
OCC1CC2OC12CO,0.3213
c1c2c(c(o1)N)nno2,0.1497
CC(=O)CC1(CN1)C#N,0.2165
NC1=C(N)C=NC(=N)O1,0.1652
NC1=COC(C[NH3+])=C1[O-],0.1365
CC1CNC2=C1NC=N2,0.2075
O=CNCC12CC(C1)C2,0.283
COc1c(onn1)C#N,0.1797
C1CC11COCC2CN12,0.2985
COC1CN2N=NC=C12,0.2609
OCC1C=CCCC1O,0.2641
CC(CC1CO1)C(N)=O,0.2762
OC1C2NCC2OC1=N,0.2645
CC(C#N)(C#N)OC,0.2786
OC12COC34CC(C13)C24,0.2905
CC1(CC1)C1CCC=C1,0.2618
Cc1c[nH]c(=O)nc1C,0.1792
OCC1=CC(=O)CC1O,0.1917
CC1C2C(O)C1C2(C)C,0.328
C1OC23CC(CC12)C=C3,0.2416
C1C(=O)CN1C(=O)N,0.2163
Cc1c(oc(n1)C#C)C,0.1908
CC1NC(=N)C(O)C1=O,0.2077
COC1OCC=CC1O,0.2533
C1CNC(=C1C=O)CO,0.1737
OC12CCC(CC1)OC2,0.305
CC(C)CCCOC,0.3339
CN1C=NC(C)(C)C1=N,0.224
CNC1C=CCOC1=O,0.2177
CC1CC23OC(C=C2)C13,0.2165
CC(CC1(C)CO1)C=O,0.2281
OCC1OC11CN2CC12,0.3081
CC12COC3=NCC1N23,0.2256
C1CC2(CC(=O)C2)OC1,0.2146
CC(=NO)CC#CC#N,0.2211
OC(C#C)C1COC1,0.2706
CC1(NC2CC12O)C#N,0.2579
C#CCN(C=N)C(=O)N,0.2537
CC1OC2(CC12)C1CO1,0.2983
CC12CCN3C(C13)C2O,0.2921
CCC1(C)CCC2CC12,0.341
c1coc2c1c(n[nH]2)N,0.2171
CC(CO)C1CN=CO1,0.2715
OC1CCCOCOC1,0.3259
CC#CC(=O)OC,0.2341
Cc1c(cc(o1)N)C=O,0.1633
O=COC1COC1C#C,0.2645
C1CC2(C1)C1OCOC21,0.3068
CC#CCCC(C)C,0.3032
OC1=CNC(=[NH2+])C([O-])=C1,0.1482
CCC1(CC1)COC=O,0.2821
Cn1cnnc1,0.2659
CC1(O)COC2CCC12,0.3047
COCC(=O)NC=O,0.2221
C1(=C(C(=O)NC1=O)N)N,0.1383
Cc1coc(n1)CCO,0.2419
C1C2C3C4=CCC13C24,0.1496
C1C2OC1C1=NNC=C21,0.2478
c1ncn(n1)C(=O)N,0.2459
CC12NC1COCC2O,0.3069
CC1=CC2(CCC2)OC1,0.244
CN=C1NN=NC(C)=C1,0.16
CCC(CC#N)NC=O,0.2807
ON=C1C(O)C(O)C1O,0.2215
CC(C)C1(CCN1)C#N,0.2666
C1OC1C1OC2CC2O1,0.3352
CC1COCCC1(C)O,0.3162
C(C#CC=O)C(F)(F)F,0.2041
C1CCC2=C(C1)COC2,0.2472
CC1C(C#N)C1(C)C#N,0.2874
CC1=CC2OC1(C)C2=O,0.2465
C1C2COCC3CC12C3,0.3224
O=C1CC=CCC2NC12,0.2191
C#CC#CCOC1CC1,0.2221
CN1C2C3C4CCC13C24,0.2939
CN1CC2(CC12)C=O,0.2007
CC12CC1N=C(CO)O2,0.2634
OC1C2CC1C2(O)C=O,0.2212
CC1CC2CC3CC12O3,0.3145
OCC(CO)C1CN1,0.2965
C#Cc1c[nH]nc1C=O,0.1909
c1nc([nH]n1)CNC=O,0.2559
C1CC1OCCOC=O,0.2758
CC1C2CC1(O)C(O)C2,0.3117
OCCC1CCCC1O,0.3249
CC1=CC2OC3C2NC13,0.2286
CC(=O)CCCCC=O,0.2263
CC1(C)CC1OC(N)=O,0.3089
N#CC1CNC(=N1)C#N,0.2027
CC(=O)N(CC#N)C=O,0.2354
CC1(CO1)C1=CNN=C1,0.2532
CCCCn1ccnc1,0.2535
CC12CC3CC3C1O2,0.3341
COCC1C(C)C2CN12,0.3042
N=C(C#C)N1CCC1=O,0.214
CC(=O)OC1CC1C#C,0.2584
[NH3+]CCC(CO)C([O-])=O,0.2713
CC(O)C1C2OCC12C,0.3
CC1C(C)C1C1CN1C,0.2935
C1OC23CC(CC2)C13,0.2954
NC(C#C)C(=O)NC=O,0.2087
CC1(CO)CNC1C#N,0.2635
C1CC2CC3OC3C2C1,0.337
c1c(non1)C2CC2,0.2362
CC12C3C4C1C4(CO)N23,0.2786
CC1C2CC2C2CC1O2,0.314
CCCC(CC)CO,0.3392
CN1C2CC1(C=O)C2O,0.1728
NC1(CC1O)C(F)(F)F,0.3126
CCc1ccc(cn1)F,0.2176
CNC(=O)NC=NC,0.2495
CCC(=O)C1OC1C#C,0.2186
COC1C(C)C=CC1=O,0.1727
C1C2CC3=C(C=NN3)C12,0.2404
CCc1c(ncn1C)N,0.2158
Cn1c(noc1=O)CO,0.2372
CC1CCC1C#CC#C,0.2247
CC1=C(CCOC1)C#N,0.2201
N#CC12CC3NC1C3N2,0.2624
CC1NC(=O)C1OC=O,0.2591
OC1CCC(=O)NC1=O,0.2371
CC1(O)C2CCOC12,0.2991
O=CC#CC1C2CC1O2,0.1866
C1C2OCC3NC3C12,0.3037
OCC12OC3CC1C2C3,0.3227
CC1C2(C)CC(C)C12C,0.3119
C1C2C3C4OC2C1C34,0.3352
CCC1C2CC1(C)CC2,0.3585
COc1coc(=O)[nH]1,0.2454
c1c(nc(o1)O)CCO,0.2442
CCC(C)C1CC1C=O,0.2278
Cc1c(nco1)C2CC2,0.227
CC12C3CC=C1C1C3N21,0.1602
CC12CC3C4C1N4CC23,0.3271
CN1C2CC3C1C2C3=O,0.2058
C1C2CCC=CCCC12,0.2644
CN1C2C1C1(CN1)C2=O,0.202
CCC1(CO)C(C)C1C,0.3233
CC1C2N1CC21COC1,0.2984
CC1CCC=CC11CN1,0.2531
CC1OC2C3C2N2C3C12,0.2753
CC1=CN=NOC1=N,0.1675
c1c([nH]nn1)CN2CC2,0.2541
CCOC1(CCC1)C,0.3253
COCC1NCC1=NO,0.2253
CC1CC2OC1C=C2C,0.2517
O=C1OCCCC2OC12,0.2503
CC1CC1(NC=O)C#N,0.269
NC12CN=C3NC1C23N,0.202
CCC1N2C3CC2C13C,0.3153
O=CC1(CN=CN1)C#C,0.1939
CCC12CNC1C(=O)O2,0.2407
C(C#N)NC(=O)C(=N)N,0.221
CC#CC12CCN1C2C,0.2456
CC#CC1(O)CCC1C,0.2793
c1cnn(n1)CC=O,0.2184
CCOC(C#N)C(C)N,0.2819
N=C1OCOC1C=O,0.2168
CC(=O)C12COC1CN2,0.2032
C1CC2C3CCC2(C1)O3,0.3184
C#CCN=CNC(=O)N,0.2485
OC1CN(C1)C1CC1,0.3057
CC12COC(O1)C1OC21,0.338
CCCOC1CCOC1,0.3265
c1c(c2c(o1)CCC2)N,0.2215
O=C1CNC2COC1C2,0.2029
CC1C=CC(C#N)N1C,0.2238
CCC1COCC1CC,0.3227
CCC1(C)CN1C,0.3001
c1cn2cnoc2n1,0.2082
c1cc2c(nc1)OCC2,0.2009
c1c(nc2n1CC=C2)O,0.161
Cc1cccc(c1O)O,0.2143
CCCC(C)(CC)C=O,0.223
COC(=NC1COC1)N,0.273
N=C1CC2(CN2)C(=O)N1,0.2402
CC(C)CNC(=O)C,0.2784
C#CC1CC1NCC#N,0.263
CN1CC(C1)OC2CC2,0.296
C1CNC=C1C(=O)N,0.1933
N=C1CCC=CN1C=O,0.2069
CC1(C)NC1C(=O)C=O,0.1492
C1C2C3NC3C3CN3C12,0.2791
O=C1NC=CCN2CC12,0.2153
CNC(=N)c1n[nH]nn1,0.1802
Cc1cc(on1)N2CC2,0.2293
C1CCNC(=O)C(=O)C1,0.1926
CN1CCC(N)(C1)C#N,0.2535
CC(CCO)CC#N,0.3075
N=CN1CCCC1=O,0.2217
C#Cc1c[nH]c(c1N)O,0.2006
CCCCC#CCC,0.3018
CC1CC(O)C11CCC1,0.3155
CCC1C(O)C1OC,0.2935
CCC(C)C1COC=N1,0.269
CC#CC(=O)C1CC1C,0.2038
CC(=O)COCC#C,0.2348
C#CC1C2C1C1CCC21,0.2898
c1coc2c1[nH]c(=O)o2,0.2112
CC(C)C1CCC(C)=C1,0.2575
CC1OCCC2CCC12,0.3202
C1CC2CC=CC(O1)O2,0.2561
COC1C2CC2C1O,0.315
CCC1COCOC1=O,0.2674
O=C1OCC2OCOC12,0.2516
OC1C=CC2=CNC=C12,0.1933
CN=C1OC2CCOC12,0.2648
CC1C2C(C=O)N=CN12,0.209
C1CC1C#CC2(CC2)O,0.2656
N=C1OC(=O)C2CC1C2,0.2547
Cc1cc(on1)NC,0.2277
CC(=O)C1C(O)C1(C)C,0.2135
CC1CC(C)(C)C2OC12,0.3375
c1ncn(n1)C2CC2,0.2601
CCN1C2C3N4C3C1C24,0.2889
NC1C(NC1=O)C(N)=O,0.247
CCc1ccn(c1C)C,0.2386
COC12CC3(C)CC1C23,0.3252
CCC1=NC(=N)NN=N1,0.1652
C#CC1C2CN1C21CC1,0.2614
N=COC1C2C3OC2C13,0.2604
c1cnc-2occnc12,0.1412
Cc1ccc(cc1O)F,0.2218
N=C1NCC=CC1=O,0.1555
CC1(C=O)C(O)C1C#N,0.2243
CC12CC1C(O2)C#C,0.2633
CC1CC2CCC1CO2,0.303
OC1CN(CC#N)C1=N,0.2524
CCC1=CC(=O)NN=N1,0.1796
CC(C)C1CCC2OC12,0.3365
CC1OCC1OC(N)=O,0.2973
CC1CCC(O)C2CC12,0.3245
CCC(=O)C1COC1C,0.2251
NC1=CC([O-])=C(C[NH3+])O1,0.1802
O=C1CC2C3COC2C13,0.2247
CC1=NCCOC(=N)N1,0.2367
O=C(CCC1CO1)C#N,0.1937
CC12CC(O)C1C=CC2,0.2508
C1C2CCOC3CC2C13,0.3154
CC(C)C1(CCO)CO1,0.3307
CNc1c(nn[nH]1)C#C,0.2133
CCC(O)C#CC1CC1,0.2745
CC1CC(=O)OCC1O,0.2686
C1OC1C12CC3C1CC23,0.3481
CNc1c(c[nH]c1O)N,0.2286
CC1CCCCC(=O)C1,0.2248
COCC1OC=NC1C,0.2693
CN1C=CC(CO)C1=O,0.2089
OC12CC1C1OC1C2,0.3233
CCC(C)C1CC1CO,0.3352
OC1C2C3CN4C(C23)C14,0.2879
CC12CC3OC(C)(C1)C23,0.3133
CCC1(OCC1C)C=O,0.2118
CC#CC(O)C(C)(C)O,0.2804
COCC(C)(O)C(N)=O,0.2745
OC12C(OC1=O)C2C#C,0.2413
CC1CC2(C)OC1C2O,0.3324
CCC(C)OC(C)C#C,0.2972
CC1C2CC(C#N)C1O2,0.2958
CC(O)(C#N)C(N)CO,0.258
CCC1=CCOC2CC12,0.2452
c1ncnc(n1)CCO,0.2184
CC1(CCOC1)C1CO1,0.3307
CC(CC#C)OC(N)=O,0.3144
COC=NC1CCC=C1,0.2589
COC1CC=CC(O)C1,0.259
CC(CC#C)(C#C)C#N,0.2823
NC1=NNN=C1C1CN1,0.2116
CCC(O)CCC(C)C,0.3328
CCOC12CC(C)(C1)C2,0.3369
CC1N=C2NC3C1C23O,0.1611
C1C2N1CC1C3CC21C3,0.3142
OC12C3CC(C13)C21CN1,0.2812
OC12CN(C1)C2C=O,0.2174
C1CC12CC(C2)C=O,0.2229
c1c2c(c[nH]1)OCO2,0.2357
CC12CC3C1COC3O2,0.3288
NC1(COC1C#N)C#N,0.2623
COC(C)(C#N)C(C)=O,0.2223
CC12COC1C2(N)C#N,0.2647
OCC1CC2NC12C#N,0.2608
C#CC1C2OC2C1C#N,0.2766
OC1C2CCOCC1O2,0.325
CC12C3C(O)C1CN23,0.2979
CC1=CCC2(C)C(O)C12,0.2368
CC(C)C(C)NC=O,0.2825
CCC1(C)CC2CC1O2,0.3246
CCC1(C)CC1O,0.3331
c1cocc1C#CCO,0.2113
CC1OC23CN(C2)C13C,0.2515
O=CC1NC1C#CC#N,0.2069
c1c2c([nH]n1)OCCO2,0.2326
CCC(=O)N1C(C)C1C,0.2572
C#CC1CN(C1)CC=O,0.2072
CCC1=CC(=N)OC=C1,0.1689
CCC12COC1C2C=O,0.2124
C#CC1C2NC2C2CN12,0.2737
Cc1cc(c(nc1)C)F,0.2175
CC1(CC1)C1C2CC1C2,0.356
COC1C2OC1C2OC,0.305
CC1C2OC(=NC12)C#N,0.2049
CC(C)COC(=O)CN,0.2619
C1CC1C1CN=CO1,0.2714
COCC1COC1C#N,0.2675
CC1C=CC(=O)C11CO1,0.1817
CN(C=N)c1ncco1,0.2055
c1c(oc(=O)cn1)O,0.1625
OC12CC(O)(C1)C1CC21,0.3149
C1CN1c2nc([nH]n2)N,0.2406
NC1C(OC1=O)C(N)=O,0.241
OC12C3CN(C13)C2=O,0.2345
OCC1NC11CNC1=O,0.2712
CC1(C)N=COC1CO,0.2676
c1cc(oc1)C(=O)C#N,0.1667
O1C2C1C1C3C4C(C23)N14,0.2936
CCn1cc(oc1=O)O,0.244
CC1=NC(F)=CNC1=N,0.1496
CC1CC23COC12CN3,0.2623
C[NH+]1CCCC1C([O-])=O,0.2607
C#CCn1c(ncn1)N,0.2387
O=C1C2CCC1N1CC21,0.2003
OC1CN2CC3NC3C12,0.2776
OCC12CC(O)(C1)C2O,0.3286
NC1=C(ON=C1)C1CN1,0.1964
CC12CC(O)(C1)C(O)C2,0.3151
CC1OCC(O)C2OC12,0.3249
COC=NCC#CCO,0.2664
CC1=CCC2COCC12,0.2615
C1Cc2c(nnn2C1)N,0.2168
CC1C2C(O)C2(C)C1C,0.3072
OC1C2C(O)CC12O,0.2866
O=C1OC23CC(C2)NC13,0.2382
CC#CC(O)CC(C)C,0.2869
CC1C2OC(C=O)=NC12,0.1767
OC1COC(=N)C11CC1,0.2769
CCC1C2CN1CCO2,0.2895
O=C1C2CC3OCC1C23,0.2132
CC(C)CCC1CN1C,0.2982
CC1OC2CN3C2C13,0.3116
OC1(CC1CC#C)C#N,0.2787
O=C1OCCOC2CC12,0.2477
c1cncc(c1C=O)F,0.1788
CCC1OC1(CO)CO,0.3232
CCC1(O)CC1C#C,0.2878
CC(=O)CC(CO)C#C,0.2113
C1C=Cc2c1nc(o2)N,0.1716
CC12CC1(O)CC1CN21,0.2914
ON=C1COC2CC1C2,0.2496
CC(C#C)C1=COC=N1,0.2462
OC1C=CC2=C1NC=C2,0.1756
NC(=O)C1(CO1)C1CO1,0.2607
N#CC12CNC3C(N1)C23,0.2403
O=CC1CC2OC3C2C13,0.219
CC1CC(C#N)C2OC12,0.3111
C1C(CO1)O,0.3069
CCC1OCC(=C1)C#C,0.2045
CN1CC23OCC2CC13,0.2753
CC12CC1C1OC1CO2,0.299
CC1CC(CCO)C=C1,0.2615
C(#Cc1n[nH]nn1)C#N,0.2027
C(=O)N(C(=N)N)C(=O)N,0.2237
OC1C=CC2NC12C=O,0.2068
CC1COC2C(O)C2O1,0.2803
C1COCC(=O)C(=N1)N,0.1672
CC12CC(C#N)C1CO2,0.28
CC#CC1(C)OC2CC12,0.2636
N#CC12CC3C1N3C2,0.2674
c1c(nno1)NCC#N,0.1991
COC12CN=C3OC1C23,0.1696
Cc1nc2cnoc2o1,0.2208
CCNc1cc(no1)C,0.2273
CCC(O)(C=O)C1CC1,0.2225
Cc1ncc(=O)on1,0.1592
CC1OC(N)=NCC1=O,0.2019
CC(O)C1=COC=C1,0.2415
CC(O)C1CCC1C=O,0.2236
C#CC1CCC2CC2O1,0.2828
CC12CC3(C)N1C2C3=O,0.2333
N=C1OC2CCC1O2,0.286
CC1(C)C(O)C1(C)C=O,0.2213
O=C1COC2CC1C=C2,0.2003
C1C2C3C1C1CC=C3C21,0.1637
CC1(C)N2CC2C1=NO,0.2354
CCCCCC#CC,0.3043
CC(C)C12COC1CO2,0.3008
CCC(C)(O)C1CN1C,0.2844
CCC(=O)C1NC1C=O,0.201
CC1OCC2=C1ON=C2,0.2294
CC1=NC(=N)C(F)=CO1,0.2035
C1CC2C1N1C=CC=C21,0.2416
C#CC1(COCO1)C#N,0.2676
C1CC1(CC#CCO)O,0.2789
CC1(CCO)CC1C=O,0.2267
C(C#N)N=COCC#N,0.2736
O=C1CC(=O)C2CCC12,0.1942
C(CO)C#N,0.3237
NC=[NH+]C(CO)C([O-])=O,0.1521
CC1CC(O)C1CC=O,0.2253
OC1C(=O)CC11CN1,0.2054
CN1CC2(O)C(C=O)C12,0.1829
CNC1=NCCOC1=N,0.193
CN(C=O)C(=O)NC=N,0.2248
CC1C(C#N)N1CC#N,0.2673
CC(O)CCNC(N)=O,0.303
COC(C)C1(C)CCC1,0.3289
CNC1C(CO)C1C#N,0.2477
CC1CN1C12CN(C1)C2,0.304
O=C1CNC2=NCCC12,0.1947
ON=C1C=CCCC1O,0.197
COC1=CC(=N)ON=N1,0.1463
CC(CO)C1(O)CC1O,0.3157
C(COC=NCC#N)O,0.2719
N#CCC1C2CC1CC2,0.3418
CC1CCCOC=NC1,0.2577
CC1(CC2CC2O)CC1,0.3314
CC(C)CCC(C)C#N,0.3485
CN1CC2=CNC(=O)C12,0.1914
Cn1ccc(n1)CCO,0.2578
CC(C)(CO)OC=O,0.2802
c1cc(cnc1)C2CC2,0.2206
NC1=CC(=O)CCC1O,0.1953
CC(C)C1(C)C(C)C1O,0.3119
CCc1c(cco1)C=O,0.1947
CCC(CO)COC,0.3235
OC1C23CCC12N=CN3,0.2327
CC1C2OC1C2CC#C,0.2903
CC1C=C(C)CC1=NO,0.2435
OCC(O)C1NC1CO,0.3033
C1CCC(C1)CN2CC2,0.3138
Cc1c(cc(n1C)O)O,0.2275
c1c(cc(nc1N)N)O,0.2141
OC1C2NC2C1C1CO1,0.3127
C1CCC2(C1)OCCO2,0.3293
COCC1(CC1)CC#C,0.3059
O=C1NC2C3NC3C2N1,0.2973
CCC1(CCO)CC1C,0.3358
C1OC2C=CCC2=C1,0.2461
NC1C(N)C1C#N,0.2639
CCC(C)(C#C)C#C,0.2938
CC1C(O)C1CCC#N,0.3023
N#CC#CC1OC1C#N,0.2259
O=CN1CC11CC2NC12,0.2469
N#CC1CC11C2CC1O2,0.2757
C1CN1C(=O)C(=O)C#N,0.1573
CC12COC1(C)C1CN21,0.3067
OC1C2C3CCC1CN23,0.284
Cn1cnc(c1O)O,0.2189
OC1CC11CCOC=N1,0.2558
C#CCn1ccc(n1)O,0.2403
CC1C2C3C2C2C3C12O,0.2846
OCC1=NCC(O1)C=O,0.2193
C(CC(=O)C(=O)N)C=O,0.1769
CC(C)C1C2CC1C2O,0.3232
CC(C#N)C1OCC=C1,0.2509
CCC(C)(C)CC=O,0.2223
COC1CC1C(C)(C)C,0.3247
C1C23COC=NC12CN3,0.2382
CN=CNc1c[nH]nn1,0.213
CC1(CCO)C2CC1C2,0.3419
CCCC1CC(O)C1O,0.3036
COC12C(C)C1NC2=N,0.2454
OC12CCC(C1)OCC2,0.3164
CC(=O)C(C)(C)C1CO1,0.227
CC1N(C(C)=O)C1(C)C,0.2552
OCC12CC(OC1)C2=O,0.2059
CCC(C#N)C(=O)CO,0.2336
OC1CCC2=C1N=NN2,0.2436
CC1(O)C2C3COC2C13,0.3066
CNC(=O)c1ncon1,0.2054
OCC1(NC1C#N)C=O,0.2141
CCC1OC1C1CCC1,0.3387
COC1C(C)C1C#CC,0.2711
CC1CC11C2OC1C2O,0.2956
CC(=O)C1=CC2CC2C1,0.1902
C1C2NC2C2=NOC=C12,0.2414
CCC1(C)CC(O)C1C,0.3219
CC1(C)NC2CC12C#N,0.2515
CCOC1C2NC2C1C,0.3019
CC1(O)CCCC1=O,0.2179
O=C1NCC2CC2O1,0.3028
CC12C3OC1C1C3C21O,0.3015
CC(CC#C)C1(O)CC1,0.3069
CN1C2C1C(=O)C2O,0.2048
CC1C2(O)CC1(C2)C=O,0.222
CC1(C)C2CC2C1C#C,0.2991
C#CC1(CC1)C1OC1,0.2931
COc1cccc(n1)F,0.2121
OC12CC1C1OCCC21,0.308
CN1C23CCC12COC3,0.296
CNc1c(n[nH]n1)NC,0.2077
CC12CC3C1CC(=O)C23,0.2216
OC12CN3CCC1CC23,0.2771
CC(=NC)NC(=N)C=O,0.1871
CC1=CCC(=O)N1C,0.2095
NC1C(OC1=O)C#N,0.247
CC12CC3N1C2C3(C)C,0.319
CCC12C3C4C(N13)C24O,0.2656
c1cnn2cncc2n1,0.1425
CCOCC(=O)C#CC,0.209
[NH3+]CC1=N[N-]C(=N1)C#N,0.2379
CN=C1NC(=O)C(C)=C1,0.1851
CC1C2C3OC1C(O)C23,0.2962
c1nc(no1)N2CCC2,0.2124
CN=c1ccn(nc1)C,0.1629
CC#CC1(C)OCC1C,0.2786
CNC1(C)COC1=NC,0.2566
COCCC1CC(=O)O1,0.2717
C1C=C(CC1=O)CC=O,0.2089
CC1COC2C(C#C)C12,0.2702
C1OC23C4CC2(C4)NC13,0.2633
C#CCC1C2C3CC2N13,0.2865
CC(=O)C1(O)CC2CC12,0.2193
CCOC1=NCCC1,0.2814
CC1N2CC=CC12C#C,0.223
C1CC(C1)NC(=O)C=O,0.1745
CC1=NC(CO1)C#C,0.2708
NC1=COC(=O)OC1=N,0.1813
COC12COC3C1CC23,0.3188
CC(O)C1C(C)NC1=O,0.2804
CC1COC=NCC1O,0.2519
O=CC1OC2CCC1C2,0.2179
CC(O)C1(C)OC1CO,0.3195
[NH3+]CCOCC([O-])=O,0.2726
C1OC2C3CC=CC2C13,0.2346
OCC1(O)C2OCOC12,0.2996
CC(C)CC#C,0.3143
CC1CC2=CC(=O)OC12,0.2207
CC12COC1CCO2,0.3262
COCCC1CNC1=O,0.2797
CC(=O)C(=NCC#C)N,0.1903
N=COC1C=CC2CC12,0.2402
C1C2OCOC12,0.3209
c1cc(oc1CO)N,0.2139
COC1CCC(=O)C1O,0.2196
O=C1CCC11C2CC1C2,0.2076
Cc1cnc(c(=O)[nH]1)N,0.1667
COc1cnn(n1)C=O,0.1959
CCC12CC1CC2OC,0.3226
CC(O)C1=NNC(C)=C1,0.2557
OC1C(O)C1(C#C)C#C,0.2498
CC#CC(=N)OCC=O,0.2203
COC1(CC1)C#CC#C,0.2108
CN1C2C3C1C2C31CO1,0.3046
N=C1CC23CC2(CO3)O1,0.2589
CC1N=COC2CC12C,0.2678
OC12CC3C1OC23C#N,0.2451
C1C2COCC3CC12O3,0.2983
CC1=NNC(=C1)C1CN1,0.2412
O=CC12CC(C1)CC2=O,0.2113
CC1OCC2CCC12,0.3251
Cc1cc2c([nH]1)[nH]nn2,0.2096
CC1(C)CC(C)(O)C1O,0.2999
CC1C2(C)NC(=O)C12O,0.2395
CCC1(CC(C)C1)C=O,0.2256
C(C1CC1)C12CC1OC2,0.304
CN1C2C3C4C=CC13C24,0.2102
CC1(NC2COC12)C=O,0.2012
CC1CCC1CC(C)=O,0.2332
O=C1CC2(N1)C1COC21,0.2605
OCCC1CC(C1)C#N,0.3053
N#CC1C2OC1C2(C)C,0.2826
OC(C#C)C12CC1CO2,0.2828
CC12CC1(C#C)C1CN21,0.2596
C#CC1(CC1)C2COC2,0.2869
COc1ccc([nH]1)CO,0.2195
COC1C2C3C1C2C3=O,0.251
CC1C(O)C11CCC1C,0.3074
N=C1OCC(=O)N2CC12,0.2346
CC1=NCCC(=O)CO1,0.2169
OCC1=CC2CC2C1,0.2444
CC1COC1(C)CCO,0.3187
OC1CCC=CCC1O,0.2544
CC1CC2C=CCC12O,0.2621
c1nc2c(o1)CCOC2,0.236
OC12CC3(COC3C1)C2,0.3132
OCC1(CO)NC1C#N,0.2796
CCCNc1cnoc1,0.2078
CC1C(CN1C=O)C#N,0.2648
OC12C3CC1C3OC2=O,0.2696
Cc1c(n[nH]c1C#N)C,0.2196
C1C(CO1)CCCC#N,0.2844
O=C(C1CN1)C1CO1,0.2165
CC1(O)C2CN2C1C#N,0.257
CCC12CC(C)(C1)C2,0.3754
c1nc(n(n1)C2CC2)N,0.2498
COc1cc(oc1)OC,0.2339
CC1=CCC(CC1)C#N,0.2598
OC1C2OC3COC3C12,0.2834
OC1CC23CCCC12O3,0.3074
CCc1c(cc(o1)N)C,0.2189
c1[nH]c(nc(=O)n1)N,0.2113
COC12C3CC4C(C14)C23,0.309
c1cnc-2cncc2[nH]1,0.116
c1c(nc(cn1)F)C=O,0.1658
CC(C=O)(C#N)C#N,0.2228
CNC(=NCC#C)C#N,0.2026
CC1COC(=O)CC=C1,0.2535
OC1CC2CC2C1C#N,0.3191
c1coc(=NC2CC2)o1,0.2235
O=C(NCC#N)C1CN1,0.2579
COC1CC(O)C1(C)O,0.307
O=C1OC23CC12NCC3,0.2466
COC1C2C3CN2C13C,0.3059
CC(CO)C1=CNC=N1,0.2517
CC(O)C1(C)CN1C,0.2902
CC(C)Nc1ncco1,0.2313
CC(=O)NC1CC2CC12,0.2752
CCC(C=O)C(C)C#C,0.225
CC1=C2CC(O)C2OC1,0.2316
CC12CC3OC1(C)C3N2,0.2977
CC(O)C1(CC1)N1CC1,0.2933
CC([NH3+])C(CO)C([O-])=O,0.2701
OCC1C2OC2C11CC1,0.3132
CC(C)c1cccn1C,0.2398
COC1COC1CC=O,0.2241
CC1CC2C(O)CC2=C1,0.2463
CC1C2CCC1C(=O)C2,0.2222
CC1CCC1CCC#C,0.3138
COCC1C(O)CC1=O,0.2201
CC(=O)N1CC2(C1)CO2,0.2655
CC12CC3CC(O3)C1N2,0.308
OC1COC2CC2C1O,0.3284
O=CC12CC1NC=N2,0.2088
N#CC1C2CC1C1OC21,0.303
NC(COCC#C)C#N,0.2823
c1(=O)c(nonc1F)F,0.178
CC1C2COC2C1C=O,0.2261
COCc1cc[nH]c1N,0.2299
CCC1(CC1)NC=O,0.2757
CC1CC2(CC2O)C=C1,0.2442
CC1C2C=C(C)C(C)C12,0.2405
CN1C2CC3(C)OC3C12,0.2792
CC12COC3C(C13)C2=O,0.2372
N=C1N=CC(=O)ON=N1,0.1636
COCc1cnnnn1,0.1659
C#CCN1CC1CC#N,0.2701
CCC(=O)C1(C)CN1,0.2305
CCOC(=O)C1NC1C,0.2608
C1CC2C3OC2C3O1,0.3042
CC1OC1(CO)C1CC1,0.3395
O=CNCC1COCO1,0.282
CC(C)c1c[nH]nc1N,0.2351
C#Cc1c(nc[nH]1)N,0.1874
CC12CC1(OC=N2)C=O,0.2169
OC1CCCCC=CC1,0.2561
CCC1(C)C2CC(=O)C12,0.2283
CC1(COC1)C=O,0.2245
COc1c(ocn1)N,0.2135
OCC(O)C1OC1CO,0.3089
OC1C2CC3CC3C12,0.3044
CCN1C(=O)CC1(C)C,0.2768
CNc1coc(n1)NC,0.2223
N#CC1NC2C=CCC12,0.2493
CNc1conc1C#N,0.1746
Cc1c(c(co1)N)C=O,0.157
C1C2C=CC3N=COC123,0.2322
OCC12CC3CN1C23,0.3263
CC1CC2CC3CC2C13,0.3591
CC1CCOC(=N)C1=O,0.1915
OCC1C=CCC1C#N,0.2641
C1CC12CN=COC2,0.2732
c1(nc(on1)N)C(=O)N,0.2163
CCC1(C)CCOC1C,0.3121
CC1C2C3OC2(C)C13,0.3098
CC1C2CC3C(O2)C13C,0.3111
CCC1NC1C(O)CO,0.3056
OC1CC2C3CC3CC12,0.318
Cc1ncnn1CC=O,0.2102
O=C1CNC2CC2C1=O,0.1484
CNC(=O)C1CC2OC12,0.2641
Cn1nc(c(n1)OC)N,0.2066
CC1=CC2N3CC2(C3)C1,0.2231
O1C2C1C1OC21,0.2955
OC1CC(O)C1(O)C#C,0.2566
CC1(CCC11CO1)C#C,0.3005
CCOC1CCC=C1C,0.2595
O=C1CC23CC12N=CN3,0.2115
CC1CC=CC=CC=C1,0.1793
CCN(C=O)C(=O)CO,0.2225
CCC1CCCC(O)C1,0.3372
O=C1NC2CC1C21CO1,0.2565
CC1=CCC(=O)C(=O)C1,0.1605
CC12CC1CC2,0.338
CC1C=C(C)CC1C#N,0.259
OC1(C=O)C2C3OC3C12,0.2049
CN1CCNC(=O)C=C1,0.1974
CNc1[nH]nc(n1)CO,0.25
O=CCCC1CC1C#C,0.2244
O=C1C=CC2(NC12)C#C,0.1703
OC1CC2OC11CCC21,0.291
CCC12CC1COC2C,0.3272
CCC12C3CC1(C)CC23,0.3196
CC#CCN=C(C=O)N,0.1851
c1c(nco1)C2(CC2)O,0.2337
C1C2C1C1C3C4C3C1C24,0.3348
CC1C(C2CO2)N1C=O,0.2568
CCC12C(C)C1CC2C,0.3158
c1c[nH]cc1CNC=O,0.2361
CCCC1COC1=NC,0.2787
CC(C)C#CC=O,0.2048
C1CC(O1)C1CC2NC12,0.3019
O=C1C2OC2C2CCC12,0.2042
OCCC(CC#C)C=O,0.2253
c1cc(c(c(c1)N)N)N,0.2124
Cc1n[nH]c(=O)o1,0.2484
CC1C2C3C(C2=O)C13C,0.2434
CC1OC(C=O)C2OC12,0.2211
Cc1c([nH]c(n1)O)O,0.2438
OCC12CC3C1CC23,0.336
CN1C(=N)OC=C1C#N,0.1699
CC(C)(C)n1cccc1,0.2477
CC12COC1CC(=O)O2,0.2713
CC1COCC(C)O1,0.3242
Cc1cc(noc1=O)F,0.1814
c1cocc(c1=NO)N,0.1706
NC1(C#N)C2CCOC12,0.2683
c1c(coc1C=O)C=O,0.1898
OCC1(CO)C2CCC12,0.2975
OC12CCC1(CC2)C=O,0.2102
CC1CC(=O)C2OC12C,0.212
CCCC1CCC=CC1,0.2679
COC=NC1C(O)C1O,0.2221
OCCC#CC(O)C#C,0.2683
c1cc(c(nc1)C=O)N,0.1559
C1C2COC11CC=CC21,0.2444
CCC(=N)N(C)C=O,0.2398
CCNc1ncon1,0.2211
CC1C2C3N2C(C)C13C,0.3065
C#CC12CCCC1O2,0.278
CCC1C2CC(=O)C12,0.2293
c1c[nH]c2c1[nH]c(=O)o2,0.2227
CC12C3CC1N1C3CC21,0.3141
CC1C2OC2C1N1CC1,0.3021
O=CCC1C2COCC12,0.2264
CC1C2N1C(=O)C21CN1,0.2198
CCC(OC)(C=O)C#N,0.2161
CC1NC1C1=CNN=N1,0.2409
CCC(O)C(C)(O)C#C,0.287
CC1(O)C2CC1C2C=O,0.2342
COC1(CC#N)CC1C,0.2898
c1c(c[nH]c1CC=O)N,0.1568
COCC(C)OC1CC1,0.323
C1CC1C(=O)NC=N,0.2406
O=C1C2CC11NCC1O2,0.1974
C1CN=CN(C1=O)C=O,0.2188
CC1C2OC3C2C13C#N,0.2667
CNC(=O)CNCC=O,0.2164
CCC(=O)n1ncnn1,0.2131
CC1C2CC3(O)CC2C13,0.3131
CC12CC1(CCO2)C#C,0.2724
CC1CN2C=NC(C)=C12,0.2495
COCC(N)(CO)C#N,0.2881
CC12C3C4C3C1=CCN24,0.1578
O=CC12NC3C1COC23,0.2098
O=C1C2OC3CC2C13,0.2092
CC1C2C3OC3(C)C12,0.3247
CCC1NC1C(O)C=O,0.2176
ON=C1CC(CC=O)C1,0.2228
O=C1CC2CC(O1)C=C2,0.2472
CN=COCC(C)O,0.2712
CC#CC1CC2NC12,0.2821
c1nc(nn1CCO)N,0.2293
C#CC1CC11CCCO1,0.2733
CC1OC2CC12NC=O,0.2524
CCC1(CC1C#C)C#N,0.2701
O=CCC1CCN1C=O,0.2113
NC(=O)C12CCCC1O2,0.2629
CCC1OCC2CC12O,0.3201
CC1CC2(C)OCC12,0.3148
CN(C)c1[nH]nc(n1)O,0.243
CC12OCCC1C2C=O,0.2165
c1c(n[nH]c1N)CCO,0.2453
c1c(c(co1)NC=O)N,0.2148
O=C1OC2C3COC2C13,0.2593
OC1(CN2CC12)C#N,0.261
CNC(C)(CC#N)C#C,0.2664
ON=C1CCC1C#N,0.2472
OC1C2OC1(C=O)C2O,0.2127
OCC12CN(C1)CC2=O,0.202
CC1(CO)CCC1C=O,0.2185
c1c(non1)C#N,0.2355
OCC(=O)C12CC1OC2,0.2218
CC1=CCN(C1=O)C,0.2176
CCC12CC(C1O)N2C,0.2868
CC12CN(C=O)C1C2O,0.2544
CCC(C)(OC=N)C#C,0.281
CN=COC1C2CC1C2,0.2721
NC(=O)C12CCC1CC2,0.2636
CN1N=CN=C1C1CO1,0.2483
COC1=NNC=NC1=N,0.1942
OC1(COC1=N)C=O,0.2197
CC1C2CC3OCC13O2,0.3006
CC1C(CO)C1C(C)=O,0.226
OC1C(=O)OC11COC1,0.2511
CC12C3CC1C(C#N)N23,0.2766
c1nc2c(o1)C=CC2=O,0.1318
CN1C2CC(=O)C1C=C2,0.1869
c1cc(cnc1)NC=O,0.2069
CNC(=O)C(=N)N1CC1,0.2116
C#CC1CCCC=CC1,0.2559
OCCCC1OCC1=O,0.2246
CC1(C)C2CCN2C1=O,0.2361
c1nc(on1)C(=O)CO,0.1893
O=CN1C2CC1C=C2,0.2237
CC(CO)N(C)CC#N,0.264
CCCC(C)(O)C(C)C,0.3228
CC1=C(F)OC(=N)C=N1,0.159
CC12CN3CC1C3C2=O,0.2166
COC=NCC1(C)CO1,0.2661
CC1CCC1(C)O,0.3273
C1CC23C4C5C4C12CN35,0.2572
c1c(nno1)OC(=O)N,0.2186
O=C(C#C)C1C2CCC12,0.1924
Cc1cnn(c1)CC=O,0.1996
O=CN1CCC2CC2C1,0.2706
CN1C2C3N4C2C1C34C,0.2896
c1[nH]c(c(n1)N(=O)=O)N,0.1678
C1OC2COCCC2=C1,0.2424
C1C=CC2CCCC=C12,0.2489
COC1C(O)CC1CO,0.3091
C1C2OC3C4CC3C4C12,0.3227
COCC1N=COC1C,0.2612
O=C1CC2(CC2)C2CN12,0.2404
COC1CCC2(CC2)O1,0.3236
O=CNCC1C2CC1O2,0.2563
COC1C(C)C1NC=O,0.2625
CCC1(C)CC2C(O)C12,0.3174
CC1=C(C)C2CCC1O2,0.249
CC(=O)c1[nH]c(=O)on1,0.1832
c1c(oc(n1)C2CC2)N,0.2153
C1NC1C1OC2CCC12,0.3038
CC(C=O)C#CC=O,0.1941
c1c(=O)[nH]c(=O)[nH]c1F,0.2228
CCCC(C)(O)C(C)O,0.3168
CC1CC11OCC1(C)C,0.3018
N#CC1OC11CC=CC1,0.2568
CC(=O)CCCC(=O)C,0.2277
CC(C)(C#CC(=O)N)O,0.2363
O=COC1CC2NC12,0.2628
CCC(=O)C1(CO1)C=O,0.2034
CC(=O)CC#CC#N,0.2295
CC12OC1C1(CO1)C=C2,0.2342
CC(N)C(O)(CO)C#N,0.2733
CC1(C2CN1C2)C(N)=O,0.2699
c1nc(c(c(=O)o1)N)O,0.1608
OC12C3C1C1(O)C2C31O,0.2763
COC(=O)C(C)CCO,0.2825
C#CC1(CC1)OCC=O,0.2247
Cc1conc1N,0.2388
COC1CC(O)CCO1,0.3288
CC1(CN1CC=O)C,0.2155
O=CC1CC1C(=O)C#N,0.1615
C1CC23CCC(CO2)C13,0.3051
OC(CCC=O)CC#N,0.2298
CCCCN=COCC,0.2696
CC(C1CN1)C(=O)C=O,0.1431
OC12CCC(C=C1)C2=O,0.2358
C#CCc1ncncn1,0.2134
N=C1ON=NN1CC=O,0.1977
CCCOC1(CC1)CO,0.3298
CN1CC1(C)C(N)=O,0.259
CC12CC1N=C(O2)C#C,0.2088
NC1=NC2COC1OC2,0.2558
CC1NC2(CCC12)C#N,0.2567
CC1OC=NC2COC12,0.2702
C1C2C3C4C1C1C2C3C41,0.3291
CCc1ncnc(n1)F,0.2255
O=CC1CCC2(CC2)C1,0.2287
CCN1C(C)C1(C)C,0.289
C#Cc1c(c[nH]c1N)N,0.1976
CC1OC(C)=NC1C=O,0.2105
N=C1NC(CC#N)=NO1,0.2272
CC1CC(C#C)C11CC1,0.3008
OCC1=CC2CC1C2=O,0.2394
C[NH+]1CC2C1C2C([O-])=O,0.2625
CC#CC(=O)C(=O)C,0.1526
OCCC1OC1C#N,0.2702
O=CC1CC2=CN=NN12,0.2057
CC(CC#N)C(C)(C)O,0.3178
CC1(CCO)CC1C#C,0.2867
CC1=NON=C(F)C1=N,0.1841
CC1C=CC(O)C1(C)O,0.2476
CC1CC11OCC1C#C,0.2678
CC12CC1C(O)(C2)C#C,0.2844
C1C2NC22CCCC=C12,0.2486
c1c(ncc(n1)O)C=O,0.1816
CC1=CC2C=CC1C2O,0.2224
OC12CC(CC#C)(C1)C2,0.3101
CC1CC(O)C=CCO1,0.25
O=C[C-]1C2CC([NH2+]2)C1=O,0.1476
CC1(O)CC2(NC12)C=O,0.2184
CCC(C#N)C#CC#N,0.2436
CCCC(C)(C)C=O,0.2282
CC(C)COCC=O,0.2292
CC1(C#N)C2C3C1CN23,0.2759
c1c[nH]c2c1[nH]nc2O,0.2095
COCC1CCC(C)O1,0.3275
CCc1cc(ncn1)F,0.2294
CCOC1CCC1C,0.3258
CNC(=O)C#CCOC,0.237
COCC1C2CC1CC2,0.3396
COC1C(O)C2CC12C,0.3146
CCC1NC1(C)CC#N,0.2813
CC(=NO)C#CCCO,0.2033
O=C1COC2CN(C2)C1,0.1899
CC12C3C1C1(C)OC2C31,0.3256
OC1CC2C3OC12C=C3,0.219
CCC1(O)C=CCC1O,0.264
CC1OC2=C(O1)C=CO2,0.203
Cc1c(nc(o1)O)C=O,0.1898
CCC1(NC1C)C=O,0.2226
C#Cc1c(nccn1)N,0.1656
COC1CC2C(C)C12C,0.3213
CC12N=COC1CC2O,0.2637
OCC(O)C1CC2NC12,0.2926
O=CC1CCOCOC1,0.2258
CC1(C)CC(CO)C1=O,0.2147
CC1OCC2CN2C1=O,0.2314
COCCN(C=O)C=O,0.2157
CCC1CCC(=O)NC1,0.2677
CCOC1CCC(=N)O1,0.2908
CC1CC2OC1CC2=O,0.2149
CCC1CC(=N)OC1=O,0.2607
CCC1CC(C)(O)C=C1,0.2636
CC1=CC(O)C2OC2C1,0.2596
Cc1c(con1)C#C,0.2192
N=C1OC2CCN3C2C13,0.2574
Cc1c(nn2c1CC2)C,0.2583
c1(c([nH]nnc1=O)N)N,0.1597
CC1(O)C(O)C(O)C1=O,0.2017
NC1CNC(=O)OC1=N,0.2558
CN1C2CC(C=O)=CC12,0.1717
OC12C3CC1(OC23)C=O,0.2002
CCC#CCC(O)CC,0.2928
CC1CN2CC3(CN3)C12,0.2758
C(C#N)OCC#N,0.2853
OC1C(C#C)C2CC12O,0.2789
CC12CC(C1O)C(=O)C2,0.2248
N=C1OCCC2COC12,0.2558
OC1CCC2=C1NC=C2,0.2357
CCC12COCC1(C)O2,0.3273
N=C1OC2C3C=CC2C13,0.2175
C#CC(=O)CCC=O,0.1882
COc1[nH]c(=O)ncn1,0.2151
NCC(CC#N)C#N,0.2761
C#CCN1C=NCC1=O,0.2316
CC1C2C3CC(C3)C12O,0.3247
CC12C3CC1C(O)CC23,0.3143
C1Cc2c([nH]c(=O)[nH]2)C1,0.2338
CC12COC1C(=O)CO2,0.1948
c1(c(n[nH]c(=O)n1)F)N,0.1831
N#CC12COCC1CN2,0.2624
CC1C2OC(=O)C12C#C,0.2483
c1cc([nH]c(=O)c1)C=O,0.1409
N=COC1C2CN2C1=N,0.2466
COC1(C)C=CCC1O,0.2542
N=COC1CN2CCC12,0.2407
CCNc1ccon1,0.2223
CC(C)CNC(=O)C=O,0.175
CCC(=O)n1ccnn1,0.2125
CC(C#C)C12CC1CO2,0.282
NC1C(CO)C1(N)C#N,0.264
COC1CC2C3CN3C12,0.2817
COC1CNC(=O)OC1,0.3096
CC1=CC2(O)CC1C2O,0.2349
CC1C2OC2C1NC=O,0.2743
CC(C)(C)n1cccn1,0.2622
CC([NH3+])CCCC([O-])=O,0.2771
OC1CC2(O)CC2C=C1,0.253
CC1N(CC=O)CC1=O,0.2099
Cc1cc(nc(c1)F)O,0.215
Cn1ncc(=O)c(n1)N,0.1671
CCC1=CC(OC1)C#C,0.2527
CC(C)C1CC(=N)O1,0.2886
C(C(=O)C#CC#N)O,0.1859
N=COC1=CN=CC=C1,0.2159
CC1NC11CC2COC12,0.2962
O=C1COC(C1)C#C,0.2189
CC1C(=O)C(O)C1(C)O,0.2169
C#CCC1OC2CC2O1,0.3018
N#CC1=NCC2CC2N1,0.2054
CC1NC2CC(=O)OC12,0.2567
N=COCC1=NC=NN1,0.2599
CN1CC2CCC12C=O,0.1794
CCOCC(=O)C(C)C,0.2168
OCC1OCC2COC12,0.3075
c1nnco1,0.2711
C1CC(=O)C=CC(=O)C1,0.164
CC(CO)C1=CC=NO1,0.2451
C#CC1CC2CCC1O2,0.2982
CNC(=O)CC#N,0.2807
CCC1C2NC2C1(C)O,0.3039
OC1CC(C=O)C1C=O,0.2069
NC1=NC2(CO)CC2O1,0.2704
CC1(CC#CC#N)CO1,0.2373
NC(C#N)C1CC=CC1,0.2637
CC1C2C(C)C(O)C12C,0.3183
O=CCC1CC2CN12,0.218
CC(C)CCOCC#N,0.2924
c1cnoc1C(F)(F)F,0.2468
CC(=O)C(CO)OC=O,0.2307
CC1=CC2CC(O2)C=C1,0.1753
Cc1c(=O)c(non1)F,0.1728
NC1=C(C=CO1)C1CN1,0.221
OCC1(O)COC=NC1,0.2744
CCCCC(C)C(C)O,0.3366
O=CC1(CN1)C(=O)C#N,0.1863
C1CC2C=CCC22OC12,0.2645
COCC1(CC1)N2CC2,0.3093
NC(=O)N1C2C3CC2C13,0.275
CC(C=O)(C#C)C1CN1,0.2079
CCC1CCCOC1=O,0.2668
CC1(C)C2COC(=N)N12,0.2784
C1C2OC3C2C=CC13,0.2405
COC1COC1CCO,0.3174
CC1OC2(C)CC2C1C,0.3011
C(=O)(C(=O)N)C(=O)N,0.152
O=C1ON=NC(=C1)C#N,0.1592
CCCC1CCCCO1,0.331
OCC1C2OC(=O)OC12,0.3056
CCC1C2COCCN12,0.2983
O=CC1CC(C=C1)C#C,0.2119
c1c[nH]c2c1COC=N2,0.1803
CC(C)(O)C1(CO)CN1,0.2969
O=C1CC(OCO1)C#N,0.2616
CC1=C(COC=NC1)C,0.2334
N#CC1=CC2CC1C=C2,0.192
CN(C)C(C=O)C1CO1,0.1962
CC1C2CC3NC3C12O,0.2971
c1ccn2c(c1)ncn2,0.193
CC12C3C1N1C3CC21C,0.3002
O=C1CC2CN2C1,0.2049
CC1(C)N2C3CC=C1C23,0.1729
O=CC(=O)C1CC2OC12,0.1525
CC1=C(ON=C1)C1CO1,0.2274
N=C1OC(=O)C=CC=N1,0.1723
CCC(O)COC=N,0.2824
CCC1C2CC2C=C1C,0.244
NC1=NN2C3CC3C2=N1,0.202
COC1C=C(C)NC1=O,0.2066
CC12CC(CC1O2)C=O,0.2279
OC1C(O)C1(O)C=O,0.2019
CC1(CCN1C=O)C#C,0.2646
CC(C=O)N(C)CC=O,0.195
CCC(O)C(=O)C#CC,0.2029
CC12OCC3OC1C23C,0.2847
CC1C2C3OC3(CO)C12,0.3278
CCC1C2OC1C1NC21,0.3121
C1C2CC3=NNN=C3C12,0.2359
O=C1CC=C(C1)C1CO1,0.2248
N=C1OC2CC1C2C#N,0.2686
OCC1CC=CC2OC12,0.2414
CCOCC1CCO1,0.322
C1N2CC3N=COCC123,0.2588
OC1C2C3NC2(C#N)C13,0.2503
CC1CC2CC(O)C=C12,0.2461
C1C2CC3C4OC4C2N13,0.3048
CC#Cc1c[nH]nc1,0.2229
OC12C=CCN3C1CC23,0.2231
O=C1OC2CNC1C2,0.2502
O=CC1OC(C=O)C=C1,0.1931
CC(C=O)(C=O)OC=O,0.1936
COc1ccc(o1)OC,0.225
c1c(oc(c1O)N)C=O,0.1578
CC12CCC(CC1)OC2,0.301
C1C2COC3CC=CC123,0.2391
CC12CC1(C=O)N=CO2,0.2174
CC#CC(=O)OC1CC1,0.2331
CC12CC1CC(C2)C=O,0.2287
c1c(cnc(n1)N)F,0.1845
OC1COC2=C1NC=C2,0.2161
CC1CC(C=CN1)=NO,0.1793
CC1OC(CO)C11CO1,0.3149
CCC(=O)OCC#C,0.2818
N#CC1C2CC3CN2C13,0.2702
CC1CC=CC1(C)CO,0.2591
CC1OC11C=CC2OC12,0.231
CC1OC2(CC2)C1CO,0.2896
c1c(=O)oc(cn1)F,0.1693
Cc1coc(n1)O,0.2473
O=CC12OC3CC1C2C3,0.2291
CC(C)(c1ccc[nH]1)O,0.2415
COc1c(c[nH]n1)N,0.2223
NC1(CC(O)C1)C#N,0.2858
C(C(=O)C(=O)C=O)O,0.1174
CC1(CCCC12CC2)C,0.3387
CCCC(C)C(=O)NC,0.2782
C1CCC(C1)(C2CC2)O,0.3095
C1C2C3OC4COC2C134,0.2383
C1C2C3C4C1C2N34,0.3043
CCC1C(O)C1CO,0.3051
CCC#CC#CCC,0.2247
CN1C2CCC2C1C#N,0.247
CC1C2C(OC12C)C=O,0.2079
CCC(C)C(C)CC#N,0.3458
CCc1cc(on1)C=O,0.191
CCn1ncc(n1)NC,0.2108
OC12COCC3C1CC23,0.3151
C1C=Cc2c1c(no2)N,0.187
COC12CC(C1)(C2)OC,0.3342
CC1(CCNC1=O)C#N,0.2603
COC1OC(=O)CC1O,0.2718
N#CC1C2CC3C2OC13,0.2907
C1CC2CCOC2O1,0.3194
CCC12CC1C(CO)O2,0.3063
Cn1c(cnn1)CC#C,0.2526
O=C(CC#C)CC1CO1,0.2263
CC1=NC2(CO)CC2O1,0.2568
COC1C2C3C4C3C2C14,0.3165
Cc1c(ncc(n1)F)O,0.1879
COc1cc(co1)N,0.2274
CC1C2OC2C1(C)O,0.3204
CC1N2CC2CC1=O,0.202
CC1(O)CC2CC3C2C13,0.3309
CC1=NCC(=O)N1C=N,0.2187
CC12CC(C1O)N1CC21,0.2905
CC1C=CC2NC1C2=O,0.2123
CC(OC=O)C(=O)C#N,0.1853
CCC1CC2C(C#N)C12,0.3122
CCOC1CC1C#C,0.279
OCCCC1CCC1=O,0.2197
O=CNC1CC2NC2C1,0.2823
CC1(CO1)C(=O)C(N)=O,0.1673
CC1(O)CN2C=CN=C12,0.2538
CN1CC=C(C1=O)C#N,0.1892
OC12CC1C1CC(=O)C21,0.2045
OC1C=CC2CC12C=O,0.2213
CCC(O)(C#C)C(C)=O,0.2185
CC1(O)CC1C1(C)CO1,0.3173
CN1N=NC(C)=NC1=N,0.1633
CC(C)C12C3C4C3C1C24,0.2953
C1CC23C1CC1C2OC31,0.296
COCC(C)C(C)CO,0.3285
CC1(C#N)C2CCC12,0.3128
CC1(CC2NC12)NC=O,0.265
CC12C3C4C1C2(C#N)N34,0.2323
CCC1C(O)C2NC12C,0.302
CC1CC2C(O)C2C1C,0.3131
CC1CC(C)(C)CC=C1,0.2657
c1cc2ccncn2c1,0.1673
OCC(O)CCN1CC1,0.2988
c1ccn(c1)C2CC2,0.2455
C(C1CN1)C1=NNN=C1,0.2406
c1[nH]c2c(n1)CC(=O)C2,0.1995
CC1(CC(O1)C#N)C=O,0.2173
CC1C(C#N)C11COC1,0.2793
CC12CC(COC1=N)O2,0.2674
CCC1=CCOC(C)C1,0.2596
CCNC(=O)COC,0.2806
CC(C)c1[nH]c(=O)on1,0.2543
CC1C2C1C1C=CCC21,0.2624
CC1N(C)C(=O)C11CO1,0.2584
CCC1(C#N)C(N)C1O,0.2773
CCC(C)CC(C)C#C,0.3141
OC1CC(CC2CC2)C1,0.3298
COC1CC(=O)N2CC12,0.2406
FC1=CC=NC(=N)N1,0.1687
CC1=CC2CCC3C2C13,0.2389
C1C2CC1CCOCC2,0.3156
CC1=C(N=NN1)C1CN1,0.2203
CC12CC1N=C(N)O2,0.2701
CC(C)NC(=O)CO,0.2773
CCC1(C)CC2CC1C2,0.3697
C1CC2CC3OC3C2O1,0.3141
OC12C3CC1(NC23)C#N,0.2508
c1[nH]c(=NCCO)on1,0.222
OC1CC11N2CC1(O)C2,0.2965
CC(C)C(O)CC(N)=O,0.2712
C1OC1C1=CC2NC2C1,0.2296
CC(C)C(C)(C)CCO,0.3342
COCCCC=O,0.2302
CC1NCC=CCC1=O,0.2102
C1NC11C2OC1C21CO1,0.3047
CC1CCC2(CN12)C=O,0.2186
CC1CC(C)(C=C1)C#N,0.2597
CC1=NCC(CCO)O1,0.2717
O=C1CC2C3CN2C13,0.2178
OC12C3NC3C1NC2=N,0.2525
CC1CC(=O)OC1C#N,0.2757
c1c(nco1)C(=N)N,0.2113
CC(C)C(C)CC(N)=O,0.2785
OCC1COC(C1)C#C,0.2925
COC1CCC1C(N)=O,0.27
CC1OC(OC=N)C=C1,0.2576
OCC1OC11COC1=N,0.2689
CC(=O)N1CC1C1CC1,0.2545
c1cocc(c1=O)N,0.1786
CCC1C=C(C)CC1O,0.2576
CC(C)C1(COC1)OC,0.3164
CC1CCC2=NNC=C12,0.2505
CCCC(=NO)C(C)O,0.2579
CC(=O)C(=N)NC=NC,0.1591
Cc1ncc(n1C)O,0.2385
ON=C1C2NC1C1CC21,0.256
CC1(C)CNC1C#N,0.2649
C(c1c(n[nH]n1)C=O)O,0.1933
O=C1CCC2OC1C=C2,0.195
CC1C=C2COC2C1O,0.2416
CC1(COC=N1)C1CO1,0.2681
CC(C)N1CC1(C)C#N,0.2775
CC1(OC(=O)C1N)C#N,0.2489
CC12OC1CC=CC2O,0.2661
O=CNC12CC1C1OC21,0.2506
c1nc(no1)C=O,0.1913
CC(=O)C1(C)NCC1O,0.1978
C1N2C3CCCC=C1C23,0.2224
CC1CC1(CO)C1CC1,0.3189
N#CC12CC3OCC1C23,0.2764
CC(=O)C1(CC1O)C#N,0.2191
C#CCC1(COC1)CO,0.2804
CCC1(C#N)C(C)C1C,0.3104
CCC(C)(CO)OC=O,0.2791
OC1C2CCC11CCC21,0.3143
OC12C3C4C1OCC2N34,0.2923
COCC1CC(O1)=NC,0.2748
CCc1cn[nH]c1C#C,0.2091
Cc1c(=O)oc(cn1)O,0.1621
O=CC1CN1C1CC1,0.2112
CC12NC3C1OC2C3=O,0.2002
c1c(con1)CCC#N,0.2476
C(C#CC(=O)C(=N)N)O,0.1741
N=C1CC2NC(=O)C2O1,0.2583
CN1C2CC11CC(O)C21,0.2929
CNc1c(c([nH]n1)N)O,0.2343
CCC1(CN1)C#CC=O,0.2001
COC(C)C(C)(C)C#N,0.3064
CC1C(CC1(C)O)C#C,0.302
C1C2CC3=C(OC=N3)C12,0.224
CC1=C(C)C2CCC1C2,0.2485
C#CCC#CCCCO,0.2896
COC1CC(C#C)C1=O,0.197
CCC1CC(=O)C(=N)N1,0.1761
CCOC1CNC1C=O,0.2088
CCC1NC(C=O)C1O,0.209
CC1CCC1(C=O)C#N,0.2217
Cc1cnc([nH]1)OC=O,0.2078
CC12C(O)C3(C)C1CN23,0.2917
CCC1OC(C)C11CO1,0.3272
OCC1OCCC1O,0.3023
CC(C)C1CC2C(C)C12,0.3233
c1cc[nH]c(=O)c1,0.1783
CC(O)CC1CC=CC1,0.2639
CCC1OCC(O1)=NC,0.2788
OC1C23CCC12OCC3,0.2829
CC1=CNC(=NC)C1=O,0.1503
OC1C2CN3C2C=CC13,0.2185
CC1CC11NC(=O)C1O,0.2636
CCOC(=N)C(C)=NO,0.2114
CC1(NCC11CC1)C#N,0.2666
CC12CCC1OCCC2,0.3198
C#CC(C#N)(C#N)N,0.2668
CC1C=CC(=O)C1C=O,0.1874
CN=C1CN2CC(C2)O1,0.2441
CCOC(=NCCO)C,0.266
CC1NC1C1OCC1O,0.3023
C(C(=O)CO)NC=O,0.2137
COC12CC3OC1C23,0.295
N1C2C=CC3NC2C13,0.2275
CC1C2CC1OC(=O)C2,0.2701
CCCCCCCCC,0.3824
CCC1CC(O)C=C1C,0.2551
CC1NC1COC(C)=O,0.2727
N=C1C=NOC(C=O)=C1,0.164
C1C2OCC3CC12C=C3,0.2195
c1[nH]nc(n1)C(=N)N,0.2135
OC1C2C(=O)NCC12O,0.2546
c1c(n[nH]n1)CCCO,0.2579
CC(O)C(=O)C#CC#C,0.179
N#CC1CCC2CC2C1,0.3205
CC1(O)CNC(=O)OC1,0.3061
CC(C)(C)C(=NO)CO,0.2541
CC1C2OCC1(C)CO2,0.3184
C#CCOC12CC1CC2,0.2821
CC1CC2NC2C1=NO,0.2401
CN1C(C#N)C1(C)CO,0.2601
COCC12CN(C1)C2C,0.3049
C1C=Cc2c1c([nH]n2)N,0.199
CC12CC3(CO3)C1O2,0.323
CN1CCc2c1cco2,0.1996
c1c[nH]c2c1OCCO2,0.2271
O=C1CC2NC1C21CN1,0.2104
CC12CN1CC(CO)C2,0.2946
OCC12CC(=NO)C1O2,0.2466
CC1COCOCC1C,0.3268
OC12CC1C1(NC21)C#N,0.2389
CN=C(c1ccno1)N,0.2019
CC(O)CN1C2CCC12,0.2948
CCC#Cc1nnon1,0.1975
OC1C(=O)CCC11CN1,0.2108
CN=C1OCC1C1CN1,0.2591
CC1NC1C#CC(N)=O,0.2291
OCC1=CCC(O)C1=O,0.196
C1C2C3C4COC3C4N12,0.309
OCC1CCC1N1CC1,0.3088
C#CC12CCC1NC=N2,0.2434
OC1=NC=NC(=N)N1,0.1922
C(C=O)OCC=O,0.2219
CC1CC11C2C3OC1C23,0.3085
CC1=CCOC(=O)C1,0.2642
OC1C2COC(=O)C1N2,0.2487
CC12C=CC3C=CC1N23,0.2089
CC#CCN=C(C#N)N,0.218
CC1=C(F)N=NOC1=O,0.1789
CC1(C)CC2C(C=O)N12,0.2108
CCC#CCOC1CC1,0.2842
CN=C1COC(=N)N1C,0.237
c1cnc(nc1C#N)O,0.1919
O=C1NC2C3CCN1C23,0.2633
COC1OC(=N)C2CC12,0.2834
OC12CC1C(=O)NC=C2,0.2106
C1C2CC3(CCC3)OC12,0.3088
CC1C2CN(C)C12C#N,0.2316
CCC1=C(CCN1)C=O,0.1768
N=C1NC(=O)CCC=C1,0.2049
N=COC1CC2OC12,0.2763
C(CO)C(=O)NCC#N,0.273
CN1C2CCCC12C#N,0.2709
Cc1c(nc[nH]1)CC#C,0.2424
CC1C(O)C2CCC12O,0.3001
ON=C1C2CCCC1N2,0.2473
CC#CC#CC#CC#N,0.1628
CC1(CC=CC1)C#N,0.2672
C1CC2C=CC1OC=N2,0.2331
CC(CNC=O)NC=O,0.2466
CC1C2OC1(C=O)C2=O,0.2109
OC12CC3C4OC3C1C24,0.3125
CC1(O)C2COCC12C,0.3155
CC1(CNC(N)=N1)C#N,0.2596
CC1C2(C)CC2C1(C)C,0.3225
CCC1(CN2CC12)C#N,0.2805
CN(C)C1(COC1)C=O,0.1779
Cc1cn(cn1)C(=O)N,0.209
CC1(CC(N)C#N)CO1,0.2819
c1c(c(co1)OC=O)O,0.2115
NC1C(O)C1(O)C#N,0.2698
CCCC(C)(O)C(C)=O,0.2192
CCN1CC2(O)CC12C,0.2792
CC1C2C3CC3C(=O)C12,0.2114
CC1(O)CC2CCC=C12,0.242
N=C1CC2CCC(C2)O1,0.2764
COC(C)=NC(C)C=O,0.2176
CC1C(=O)NCC=C1C,0.2539
CCCC(=O)OCC=O,0.2288
CC1C2CC=C(C)CC12,0.2627
O=CC1CC2OC2C1,0.2272
C1CC2C1C21COC1,0.3137
CC1(C)CC1(O)CO,0.289
N=C1OC(C=O)C11CC1,0.2137
CC12C(O)C3C4C(C13)N24,0.3058
C#CC1C2C3C=CC2N13,0.2096
CC1CC2=C(O1)N=NN2,0.2104
CC1OC(=O)C(O)C1O,0.2555
c1c(n(cn1)C=O)C=O,0.1792
CC(O)C(=O)C(C)=O,0.1589
ON=C(C#C)C1CN1,0.1985
CCC1(C)OC(=O)C1C,0.2795
CC1=Cn2cncc2C1,0.2029
O=CC1CC=CNC1=O,0.1884
c1cc([nH]c1)N2CC2,0.2328
N=C(OC(=O)C=O)C=O,0.1672
NC(=O)C(C#C)C1CN1,0.2465
O=CC1NCCC1C#N,0.2071
CC#CCN(C)C(=O)C,0.2672
O=C1COCC2CCC12,0.21
COCC1(CO1)C(C)O,0.3092
CC(=O)Cc1nnon1,0.1999
CN1CCC1C#N,0.2536
OC1CC1C1=NNC=C1,0.2489
CCC1CN1C(=O)CO,0.2567
CCC1N(C)C1(C)CO,0.2943
C1OC2CC3CC(C3)C12,0.3241
CC12CC1(O)C(C2)=NO,0.2425
C1C2OC3CC1CC23,0.3198
CC#CC1C2COC12C,0.2742
CCOc1ncnn1C,0.2592
c1c([nH]nn1)CC2CC2,0.2522
c1cc-2cncc2[nH]c1,0.1248
CC1OC2CC(O)C1O2,0.3036
CCC1(COC1C)OC,0.3122
[O-]C(=O)C1[NH2+]CC11CO1,0.2663
OCC12NC1COC2=N,0.2636
CC12CC(OC=O)C1O2,0.2675
CCC(COC=N)C=O,0.2267
CC1NC1(C)CC(N)=O,0.2585
N=C1OC2OC1CC2=O,0.2136
O=CC12COC1CN2,0.196
CC1CC(C)C1(C)C,0.3506
CC1C=CC2=C1NN=C2,0.2006
OCC1(CN1)C#C,0.2868
CN(C)C(=O)C(=O)OC,0.2213
N#CC12C3NC1COC23,0.248
OCC1C=CC2OC12,0.2459
CC12CC1C1C(O)CN21,0.2727
CC#CC(C)OCC#N,0.2617
NC(=N)NC(=O)C1CO1,0.2136
NC(=O)C12CC(C1)C=C2,0.2372
CCCOc1cnco1,0.2336
CC1C2CC3C1(O)C23O,0.2915
CCCCOC(C)(C)C,0.3245
OC(CCCC#N)C#N,0.3133
COc1cnc([nH]1)C#C,0.1897
CC1(C)CC1(O)C#C,0.2739
COC1C(C)C1(C)C=O,0.2264
CC1CC2(C)C1OC2=N,0.2878
Cc1ccn2c1CC=C2,0.1969
CC12OC1C1CC21C#N,0.2598
CC(O)CC1CC2NC12,0.3002
c1c(nc([nH]1)CC=O)O,0.1528
CC12CC1C(N2)C#N,0.2693
OCC1CN=COCO1,0.2574
CC1CCCC1C,0.375
CC12CC1OC(=N)C2,0.2718
C1C2CCCC3OC1C23,0.3133
OCC1OCC(=O)O1,0.2699
c1coc(n1)OCCO,0.2463
N=C1CCC(=N)OCO1,0.2723
CC(C)C(C)(C)C(=O)N,0.2749
Cc1concc1=NC,0.1716
OCC1CC2C3OC1C23,0.3051
N=C1OCC2N3CC12C3,0.2497
OC1CC11CNC1=O,0.2769
COc1nc(no1)C#C,0.2212
O=C1C2CCC=CC1O2,0.2103
Cn1c(ncn1)OC,0.2596
CC1CC=C(C)CCO1,0.248
C1NC11C2C3CCC1N23,0.3045
c1conc1COC=O,0.2521
C1CC1N2CC(=NO)C2,0.2271
N#CC1OCCC=C1,0.2658
C#CCCc1cnn[nH]1,0.2501
CC12CCC(O)CC1O2,0.3323
C#CCC1CC2CC1C2,0.3159
CC1CCC(OC=O)=N1,0.2438
CC1=CCC2CC(O)C12,0.2515
CCN(CC)C(=O)N,0.2815
CC1OCC2=C1NN=C2,0.2472
OC12CC(O)(CC1)C2=O,0.2188
CC12NC1C=CC1OC21,0.2342
CNc1c(cco1)O,0.2099
C#CC1CC2CC3C2C13,0.3048
CC1N(C)C(C#C)C1=O,0.2092
O=C1C2CCC11COC21,0.2292
CN1CC2(CC12)OC=N,0.2349
NC(=O)C(NC=O)C=O,0.2112
C#CC1=CCCCC1=O,0.1838
CCC1(C)CC1NC=O,0.2704
COCC1C2C3CC3N12,0.28
C1C2CN3N=NC=C3N12,0.24
NCC(=[NH2+])NCC([O-])=O,0.2514
COC1OC(=O)NC1=N,0.2591
COCC(=O)N,0.2738
CC(=O)COC1COC1,0.2333
CN=c1cnocc1F,0.1731
C1CC23CC(COC2)N13,0.2567
CC(C[NH3+])(C#N)C([O-])=O,0.1783
CC1=C(CC2CC12)C#N,0.2068
CC1(O)CC(O)C11CO1,0.3079
CC1(C)C2C3OC1C23,0.3106
CC1C2NC2CC1C#N,0.2915
C1COC(O1)CNC=O,0.2702
CN1C(=O)CCC12CC2,0.2587
N#CC1COCCC=C1,0.2489
NC(=O)C1OCC11CN1,0.2617
O=CCC12NC3C1OC23,0.214
C1C(CN1C(=O)CO)O,0.2681
C1C(=NCC#N)NC=N1,0.2224
COC1(C)CCCC=C1,0.2625
CCNC(C=O)C#CC,0.1947
C#CCC(=O)NCC#C,0.2703
CC(C)C(O)C#CC#N,0.2364
[NH3+]CC1(CO1)C([O-])=O,0.257
COC1OC(=O)C2NC12,0.2533
CCCC1OC1(C)C,0.3455
N#CC12CC3(CO3)C1O2,0.2654
CC(C#N)C1COC1,0.2886
CC1OC1C#N,0.2951
N#CC1CC2N=COC12,0.2644
CC1=CCCC1C#C,0.2596
OC1C2COC1C2=O,0.197
CN=C1OC2C1C2(C)O,0.2621
CC12NC(=O)C3CC1C23,0.2573
c1c(cn(n1)C2CC2)O,0.2286
O=C1CC2(CN2)C(=O)N1,0.2345
CC1=C(CO)C2CC2C1,0.2407
Cc1c(cc(o1)N)OC,0.2112
CC1OC(=N)C1OC=N,0.2651
CCC12CC(C1)C(=O)N2,0.2593
C1CC12C=CCOC=N2,0.2349
OC1C=CCCC11CC1,0.2604
OC(CC#C)C(=O)C#C,0.1801
CC1=CC(=N)ON=C1O,0.164
N=C1OCC2N=COC12,0.2631
c1c(cnc(=O)[nH]1)CO,0.1757
C1C2CC3OCC2C13,0.3292
OCC1CCC2CC12,0.3399
OC1COC(=O)C1=O,0.1696
O=CN1C=CC2CC12,0.2034
Cc1c2c(co1)OCO2,0.2336
c1cnc([nH]1)C2CCC2,0.2436
O=C1OC2C(CC12)C#N,0.2788
OC1C(C=O)C11CCO1,0.214
CCC1OC(=N)CC=C1,0.2603
NC1=NCC2OC2C1=O,0.1719
CN1C=C(OC=N)C=N1,0.238
O=C1OC2C3CCC1C23,0.2725
O=CC(CC#C)C1CN1,0.2151
CC1=CC2CCC2C1,0.2571
CC1CC2(CC12O)C=O,0.2167
CC1COCC(C)C1O,0.296
CC12CCC=CCC1O2,0.2666
O=C1C2C3CC1(C#N)N23,0.2315
CCNC(=O)C(O)C=O,0.2062
CC(C)C#CC(C)CO,0.2996
CC(=NO)C1CCCO1,0.2546
O=C1CCC(CC#C)C1,0.2229
OCC1CC2NC(=O)C12,0.2695
CC1=CC2(O)COC2C1,0.2508
OC1C2CCN(C=O)C12,0.2536
c1cc(nc(c1F)F)O,0.2021
CC1C2C(C)C(=O)CN12,0.2007
OC1C2CCC1COC2,0.3181
COCCCOCCO,0.3365
OC1CC2(CC12)C=O,0.226
CC1=CC(CO)CC1=O,0.1977
OCC1C2C3OC1C23O,0.2892
CCN=COCCO,0.2729
CCn1cnc(n1)OC,0.2385
N=C1OCC11C2CN1C2,0.2486
NC1=NCC(O)C1=O,0.1816
OC1C2CC11NC(=O)C21,0.2498
Cc1c(cc(o1)C#N)N,0.1759
CC12CC(CC1(C)O)O2,0.303
CCC12NC1C=CC2=O,0.1741
COCC1CC1N1CC1,0.3181
CC1(CO1)C(=O)NC=N,0.2213
CC12C3C1C1C3C(O)C21,0.3011
NC1=NC=CN=CC1=N,0.144
CC12C3CC(OC1=O)C23,0.2682
OC1C2COCC12C#N,0.2834
CC(O)CC(CO)C=O,0.2223
CC1(OC(=N)C1O)C=O,0.2193
OCC12CN3CCC1C23,0.2862
OC1COC(C1)C#C,0.2857
O=C1CC2(CC3CC23)C1,0.22
CC(CO)N(C=N)C=O,0.2296
CC(=O)C1CCC(C)=C1,0.2108
C1NC1C1CCCCO1,0.3245
CC12C3CN1CC2C3O,0.2764
CC1C(O)C(O)C11CN1,0.2842
CC1(COC1=N)OC=N,0.2664
CC1N2CC2(C#N)C1=O,0.2187
CCC1C2OC2C1C,0.3322
C1C2C3COC=NC2C13,0.256
C1CC2(C1)C1CCCC21,0.3299
C1OC2C1CC1COC21,0.2855
CCC1CC1(C=O)C=O,0.2085
OCC1CCOCC1O,0.3254
CC1NC1C(N)CC#N,0.2912
NC(=O)CC1(CO1)C=O,0.2259
C1CC(=O)NCCOC1,0.2663
NC(CC(O)C#N)C#N,0.2885
CNc1nc(co1)O,0.2264
CC1CC(=O)CCC1O,0.225
CC1CCOCOC=N1,0.2578
CC1=CC(=O)CC1(C)O,0.1924
CCc1cc[nH]c(=O)n1,0.1866
CC1CC=CC1(C)O,0.2656
CCC(C#N)N1CCC1,0.2679
O=C1C2CCC(N2)C1=O,0.134
CC1CCC2CCCC12,0.3698
COC1CC1(C)C(C)O,0.303
COCC1CC(O)C1=O,0.2222
CCOC1OCC=C1,0.2618
C#CC1C=CCC11CO1,0.2611
CC1=Cn2c(ccn2)C1,0.2
CCC(=O)NCC1CO1,0.2781
N=C1CC23CC2(CN3)O1,0.2366
OC1(CC#N)C2COC12,0.2839
C1CN(C(=N1)C#N)C=O,0.1961
Cc1coc(n1)CC=O,0.2039
C#CCC1OCCO1,0.3054
CC1OCOC(C)C=C1,0.2605
C#CC1C=CC2OCC12,0.2461
CC(=NO)COCCO,0.243
N=C1CC(=O)NC(=O)O1,0.238
CN1N=C(F)C=CC1=N,0.1466
CC12CC1CC(=O)C=C2,0.1852
CC12CC(CO)C1O2,0.3237
C#Cc1cn[nH]c1C=O,0.1717
CC(=O)C1(C)CC2NC12,0.2217
[NH3+]CC1COC1C([O-])=O,0.1181
CC12OC3CC1OC2C3,0.3237
CC1(OCCO1)C1CO1,0.3286
Cc1c(c(=O)cn[nH]1)N,0.1696
O=CC1C2NC2C1C#C,0.2076
CC1C(O)C1CC1CC1,0.3153
CC1C=CN2C1CC2=O,0.2157
COC(C)C1NC1C=O,0.2261
CC12CC=C3C4C(C14)C23,0.1619
CCC1N2CC2CC1=O,0.2023
CC(=O)c1coc(=O)o1,0.1917
CCC1(NC1C)C#C,0.2751
CC12CC1C(O)C2C#N,0.2933
CC#CCc1c[nH]nc1,0.2565
CCC(C)(C#C)C(C)O,0.3038
c1c2c(n[nH]1)CC=C2,0.206
CC12CC3OC1(C)C3O2,0.3157
COC1=NCC2(CC2)N1,0.2701
OC1C=CCC1CC#N,0.2628
CC1COCC=CC1=O,0.1866
C(C=O)NC(=O)NC=N,0.2197
CC(=NO)CC#CC=O,0.1982
CCC12CC3C1C(=O)C23,0.2462
C1CC2OCC=CC2O1,0.2513
CC12CCC3CCC1C23,0.3319
CC1C2OC3CC3(C)C12,0.3057
CC(C)C1COC1(C)C,0.3141
Cc1c(c(c([nH]1)C)N)N,0.212
CC(O)(CO)CC(N)=O,0.2709
O=C1CC23CN4C2CC134,0.1781
Cc1c(occ1NC)C,0.2207
CC1C2OC2(C)C2CN12,0.314
CC1CC=CCC(C)=C1,0.2545
CC1=CNC2CC2C1=O,0.1799
C#CC12CC(C1)(C2)C#C,0.2846
CN1CC1C(C=O)C=O,0.1818
CC12CCC1C2C#N,0.3092
N#CC1NC2CNC12,0.2536
COC1CC1C1CC1O,0.3194
CC1(O)C2NC2C1O,0.3067
c1c(c(no1)N)NC=O,0.2186
[NH3+]CC1(CC1O)C([O-])=O,0.2773
CN=C1C=NNC(C)=C1,0.1661
C1C2NC22CC1CC=C2,0.2348
CC12COC1C1CC1O2,0.3019
CC1NC(C)C1=NO,0.232
CC12CC1(C)C1OC1C2,0.3394
OC1C2C3CC1(O)CC23,0.3168
CCC(C#C)C1COC1,0.2932
OCCN1N=NOC1=N,0.2079
CNc1coc(n1)C=O,0.1454
O=CC1OCC11CCO1,0.2131
CC(C#CCO)N1CC1,0.2712
CC1OC1(CO)CCO,0.332
c1c(c(c[nH]c1=O)O)F,0.1704
CC1CN2C1CCC2=O,0.2574
N=C1NCC(=O)C2OC12,0.1927
CCOC1CCOC1C,0.3228
Cc1c(ocn1)C(=N)N,0.2009
CCc1c(nco1)N,0.2089
CC1CC(O)C1C1CO1,0.3232
C1CN2C=NC3C(O1)C23,0.2289
O=CC1OC(=O)C11CC1,0.2204
CC12OC1C(C)(O)C2=O,0.2007
CC1(OCCCO1)CO,0.3316
CC1(C)C2CCC1O2,0.3282
OCC12COC1C(=O)N2,0.2441
N=C1CC=CCN1C=O,0.2265
CC(C)(O)C12CCC1N2,0.3252
CC1(C)CCCC2CC12,0.3383
CC12OC3C4C1N4C23,0.3077
CC12COCOCC1N2,0.3192
C#CC1CC2(CN12)C#C,0.2426
CC1OC2CC1C2,0.3323
CC(O)C1=C(C)NC=N1,0.2429
CN1C2C3C2C2(CN2)C13,0.283
CCCC(O)(CO)C#C,0.2871
CCC(=O)c1cocn1,0.2038
CC1(CNC=O)CC1O,0.2805
CCCCC(=O)C,0.2344
N#CCC1CC(N1)C#N,0.2657
OC1CCCC2(CO2)C1,0.3314
CC12CN(C1)C2CC=O,0.2078
C#CC1C2OC2C1C#C,0.2753
CC(C=O)(C#C)N1CC1,0.2245
N#CC12C3C4C(CC14)N23,0.2644
CC1(O)C=CCOC1=N,0.2585
CC1OCC(=C1)C1CN1,0.2359
CC12CC1OC1(CC1)C2,0.3086
Cc1cc(cc(n1)O)F,0.2209
OC1CC=CC1CC#C,0.2613
CC1=CC2(CO2)C(O)C1,0.2467
C1CC2=C3C1OC3CC2,0.2041
CC(O)CCC(O)C#N,0.2902
COCCC(C)(O)C#N,0.281
CC1C(O)C1OC=O,0.2513
NC(=O)OC1OCC=C1,0.2571
CC#CC#CC(C)C#N,0.2229
CCC12OC3CC1NC23,0.3071
COCC1CN1C(C)C,0.2913
CC1CC11CC2NC12C,0.2978
C#CCN=C(CO)N,0.2576
C1OC2CCOCC1O2,0.3194
C#CC(NC1CC1)C#N,0.2422
CCC12OCC1OC2=O,0.2498
CC12CC3(C#N)C1NC23,0.2632
CCN=C1COC(C)O1,0.2756
O=CNC1CCCOC1,0.2725
OC1CCC11CC2CN12,0.2982
CC(=O)C(=NC)N(C)C,0.1893
CC1OCC(C)(O1)C#N,0.2977
CCC12CCC1O2,0.3285
CC1=NOC(OC=N)=C1,0.2245
CCCC(=NCC)OC,0.267
CC1C2C3OC3C1C2O,0.3221
CCC12C(O)C1NC2=O,0.2494
CC(=Nc1n[nH]nn1)N,0.2077
COC(C#C)C(=O)C#C,0.1837
COC1=NOC(=N)O1,0.2666
CC#CC(O)C1CC1O,0.2613
O=C1CN2CC1(C2)C#N,0.2069
CC1CCOC(CO)=N1,0.2736
CCC1C2CC2C1C,0.3352
C1C2C1C1=CC=NN21,0.2348
O=C1NCCC2OCC12,0.2636
CC1(C)C2OC(=N)C12O,0.2548
CN1C2C3C(=O)C1C23O,0.2132
COC12COC1C2C#C,0.2763
OC12CC1(NC2=N)C#N,0.231
C#CC(=O)C#CC#N,0.1756
O=C1NCCN2CC1C2,0.2308
C1Cn2c1c(nc2N)O,0.2183
C1CCOC(=O)OC1,0.298
OCC1(O)CCC1C#C,0.2966
CN1C(C=O)C11COC1,0.1976
COC(=O)N1CC1,0.2898
N=C1OC2CC11OCC21,0.2639
OCC1CN1CC=O,0.2182
CCCC1CCC1CO,0.3381
CC1(CO)CCC1=O,0.2157
CC1(CO1)C(C#C)C#C,0.2908
CC1CC2(CO2)C11CN1,0.3038
OC12C3OC4CC(C13)C24,0.2917
O=C1C=C(C#C)C2CN12,0.1763
CCC1CC(=O)CC1C,0.222
CCCC(=NO)CC,0.2541
C#CC(C#C)(C#C)C#C,0.2911
O=C1CC2CC1C1OC21,0.2221
CC1N(C)C1(C)CC=O,0.2034
CC1(COC1)CNC=O,0.2748
CC12CN1CC2(N)C#N,0.2629
CN1CC2OC3C2C13C,0.2792
Cc1c(c(n[nH]1)C=O)N,0.1717
CC(CC#C)C(O)C#N,0.2776
COC(=O)C(C)N(C)C,0.2229
CC1OCC(O1)C(N)=O,0.2665
OCC12CC3C1OC23,0.2972
OCC1CC1(C#C)C#N,0.2721
CC1C=CC23CC12CC3,0.2319
CC1COC2(CC2)CO1,0.3278
OCC1(O)C2OC1C2=O,0.2451
CC1(C)OC2CC2C1O,0.3081
OCCC12OC1CC2=O,0.2162
CC(=O)c1cnc[nH]1,0.197
CC1(C2CC2)C2CC1O2,0.3206
C1CC2OCCOC2=N1,0.2656
CC1CC1(O)CCO,0.3179
N#CC1CCO1,0.2783
COCCC(C)O,0.3199
CC(O)C1=CCOCC1,0.2574
C#Cc1c(cccn1)O,0.1844
CC(CO)C12CC(C1)C2,0.342
CCC1CC=CCC1O,0.2662
C1NC1C1=CCCOC1,0.2465
CC1C2C1(O)CC2(C)C,0.3171
c1(noc(=O)o1)O,0.2842
CN1CC1C1=NCCO1,0.2407
CC(=O)C#CCC1CC1,0.2083
CC12CN(C1)C2C(N)=O,0.2677
C1CC1C#CC1CN1,0.263
CC1CC(=O)C1N1CC1,0.1921
c1c[nH]c(=O)cc1CO,0.1825
OCC1=C2CC3C(C1)C23,0.1727
Cc1cc(oc1C)N,0.2198
CC(C)C1=COC(=N)O1,0.2385
OC1(CC=CC1)C1CO1,0.2661
CC([NH3+])C1OC1C([O-])=O,0.2607
CC12CC3N1C1C2C31O,0.2867
CCC(=NO)C(=NO)C,0.1955
OCC1=NOC(=N)O1,0.246
CCc1cc([nH]c1)C#C,0.1997
CC12CC3C1C2NC3=O,0.2569
O=C1NCC(CC#N)N1,0.2787
OC(CC#N)C1CC1,0.3176
CC(=O)CN(C)CC#N,0.2163
CC1COC(C1)C1CO1,0.3281
NC1=C(C=NO1)C1CN1,0.2261
N=C1N=NN(C=O)N=N1,0.1586
C#Cc1c[nH]c(=O)cn1,0.1583
CC(=N)OC(=O)C=O,0.1793
OCC1C2CCCOC12,0.2968
COC1=CN=CNC1=N,0.1798
CCN=CN(C=N)C=O,0.225
CC1CC(C#N)C1=O,0.2206
CC12CCC1OC(=O)C2,0.279
CCC12NC1CC2C#N,0.2742
CN=c1c(=O)[nH]nno1,0.2022
C#CC12CC3C4C(C14)N23,0.2504
Cn1cc(cc1CO)O,0.2249
CC12CC3(O)C4C1N4C23,0.293
CC(O)(C=O)C1CN1,0.2063
CC1=CCC=CCCC1,0.2458
CC12CC1C(C)(C)C=C2,0.2476
C1CC12CC(=O)C2,0.2208
CC#CC1(O)CC1C=O,0.217
CC1OC11C2OC2C1O,0.3064
CC1(CCOCC1)C#N,0.296
O=CC1CN1C=O,0.203
CCC(OC)C(C)(C)C,0.3199
CC1=NC2(CC2)C(=O)O1,0.2392
CC1(O)C2OCC=CC12,0.2399
C#CCC(C#C)C1CO1,0.2975
CN1C2C3OC2(CO)C13,0.2663
N=C1OC(=O)CC2CC12,0.2547
CC1CC(CCC#C)C1,0.3152
CC1C2OC2C1(C)C=O,0.2227
CNC1=CNC(=N)O1,0.2221
C1COCC=C1CCO,0.2586
OC1CC2COC1C=C2,0.2468
COC1C2CC1C21CC1,0.3422
CC1C(O)CC=CC1O,0.2586
OC1CC2COC1C2O,0.2966
CC(C)C1COC1C,0.3134
C#CC12CN3CC(O1)C23,0.2317
CC1(O)C(O)C1(O)C#N,0.2564
OC1CN2CC3OC1C23,0.2639
NC(=O)C12NC1CC2O,0.2511
CC1(C#C)C2N1CC2=O,0.2102
OC12C=CC3(O)CC1C23,0.2405
CC1(CCC(=C1)C=O)C,0.1937
N=C1C=CN=NNC1=O,0.1616
CCC1N2C3CC1(O)C23,0.2983
CC(C=O)C1C2CC1O2,0.2152
CNc1c(c(n[nH]1)N)O,0.239
CC12OC1C=C1COC21,0.2285
NC1=C(F)C=CC(=N)O1,0.1526
CC1(CCCC1=NO)C,0.2516
CC12CC(C1)CC(=N)O2,0.2752
CN=C1N=CON=C1F,0.1996
CCC1CCC1(C)CO,0.3349
CCCc1c(nco1)O,0.216
c1c(nncn1)F,0.168
COC(C)C1(CN1)C#N,0.2919
CC1C=CC(=O)N1C=N,0.1949
C#CC12CC1OCC=C2,0.234
CC#CCC(CO)C#C,0.2854
CC12CC(C)(O1)C2(C)O,0.2959
COC1CC1NC(N)=O,0.2903
N=C1CN=C2C3CC3N12,0.2215
OC1=NC(F)=CC(=N)N1,0.1931
C1CC(=CC(=O)C1)N,0.1969
CC1OC2=NCCC12C,0.2617
OC12C3[NH2+]C1[C-](C=O)C23,0.1454
CC1COC1CCCO,0.3206
C1C=C(NC(=O)O1)CO,0.2212
CC1(CC(N)=O)CN1,0.2683
OC1CCNC=C1C=O,0.1856
CN(C=O)C(=N)CCO,0.2311
O=C1NC2CC11OCC21,0.2395
c1c(ncn1CCO)N,0.2198
O=C1NCC2OCCC12,0.2721
OCCC1C2CC2C1O,0.3187
CC1CCC1CN1CC1,0.3136
CNC(=O)CC#CC#C,0.2169
O=CCC1CCCCO1,0.2228
Cc1ccnc(n1)F,0.2159
Cc1ncc(nn1)OC,0.1674
OC1CC2CC3C1C23O,0.3152
Cc1ccccc1C=O,0.1878
c1c(c(c[nH]1)N)C=O,0.1725
CCCc1cnn(n1)C,0.2479
OC1CCC2CCCC12,0.3297
CCCC1OCC1CO,0.3101
CN1C2CC=CC2C1=O,0.2412
CC(CC=O)CC#C,0.2268
O=C1C2CC2NC1C#C,0.1996
C1CC1COCC(=O)N,0.2691
CC12C3OCC1C(O)C23,0.3024
CCC1NC(=O)C1O,0.2705
CC(CCO)C1CC1C,0.3417
CC#CCC1CCC1,0.3009
C1CC2C3OC4C1C2C34,0.3061
CC(=O)N(C=N)C(=O)C,0.233
CC1CC2C3C4C3C1C24,0.3261
OC1C2C3C4N=C1N2C34,0.1881
CNc1cnc([nH]1)O,0.2419
NCC(N)(CC#N)C#N,0.2785
CC1C(=N)OC1(C)C#N,0.28
CC1(CO)CO1,0.3421
OC1C=CNC(=O)C1O,0.2097
CNC(=O)CCC(=O)N,0.2737
Cc1nc(=O)cno1,0.1831
O=C1NC2CCOCC12,0.2741
CC1CC2C(C3CN3)N12,0.3017
O=CC1OC11CCC1=O,0.1895
OCCC1CO1,0.343
c1coc(c1C(=O)N)N,0.199
C#CC1CC2(CN2)CO1,0.284
CC1=CCC2CC(=O)C12,0.2048
C1C2C=CC3OC12C=C3,0.2124
CC(=O)CCCOC=O,0.2354
OC12CCCC3C1CC23,0.3281
CC1(C)C2CCC1OC2,0.31
C1C(CO1)(C=O)C(=O)N,0.206
C1C2C3C4N5CC4(C35)N12,0.2972
N#CC1=NCCN1,0.1989
OC1CC1N=CNC=O,0.1991
N=COC1=NC=CN1,0.223
N#CC1CN2CC1C2,0.2762
CN=CNc1cnco1,0.2321
C#CC1OC11CCC=C1,0.2404
CN=C1CC(=O)C(C)O1,0.2066
CN1CC(C1)C(=O)CO,0.1898
OC1(C#C)C2C3CC2C13,0.288
CC1C2C3OC3C12C#C,0.243
COC1C(O)C1CC=O,0.2247
c1cc(=O)onc1CO,0.1817
c1c[nH]nc1CC=O,0.2197
CCC(C#CC)C(C)=O,0.2216
CC1(C)C2C3CC(C3)N12,0.3057
CCC1(O)C(O)C1C#C,0.2758
OC12CC3(NC1C23)C=O,0.1885
OC1COC(=O)CC1O,0.2711
O=CC1NC1(C#N)C#N,0.2102
CC(OC=O)C1CCO1,0.2598
NC(=O)C1(CCN1)C=O,0.1952
C#CC1CC(C1)C#C,0.2884
CC1CC11C2CC2C1O,0.3126
CC#CCC1OC1CO,0.3
CC(O)C1=NN(C)C=C1,0.2513
CC12CC1C1(OC21)C#C,0.2385
COC1CC11CCC1C,0.3106
CC12CC1CN1CC21C,0.2953
N#CC1CC23CC(O2)C13,0.2765
OC1C(CC#C)OC1=N,0.2723
C1C2COC3COC2C13,0.3184
CCCC1CC1OC=O,0.2768
C1C2CC1C1=CC=CN21,0.2346
CC1CC(C)C11CCC1,0.3425
CC(C(O)C#N)C1CO1,0.3026
C1OC1C12NC1C1NC21,0.2614
CNc1ccnoc1=O,0.1614
CC12CC(C1)C2C=O,0.218
N=COC12CC1COC2,0.2796
CC12CC3C1C2CC3O,0.3263
CC1CC2CC(C)(O)C12,0.3167
C#CC1C2CC2C2NC12,0.2942
CC1OCOC2CC1C2,0.3284
C#CC1(CC(=O)N1)C#C,0.2567
CNc1c(nn[nH]1)N,0.2198
CC12OC1C1OCC21O,0.2941
COC(CCO)CCO,0.3162
FC1=C(F)C(=O)N=NO1,0.1687
O=C1CC2CCC2O1,0.2797
CCc1cccnc1O,0.2115
Cc1ccoc1,0.2434
OC1CC2CC1CO2,0.3132
CC#CC1=NOC(=N)O1,0.1949
CCC1CC1C(=O)CO,0.2386
CN1C2C=CC(C)(C)C12,0.2289
C1CC2(C1)COCCO2,0.3198
CC12OCC1CC2=O,0.2015
COC1C2OC1C1OC21,0.3081
NC(=O)C1(O)C2COC12,0.2479
CCC1(CC#N)CC1C,0.3146
CC(CO)CC1CC1C,0.3393
OC1C2CC2C1OC=O,0.2767
CN1CC1C(O)C(N)=O,0.2463
O=C1OC2CC1OCC2,0.2467
CCC12CC1NC2=O,0.2526
CC1=CCC(C1)C#C,0.2599
CC1CN1C1=NNC=N1,0.2268
OC1CCC(C#C)C1O,0.2902
C1CC2CCCOC2O1,0.3231
C1C(=CC(=O)C=CN1)N,0.1818
CN1CC2CC2(C)C1=O,0.2666
N=COC(CC=O)C#N,0.2222
OCC1(CN1)C(=O)C#N,0.1841
CC(O)COCCC#C,0.3108
CNc1coc(=O)cn1,0.1302
CC12CC3CC(O1)C3O2,0.3362
OC1(CCC=C1)C#N,0.2545
CC(O)C1=NCC2CN12,0.2491
c1c([nH]c(=O)o1)OC=O,0.2033
CCCC(C)C(C)C,0.378
CNCC(=O)OC=N,0.2089
CC12CC3CC3C1CO2,0.3214
CC1=CC(N)=NC(=[NH2+])[N-]1,0.2084
CCC12CC(O1)C1CC21,0.338
OC1CC2(CO2)C1C#C,0.2905
c1c(nco1)C#CC#N,0.1915
CCCN1C(C)C1C#N,0.2614
CCn1cc(nc1)N,0.2206
CC12CC1C(CO)CC2,0.3342
COCC1OC1C,0.3396
CCC1OC1CC(C)O,0.3238
CC12CC(CC1C#N)O2,0.2928
CC(C)Cc1cnoc1,0.2445
C#CC(CCCO)C#C,0.2952
CC(C#N)C(O)CCO,0.3079
CCCC1COC(C)C1,0.3198
COC(C#C)C(C)(C)C,0.3002
C1C(=O)OC1(CO)CO,0.2798
C[NH2+]C1CC(C1)C([O-])=O,0.1248
CCC(C)C(CO)C=O,0.2275
CC#Cc1c([nH]nn1)N,0.2155
N=C1COC(CO1)C#N,0.269
COC1C2C=CC1C2O,0.2406
OC12CC3(O)CC1C23,0.3146
CCC(C)CC1CC1,0.3571
N=C1OC2CC(C2)O1,0.2919
CC1(O)CCOC2CC12,0.3045
CC1(C)NC(=O)C1C#C,0.2684
c1c(c(n[nH]1)N)CC=O,0.176
c1cc([nH]c1CC=O)N,0.163
CC1=C2CCC2(O)CC1,0.2402
CCC(CO)C#C,0.316
CC1C(O)C(=O)N1C,0.2694
CC1(C)CC2CC12C=O,0.2183
c1c(=O)cc([nH]c1N)F,0.2111
CC12CC1C1CC(=O)C21,0.2053
OC12C3CC(C13)C2C#C,0.2817
CCCN1N=NOC1=N,0.2043
C1OC2C3NC3CC2=C1,0.246
Cc1cc([nH]c1C#N)O,0.1997
Cc1c([nH]c(n1)CO)O,0.2238
CC1C2C3OC3C1C2=O,0.2415
c1cc(c(=O)[nH]c1)C#N,0.1613
c1cnc(nc1N)O,0.2153
OC1CC2COCOC12,0.3258
OC12CC(C1)C2OC=N,0.2776
O=C1NCC1CCC#N,0.279
CC1CC2OC2CC1=O,0.2279
N#CC12CCC1CO2,0.269
O=C1OCC2CCC12,0.2707
CC1C2C3N2CC3=C1C,0.1667
N=C1ON=C2CCN12,0.224
CCn1c(c(nn1)C)O,0.2395
CC(CNC(C)=O)C=O,0.2196
Cc1c(ccc(=O)[nH]1)F,0.1658
CC1OC11C=CNC1=O,0.1934
OC1C2NC1C2NC=O,0.2757
CC1(N)C2CN2C1C#N,0.2596
N#CC12CN(C1)CCN2,0.2411
OC1C2C1C(=O)C2C#N,0.2267
OC12CN3C(C13)C21CN1,0.2738
CC1C2C(=O)COC12C,0.2184
COC1(CC=CC1)C#N,0.2686
Cc1c(c(n[nH]1)O)NC,0.243
O=CC12CC1C1CCN21,0.2017
C1CC1C12CC1OCO2,0.3066
CN1C2C3(C)OC2(C)C13,0.2961
OC1CC(CC#N)C1O,0.2975
CC12CN(C1)C2C=O,0.2021
c1[nH]c2c(n1)nc(o2)N,0.2178
Cc1ccc([nH]1)CO,0.2274
CN=C1OC2C3OC3C12,0.2716
Cc1cc(ncc1F)N,0.1915
C#CC(=O)n1cncn1,0.2018
CN(C)c1ccncn1,0.2017
OCC(O)C1CN1,0.2953
CCCC(N)(CC)C#N,0.2909
OC12CC3C(C1)C23,0.3122
O=CC12CC1CN=CO2,0.2297
CNc1cncnn1,0.1673
CC1(NC1C=O)C#N,0.214
CCC1CCCOCC1,0.3257
CC1OC1(C)CC1CO1,0.3383
O=C1CCOC2CNC12,0.2039
OC1C2CC3N2C1C3=O,0.2124
CC12CC3OC1C3C=C2,0.2394
CC(=O)C1NC1C(N)=O,0.2192
Cc1conc1N2CC2,0.2379
OC12C3C4C5C4N(C13)C25,0.2923
O=C1COC1CC#C,0.2172
NC1=NC(CCO1)C#N,0.2701
CCN1CCCC1C#N,0.259
CCCC1CC1CC,0.3535
CC1CC1OC1CCC1,0.3174
N#CC1=NC2C3CN1C23,0.1856
CCC1CC(CO1)=NO,0.2504
CC(C)C(=O)CCC=O,0.2269
O=C1CC2C=CCCC12,0.2188
CC(O)C1=NCCCO1,0.2711
CCC12CC3OC1C3O2,0.3093
CN1C2C=C(C)C(O)C12,0.222
O=C1NC23CN4C2C1C34,0.2353
CCC1C2C3OC2(C)C13,0.3067
NC1CCC(=O)NC1=O,0.2241
CC1C2C(O)CCN12,0.2828
CC1(CO)CCCCO1,0.3263
CC12CC(C1O)C2=O,0.2405
Cc1c(c([nH]n1)N)O,0.2359
CC1(CCCCC1)C=O,0.2224
CC1C(C)C1C(O)C#C,0.2925
O=C1C=CCC1C1CC1,0.1874
CN1N=C(OC1=N)C=O,0.1463
CC1OCOC(=O)C1C,0.2703
CC12C3CCC=C1CN23,0.2136
CCOC1CC1CC=O,0.2252
C#CC1CCOCC1,0.3061
CC12CC(C1)C(=N)OC2,0.287
NC1=C(F)N=CNC1=N,0.1665
O=CC12COC(O1)C=C2,0.2135
CC1OC2(CO)C(O)C12,0.2968
CCCc1ccn[nH]1,0.2572
CC1OC11CC2OC12C,0.3278
CC1(NC1C(N)=O)C#N,0.249
C1CC23CCN=C2OC13,0.2662
C1OC11C2CC3OC2C13,0.322
CC1CC2C3CC2(C3)C1,0.3469
CC(C=O)N(C=O)C=O,0.2009
O=C1NCCC2COC12,0.2492
CCC12CC(CO1)C=C2,0.247
CCCC(CC)C=O,0.2265
C1CC11C2C=CC1C=C2,0.2127
N#CC1OCCN2CC12,0.2483
CCC12C3OC1CC23O,0.2857
c1nnnn1C2COC2,0.2612
Cc1c(c(c(o1)N)O)O,0.2203
COC1(C)CCC=C1C,0.2614
CCCCC#CC1CN1,0.2671
OC1C2OC1C=CC=C2,0.1707
CC1CC1(C)C(O)C#C,0.291
OC1CCC2C1OC2=O,0.2792
OC12C3OC1CC23C#N,0.2704
CC1C2OCC3NC3C12,0.2967
CCC1(CC(O)C1)C=O,0.2256
CC1NC1C(=O)CC#C,0.2139
COC1C(CO)C1OC,0.2872
COC12CC1C1(CN1)C2,0.3186
CC1CC2(CN2)C1C#N,0.2899
C(C=O)C(=O)NCC#N,0.2246
N#CC12CCC1N1CC21,0.2551
COC1CC2C1NC2=O,0.2693
N#CC1C=CC=CC=C1,0.1837
CC(O)C(=O)CN(C)C,0.2029
OC1CC(C#C)C2CC12,0.3038
CC1C2C3N1C2(C)C3=O,0.2344
N=C1CC2C3C2C(=O)N13,0.2322
c1coc2n1nc(n2)O,0.2234
C1C2C3C4NC4C2N13,0.2822
CC12CN3CC3CC1O2,0.308
OCC(=N[O-])C1C[NH2+]C1,0.1384
OC1CC2(NC12)C1CC1,0.3027
CC(C)C(=O)C(O)CO,0.2222
CC1C2(C)COC12C,0.309
CC1C2C1C1C(C)C21,0.2797
CC1C2CC1C2(C)O,0.3293
NC1CC=CC1(N)C#N,0.2395
OC1CC(=O)CC1C#C,0.2198
c1c(=O)c(c([nH]n1)N)N,0.1696
COC1C2COC1C2=O,0.1952
CC12CC1CC21CC1O,0.3085
O=C1C=CC2CC1C2,0.1866
COC1COCC(=N)O1,0.278
CC12OC1(C#C)C1CC21,0.2584
CC1(C#C)C2CC1O2,0.2846
NC(=O)C1CCC=C1,0.2477
[NH3+]C1CC1(C#C)C([O-])=O,0.1611
N#CC1CC2(OC12)C#N,0.2735
CC12CC(C1)C1CN21,0.3214
COCCCOC=O,0.2733
CC(=O)c1cccnc1,0.1871
CC1(C)OCC1C=O,0.2181
c1coc2c1COC2=O,0.2107
CC1(CC1)N=COC=O,0.2249
CC1C(C#CC#C)N1C,0.2003
NC1=NC2CC(O1)C2=O,0.1903
CC12C3C4CC1N2CC34,0.3101
NC(CN1CCC1)C#N,0.263
COC1CC=CC1CO,0.2651
CCNc1c(con1)C,0.2295
CC12CCC1(C)C(O)C2,0.3194
CN1CC2(CN2)C1C=O,0.2011
CC(C)C1CCOC1=N,0.2858
C#CCC1CCCOC1,0.2976
CC1OC2CC12OC=N,0.2559
N#CC1C2C3C=CC2C13,0.2266
CC1CC2=NNN=C2C1,0.2428
OCC12CC(O1)C1CC21,0.337
OC1CC=CC=CC=C1,0.179
CC(=O)CC(C)(O)C#N,0.2318
N=CN1CC2(CC2)C1=O,0.2281
CC(=O)C12CC3OC1C23,0.2231
OC12C=CCC1C1CC21,0.2553
CCN1N=C(N)OC1=N,0.2286
OC1CNC1(C=O)C#C,0.1897
CCC12OC1C(O)C2C,0.32
CC1=C(F)OC=CC1=N,0.197
CCC(C)CC(=O)C#N,0.2097
c1c(c(=O)onn1)N,0.1774
CCC1(CCC1C)C#C,0.302
CC12C(O)C1C(O)C2O,0.3259
C1C2COCOCCN12,0.307
C(C(=N)NC=O)OC=O,0.2283
CC1CCC(C)C1(C)O,0.3191
OC1CC2OC1CC=C2,0.2515
CCOc1cccn1C,0.2396
CCC(C)C#CC(C)C,0.3
COC1CC11OCC1O,0.273
CC1NC11CN(C)C1=O,0.2679
CC(O)C1CC(=O)C1O,0.2042
COC1CC2(CO)NC12,0.2988
CC1(CC(O)C#C)CN1,0.2932
COC12C3C4C3C1C24,0.2996
OC1C2CCC1CCC2,0.3111
O=CC#CC1C2CCN12,0.18
CC1(C)CN2CC(O)C12,0.2632
NC12C(NC1=O)C2C#C,0.225
O=CC1=CCC2OC2C1,0.1983
O=C1C2CC1C=CCC2,0.2086
[NH3+]CC1=C([O-])C(O)=NO1,0.1451
C1CC(C1)C1CC=CC1,0.2655
Cc1c[nH]c(=O)c(n1)C,0.1686
C#CC1(CC#N)CCN1,0.2651
C#CC1COC2CC12,0.2848
c1c(c(co1)N)C#N,0.1931
c1cn2c(cnc2[nH]1)O,0.213
C1CC1CNC(=N)C#N,0.211
CC1OC2C=CCC12O,0.2494
CC1CCC2OC1C2=O,0.2258
CC1C2C3C1OCC23C,0.3264
CC#CC1(CO)CCO1,0.2716
CCC#Cc1ncon1,0.2166
CC12CC3=CC(=O)N1C23,0.1496
CC1C2C1N1C2CC1=O,0.2322
OC1C(C=CC1=O)C#N,0.1902
CN=c1[nH]cnc(=O)o1,0.2011
CC1CC2(CO2)C1C,0.3284
CCC1C(C)C1(C)C=O,0.2268
CCOCC1(CC1)C=O,0.2269
O=C1OCC2CC=CN12,0.2299
N#CC12CC(COC1)O2,0.2577
C1C2C3CC=CC2C13,0.2488
OC1C2CC3OC2OC13,0.3145
CCN1C(=N)COC1=N,0.2417
CCOCC(C)(C)C,0.3286
CCC12OCC1C2O,0.2938
CCc1c[nH]c(n1)C#C,0.2
OC(CC#C)C#CC#C,0.2229
C#CC1NC11CCCC1,0.2753
C1C2N1CC1=NNC=C21,0.2326
CCC1(O)CCC(O)C1,0.3228
CC1N2CCC(=O)C12C,0.2105
CCOC1CCC(=O)C1,0.2203
OC1(CN2CC1C2)C#N,0.2531
CC(C)C(O)C(=O)CO,0.2342
CC1=NC(F)=NC(=N)N1,0.1861
COC(C)C1=CC=CN1,0.241
OC1C2C3CC3C2C1=O,0.1977
NC(C#N)C1=NCCN1,0.2397
N=C1NC(=O)C=CC=C1,0.1579
c1cc(oc1C#N)C#N,0.1836
O=CC1CCN1C1CC1,0.1847
C1CC23CCC(O2)C3O1,0.3251
OC1(CC2CC2C1)C=O,0.2285
Cc1c(nn[nH]1)C(=N)N,0.2223
CN1C(=O)CCNC1=O,0.2482
O=C1CN=C2NC3C2C13,0.1971
CC1(O)C2OC(CO)C12,0.2954
Cc1cncc(c1F)F,0.2332
CC12CC3(O)CC1(C)C23,0.3105
CC(O)C1=CN=CN1C,0.2427
CC1C2C=CCCC12C,0.2459
CCC#CC1(CC1)OC,0.2743
C#CC1CC11CN2CC12,0.2686
O1C2C1C13OC4C1C2C34,0.2879
CC1=CCOCOC1=O,0.2259
CN=C1C=COC(N)=C1,0.1793
CCC(COC)NC=O,0.2822
Cc1[nH]c(c(n1)C#N)N,0.2145
COC1COC(C)(C)C1,0.3232
CN=C1N=NNN=C1N,0.1685
COC1CC(CC#C)C1,0.2996
CC1=C(C)C(=O)C2CC12,0.192
CC1=CC2OC2(CO)C1,0.2414
CN=C1CC2CC2O1,0.2661
c1c2n(cn1)CCC2,0.25
NC(=O)N1C2CC1C2,0.2746
O=C1CC2C(C#C)C12,0.2277
COC1C2C3CC2C13O,0.3335
CN(CC#C)C(=O)C#C,0.2233
OC1CC2(CC12O)C#C,0.2552
CC1OC(=N)C1C=O,0.2242
OC1CC(=O)CCC1=O,0.2075
CC1(C(=O)OCCN1)C,0.2513
OC1C2CCC1C21CN1,0.3001
CC(=O)NC1CCCC1,0.2783
CC1(C)C(OC1=O)C#C,0.2736
CCC12CC1(CN2)C#N,0.2606
CC1(O)C2CC(O2)C1=O,0.2051
NC1(CNC1C#C)C#N,0.2601
CC#CCC(C)CC=O,0.2237
CC1C2C=CCC12CO,0.2463
OC1CNC(=N)C1=O,0.182
CN1CC1(C)C(=O)C#C,0.1739
CN1C2C=CC1C1CC21,0.2149
CCC12CCC1OC2=N,0.2871
O=C1C2OCC2C2CN12,0.2161
CC12CN1CC(C=O)=C2,0.1697
CC1C2CC1C(CO)=C2,0.2383
CC1(C)CCC(=N)O1,0.2848
CC1OCC2C3CC2C13,0.3302
OC1C2CC1OCCC2,0.3072
CC1NC1(CO)C#N,0.2848
CC12C3C1N1C3C(=O)C21,0.2101
OC12CC1C1(CC21)C#N,0.2509
CC(O)C(C)C(C)=NO,0.2526
CC12C3OC1C1(CC1)C23,0.3043
CNC1(CNC1=O)C#C,0.2482
CCC1(CO1)C(F)(F)F,0.3578
Cc1ccc(nc1F)N,0.1988
Cc1c([nH]c(n1)O)C#N,0.2066
CC1CC=CC2CCC12,0.2647
OC1CC2=C(C1)N=NN2,0.2396
C1CCC2OC(C1)C=C2,0.2485
CN1N=NC(=N1)C1CN1,0.2173
CC1C=CC(C#C)C1C,0.2615
CC(=O)C(C(=O)C)NC,0.1872
OC12CCOC1CC2=O,0.2053
CCNC(=O)CCOC,0.2762
CC(C#N)(C#N)N,0.2785
CC1CC2=C(N1)N=NN2,0.2007
CN=C1C(=CCO1)C#N,0.1854
CC12N3CC1(C3)OC2=O,0.2153
Cc1cc(=O)c(co1)F,0.2009
CCOC(C#N)C1CN1,0.2657
CCC#CCNC=O,0.2721
CC(O)(C#C)C1(C)CO1,0.2865
OC1CC2C(C=O)N2C1,0.185
C(CCO)CCO,0.34
CCOC(=N)C1CO1,0.28
CC12C3OCC1C(=O)C23,0.2374
C1C2C3C2C2C1C1C3N21,0.3007
C1C=CC(=O)NC=C1,0.1857
c1c(nnnn1)C#N,0.1529
c12c(non1)onn2,0.1791
CC1C2(C)CCC12O,0.3147
CCn1cc(cn1)CO,0.2506
CC12CN(C1)C2(C)C=O,0.2045
CN1C(=N)ON=C1CO,0.2146
OC1C=CC2CC2C1=O,0.1996
OC1=NC(=N)OC(=O)O1,0.2404
CCN=C1CCN1C=O,0.2255
CN1CC2C(O)C2C1=O,0.2577
c1c(oc(=O)c(=O)o1)O,0.1585
CCCN1CC1C#N,0.2689
CC1COC2C1C2(C)C,0.3188
c1c[nH]c2c1CCOC2,0.2403
CCC1(COC1C)C#N,0.2876
CC1COC1C#CC#C,0.2167
C1C23COC12C1NC1C3,0.2724
C#CC12CC(COC1)O2,0.2582
CC1CC2=COC(=N)N12,0.2144
c1cc(=O)onnc1=O,0.1546
C1OC2CCC3OC3C12,0.323
c1cc([nH]c1)NC2CC2,0.2302
CC(=O)C1COCC=C1,0.2149
N=C1NN=C(C=C1)C#N,0.1513
CC1OCOCC1=O,0.2048
CC1OC2C(C)N(C)C12,0.2939
Cc1c(cnc(n1)O)O,0.1876
Cc1ccn2c1NCC2,0.23
CC(C)(C)N1CC1CO,0.2598
c1c(cnc(n1)F)C#N,0.2126
CC1N2CCC12C1CO1,0.2944
CC1C2C3C1NC23C#N,0.2442
C1CN2C(=C1)C=CC2=O,0.1516
COC1(CC1)C=O,0.221
OCC1C2C3OC1C23,0.2932
ON=C1CN2CCCC12,0.2229
CC12C3CCC1C(=O)C23,0.234
Cc1nc([nH]n1)NC,0.2529
C1C=C(CO1)C#CC#N,0.1757
C(c1nc(=O)[nH]nn1)O,0.1659
COC1CC(CO1)C#C,0.3105
O=C1CC2(CC#C)CN12,0.2379
CCC(O)C1C2CC1O2,0.3008
N=CN1CC1(C=O)C#C,0.2102
CC(=O)OCC=O,0.229
CC1C(C)=CC2OC12C,0.2406
CC1OC1C1OC1CO,0.3326
CCC1(CC)NC1C=O,0.2169
c1nc(c(=O)on1)O,0.1843
CC12CC3OC3C1CO2,0.3228
CCN1C(CC1=O)C=O,0.2076
CCCC(=O)NC,0.2794
OC1COC2=NCCC12,0.2727
CC1CC(O)C1C,0.3251
N=C1COCC(=O)N1,0.2397
OCC12C3OC4C(C14)C23,0.2924
CC(C=O)N=C(N)C=O,0.1739
CN=C1NC(=O)OCO1,0.2565
CC12COC(C1)OC2,0.3223
COC12C[NH2+]C1[C-]2C=O,0.1744
CCC1(C)CNC(=O)O1,0.3145
NC(=O)C(O)(CO)C#N,0.2685
CC1=NC=NNC1=N,0.1611
O=C1CC23COC2C1N3,0.2216
CC1C2C3OC2C13O,0.2901
CC1N2C3CC1(O)C23,0.2985
C#CCN=CNC=O,0.233
CC1=C(O)OC(=N)N=C1,0.166
NC12CN3C1C2OC3=N,0.2596
O=C1CC=C2C3NC3C12,0.213
CCCN(C)C(=O)CO,0.2686
CC#CCCC#CC=O,0.1969
CC(C)NC(C=O)C=O,0.1831
C1CCOC2(C1)CCC2,0.3181
N#CC12COC3CC1C23,0.2826
CNC(C#N)C(O)C=O,0.208
OC(CCCC#N)C=O,0.2361
CCC12CCC=CC1N2,0.2279
[NH3+][C-]1C=CC(=O)OC1=N,0.1629
C1CC2CC3OC3C2=C1,0.2417
C1CNC(=O)C=C1C#N,0.1797
C#CC1OC2CC12C#C,0.248
CC1=CCCCC=CC1,0.245
CC(C)C(O)C(C)C#C,0.305
O=CC1NC(C=O)C=C1,0.1913
C#Cc1cc([nH]n1)C=O,0.1753
OC1CC2OC(=N)C12O,0.2639
CCC#CCCOCC,0.3036
CCC1=CCC2OC12C,0.2425
CC1CC1C(O)CC=O,0.222
CC1C2CC2C1CCO,0.3297
C1C=C(CO1)C#CC=O,0.1638
CC1=C(CO)C2NC2C1,0.2374
N#CC12CNCC1N2,0.272
OC(COC=O)C#N,0.2813
C1C2OCC3OC2C13,0.297
CC(C)(CCOC)OC,0.3204
CC1OC(C#N)C11CN1,0.2664
Cc1coc(=O)n1C,0.2373
Cc1c(c(c([nH]1)O)O)N,0.2123
COc1c[nH]nn1,0.2234
OC12CC1C1OCC=C21,0.2264
CC12CCC(C1)CCC2,0.358
c1c(n[nH]c1C#N)C=O,0.196
CCn1c(c(cn1)C)N,0.238
CC12CCC(C#C)C1O2,0.3027
CNC(=O)COCCO,0.2413
OCC12NC1CCC=C2,0.244
C1Cn2c1c(c(n2)O)N,0.2101
CC1CN1C(=O)N(C)C,0.2773
OC(C=O)C12CC1OC2,0.1948
CC1CN2C1=CC=C2O,0.2357
Cc1cnc(nc1)O,0.2068
N=C1OC(C=O)=CN=C1,0.1445
OCC1OC1C(=O)C#C,0.1965
N#CC1CN2CC=CC12,0.2351
CN1CC1CCC#C,0.2807
OC1CC2COC1OC2,0.3149
CC1(CCCC1O)C#N,0.3193
OC1C2C(O)CC12C=O,0.2201
CC1(COCC1=NO)C,0.2522
N#CC12CC(CCC1)O2,0.2699
N=COCCC#N,0.285
CC#CC12CCCC1N2,0.2782
C#CC12C3OC1C=CC23,0.2176
NC1=C(O)ON=CC1=N,0.1451
CC(=O)c1nc(no1)N,0.1721
CC(C#N)C1(CC1)C#C,0.2833
OC1C2CC1(O)C(=N)O2,0.2787
CN1C2C3CC1C23CO,0.2915
C1CC2C1N1C=NC=C21,0.2499
CC1OC11C2OC1C=C2,0.2387
CC12OC1C=CCC2O,0.2385
C1CN(C1=O)C(=O)C=O,0.1693
CN=C1OC=C(F)C=C1,0.1558
COCc1c(con1)N,0.2091
C1C(=O)CO1,0.2295
N#CC1C2CC1N2,0.2773
CC1OC=NCC(=N)O1,0.2636
O=C1CC2COCC2O1,0.2761
CC#CC1CC2(CC2)O1,0.258
FC1=NC(=O)NC(=N)N1,0.2303
N#CC1CNC(C1)C#N,0.2725
CC(CCC=O)CC=O,0.2227
CC1=C[C-](C#N)C(=[NH2+])N1,0.2081
OC1CCC2CC1C2=O,0.2229
CC1OC1(CC#N)C#N,0.3
CCCNC(=NC)C#N,0.203
CCCC(=O)NCCO,0.2773
CC1(CO1)C1CNC1=O,0.2791
N=C1CC2C3NC3C2O1,0.2762
CC(O)C12CC1COC2,0.3162
C1C(CO1)C(=O)C(=N)N,0.1849
C1CC(C1)(C#N)C(=O)N,0.2668
CC1C=C(C=O)C2CC12,0.1906
C(C#N)N(C=N)C(=O)N,0.2479
CN1C=CC(=O)C12CC2,0.1788
COCCC1CCO1,0.3291
CC(CCC#N)OC=O,0.283
CCc1ccc[nH]1,0.2422
OC1CNC11COC1,0.2938
C1CC2(C1)C(=O)C=CN2,0.1855
CC1NC11CCC11CO1,0.2978
CC(C)(O)CC1(C)CO1,0.3198
N=C1OC(CC=C1)C#C,0.2157
OC(CC#C)C1CC1,0.3056
CC12NC3C1NC23C#C,0.2439
CC1=NCCN1C(=O)C,0.2271
CC(=NO)C1CN=CO1,0.2443
c1cn[nH]c1C#N,0.2236
C#CC(C#C)(C#N)C#N,0.2875
c1[nH]nc(n1)C2COC2,0.2401
N=C1OCC2(CCC2)O1,0.3057
CC(C)C12COCC1N2,0.3234
O=C1CNC2CCOC12,0.2011
ON=C1C2CC2C1C#N,0.2419
CCC1CCOC1C=O,0.2106
CC1=C2CNC2C(=O)C1,0.2031
c1cc(c(c(c1)O)F)O,0.2276
CCCC1C(C)OC1=O,0.2794
COC1(COC1)C(C)O,0.3112
C(CNCC#N)C=O,0.2259
CC12CC1(C)C(C2)C#N,0.2939
CC1(CCO1)C,0.3205
c1cc(n2c1CC2)O,0.2367
N#CC12NC3C1CNC23,0.2448
CN1C2CC(C)(C=O)C12,0.2122
CC1CCC2C1N2C=O,0.2557
CCC1=CN(C)C(=N)O1,0.215
C1COC(OC1)CC#N,0.3135
C#CC#CC(=O)C#C,0.1673
CNc1c(cn[nH]1)N,0.2332
c1c2c(c([nH]1)N)[nH]nn2,0.1775
N=C1NN=C(N=C1)C#N,0.1522
c1c(non1)CCCO,0.2358
c1cc(c(=O)oc1)CO,0.1792
NC(C#C)C#N,0.2768
OCC12NC(C1O)C2=O,0.2341
CC12C3C4CC1C4N23,0.3053
c1c2cnoc2on1,0.2284
Cc1cc(c[nH]1)C(=O)C,0.1961
OC1CCC=CC=CC1,0.2047
OC1CN2CC1(C2)C#C,0.2632
Cc1cc([nH]n1)NC,0.2399
C1C2CC1C=CC=CC2,0.1895
ON=C1C2OC2C11CN1,0.2292
COC1=NC2C(C)C2N1,0.2602
NC12CC1(O)CC2C#N,0.2593
CC1C=CCOC1=O,0.2639
CC12OCC1C1CC21,0.3159
CC1C2N1CC=CC2=O,0.1811
O=C1C2CC2CC2CN12,0.2406
CC12CC=CC1C=CC2,0.2527
OC1CC=CCC11CO1,0.2677
CC1N=C(NC1=N)C#N,0.1884
O=CC1C2N1CC2=O,0.2027
COC12CC3C(C13)C2C,0.3132
CC1=NC(=N)OC(O)=C1,0.1783
CC1(CN1)C=O,0.2249
CC(=O)N1CC1(C)CO,0.2555
CNc1ccc(=O)[nH]c1,0.1538
CCOC(=N)C1(O)CC1,0.2642
Cc1c(cc[nH]1)CCO,0.2398
OCC1C2OC(C#N)C12,0.2576
OCC12CC1COCC2,0.3146
CC1CCC23CC(O2)C13,0.309
OC12COCC1C1OC21,0.3029
CC1OC(CO)C=C1,0.244
CC(O)CCC(C)(C)C,0.332
NC12CC3OC1C23C#N,0.2515
N#CCC1=CC2CN2C1,0.2217
C1C2C=CC3OCC3C12,0.2389
O=C1CCN2C3CC1C23,0.2185
CC(C=O)C1=CON=C1,0.215
CCC1=NON=CC1=N,0.1881
O=C1C2OC1C2CC#N,0.2447
CC1CC(C)(O)C(=O)O1,0.2643
C1OC2CCCOCC12,0.3179
C1CC(=O)OC=NC1,0.2382
CC1(CNC(=O)C1)C#C,0.2718
C(C#CC1CC1)C1CO1,0.281
COCC#CCC#C,0.2804
Cc1nc(=O)nco1,0.2127
CCC#CCCCCO,0.3009
CNC(=O)N(C)C1CC1,0.2788
CC1C(CO)CC1C=O,0.222
CC(=O)OCC(=O)NC,0.2686
CC(NCCC#C)C#N,0.2737
CC(C)(C)CC(N)C#N,0.2835
CC(=O)N1C=NC2CC12,0.2141
C1CC1OC(=O)NC=N,0.253
C(=O)C(F)(F)F,0.2243
CC1C(CC1=O)C1CO1,0.2239
CC1(CCOCCO1)C,0.3147
CC1CC11CCC1O,0.3271
C1CC12CC(C2)N3CC3,0.3105
N=C1C=NC=COC1=O,0.1658
CCN=c1ncnno1,0.1425
C1CC2CCOC(C2)O1,0.3145
CC1CC2CC1C1CC21,0.3443
N=C1OC=NC(=N)C=C1,0.1938
COC1(CC1)C(=O)C#C,0.1913
CC#Cc1cnc[nH]1,0.2055
OC1COC11CC1C#N,0.2747
c1cc(n(c1)C2CC2)N,0.2267
CC(C#CCO)C1CO1,0.2819
CC(CO)C(O)CC=O,0.2234
C1C2NC2C2=C1ON=C2,0.23
O=C1CC2CCN12,0.2374
O=C1C=CNCC2OC12,0.1838
CCC1(CN1)C(C)OC,0.3149
c1c-2cnc[nH]c2cn1,0.1327
CC(O)C1(C)CC1C#C,0.288
OCC1CC1CC#N,0.309
C(C(=O)N)NC(=O)C=O,0.1775
CC1C2OC1C1CCC21,0.3262
CCC1CC=C(C)C1O,0.2597
CCC1(COC1=O)CC,0.2793
COC1C2NC2C1OC,0.2902
OC1C2N3CC2(C#C)C13,0.2815
O=CC1OC2(CC12)C#C,0.2048
CCC1CN2N=NC=C12,0.2596
CC1COC1CC1CO1,0.3231
C1COCC(=NO)C=C1,0.1963
O=C1CC2C3C4C1C2N34,0.2096
CC1(C#N)C2C3CC3C12,0.2548
Cc1cccc(c1)N,0.2074
CN1C2COC(CO)C12,0.3043
C1C(O1)(C#N)C#N,0.2836
CC12CC(C1)OC(=O)N2,0.302
OC12CC1C1C3CC1C23,0.3055
CCc1ccn(c1N)C,0.2366
OCC12COC1CN2,0.2837
C#CCC1(CN1)C1CO1,0.2853
C1CC1C1C2CCC12,0.3369
Cc1nnn(n1)C(C)C,0.2576
CC1CC(O)C1C=O,0.2224
C#CC1COCC2CC12,0.2972
O=C1CN2CCC2C=C1,0.1557
OC1CC(CC=O)C1O,0.2277
CC(=N)OC1=NNC=C1,0.2453
CC(O)C1C2NC2C1O,0.3045
CCC1(COC1)C=O,0.2241
O=C1CC23CC(C2)OC13,0.2083
CC(=NCCO)OC=O,0.2359
CN1C2C1C1(C)NC21C,0.2635
CC1C2C3C4C(N23)C14C,0.2924
O=C1CCCC2CC2N1,0.2655
OCC1CC2CCC1C2,0.3386
CC1CC1(C)C(N)=O,0.2761
COC1CCOCCO1,0.3321
CCCC(C)O,0.3352
OC1C2CC=CC12C#N,0.2324
OCC12C3C(CN13)C2O,0.2943
CC1CC(C)C1CO,0.3341
COC1CCC(=O)C1=O,0.1354
Cc1cnc(nc1O)C,0.2248
CC(C)([NH3+])CCC([O-])=O,0.2706
CC1C2C3C(C#C)C2N13,0.2747
CCC(O)C1CC1CC,0.33
CC(=N)OC1CC2OC12,0.2829
CC1OC1C1OCC1=O,0.2225
C1CC2C3C4N3C2C4=C1,0.2021
CC(C)C1CCOCO1,0.3423
CC1C=C(C)CC1(C)C,0.2564
C1C(CN1)(C(=O)C#N)O,0.1593
CC(C)C1C2C3CC2N13,0.3107
CC1(CO)CC2(CO2)C1,0.3211
CC1CC11OC2CCC12,0.2968
OC1(C#N)C2CCC12,0.2886
CC1CC2NC12C#N,0.2614
C#CCC12NC1C1OC21,0.2605
C1C2COC11CCCC21,0.3075
CC1CN(CC#C)C1=O,0.2715
CC1=CC2CC(C1)C2O,0.2446
CC1C2CCCC12,0.3377
C1OC2C3OCCC1C23,0.2885
CN=C(C(=O)CC#C)N,0.1889
NC1=C(ON=N1)C1CN1,0.1863
c1c(nn(n1)C=O)N,0.1839
CC1OC(C=O)C=C1,0.203
CC(C)C(O)C#CC=O,0.2044
C(CO)c1c([nH]nn1)N,0.2265
CC1(O)C2OC(=N)OC12,0.2983
CC1OC(C1C)C(N)=O,0.2657
C1CC1c2nc(no2)N,0.2265
CCC#CC(=O)C#CC,0.187
CC1=CCOC1CC#C,0.2453
N=C1OCC(O1)C1CC1,0.3085
CCC1OC(=O)C1C#C,0.2673
CC(C)N=COCC#N,0.2647
CN=C1C=NOC(C)=C1,0.1712
CCC1N=CN(C)C1=O,0.229
CC(C#N)C1CO1,0.3127
C(C(C#N)(C#N)C#N)N,0.2542
N=C1NC(=O)C=NC=N1,0.1626
C(=O)(C(=N)N)C(=O)N,0.1542
COc1cc(co1)CO,0.2294
C1C2OC2C2=CN=NN12,0.2428
CC#CCOC=NC,0.267
O=CCOC(=O)C1CO1,0.2298
CCCN(C)C(=O)C=O,0.1763
C#Cc1ncncn1,0.1986
COCCNC(=O)OC,0.3118
FC1=COC(=N)N=C1,0.1548
CCN=COCC,0.2747
Cc1cc2c([nH]1)COC2,0.2321
CCC12CC(O)C1N2C,0.2949
CC1N2CC3OC3C12C,0.2857
CC1OC1C#CC1CC1,0.2621
C1OC23CCC(CC2)C13,0.3037
CN1CC11C2NC2C1O,0.2887
CCC1C2NC2C=C1C,0.2432
CCc1coc(=NC)[nH]1,0.2175
CC(=O)C(=O)CC#N,0.1592
c1(nc2[nH]nnn2n1)N,0.1967
Cc1cccc(c1C)O,0.2169
CCCCOC(=N)OC,0.3171
Cc1c2c(nco2)n[nH]1,0.2127
O=C1CC2(CN2)C1C#C,0.2061
CC1C2OC3C=CC1C23,0.2318
CN(C=O)c1cnoc1,0.213
CC1=C(COCC1)C=O,0.1894
OC12CC3C4C1CN4C23,0.2915
CCCN1CC1C1CN1,0.2983
CC1(CO)C2CCCN12,0.3007
CC1(O)CC11OC2CC12,0.2947
CC(=O)C(C)(C)C=O,0.1944
NC1=C(F)C(=N)NN=N1,0.1541
CC1(C)OC1(C=O)C#C,0.2105
COC(C)C1CCCC1,0.328
CCC1(CN1)C(=O)OC,0.259
CC(C)C(O)C1NC1C,0.3111
O=C1NC2C3CC3C2N1,0.2992
O=C1CCC2(OC12)C#C,0.2059
CCC1N2C(=O)CC12C,0.2342
CN1CC2OC(=O)C12,0.2314
O=CCC1CC(N1)C#N,0.2065
OC(COC=N)C=O,0.2277
C1CC1C(=O)NCCO,0.2766
C1CC12C=CC3(O2)CC3,0.2117
C(C(=O)N)NC=O,0.2592
CCCC(N)C(N)C#N,0.2591
[NH2+]=C1O[C-](C=C1)C#N,0.1844
OC1COC1COC=N,0.2793
CCOc1ccno1,0.2367
CNC(C(N)=[NH2+])C([O-])=O,0.2245
OC1CC2(OC12)C1CN1,0.3089
c1c(nc(=O)[nH]n1)CO,0.177
CC1C2C3C2C2(C)C3C12,0.3052
CC12OC3C1OCC23O,0.302
c1cocc(c1=O)O,0.1959
CN1CC11C2CN2C1=O,0.2221
OCC1CC(O)C2CC12,0.3271
CC1C2CN3C2C13CO,0.3207
CC12OCC(NC1)CO2,0.2883
CC1(CC2NC2C1)C=O,0.2293
CC1OC(=O)OC1=N,0.2803
CC1(O)CCC1OC=O,0.28
CN(C=N)C(=O)COC,0.236
C1CC(C1)C2CCC2,0.3589
N#CCC1C2CC=CC12,0.248
N#CC12CC(C1)N2,0.2691
OC1C(OC=O)C1C#C,0.2686
CC1(NC1C#C)C1CN1,0.2689
C(COCC(=O)C=O)O,0.1418
N#CC12CC3CC(C1)C23,0.3043
c1cc(c(c(c1)F)N)O,0.212
C1C=C2CN=C3OC1C23,0.2102
OC(C=O)C1NCC1=O,0.2029
CC1CC2CC(C2)C1O,0.3193
CCN=c1oc(no1)C,0.2354
CN1C2COCC1C2=O,0.2292
CC1C2C3C(N13)C2=O,0.2276
C1C23CC=CC12N=CO3,0.2393
CC1=NOC(=N)C=C1,0.1658
N=C1OC2CCC=CC12,0.2587
CCC1(CC)C(C)C1C,0.3253
OC1CC(=O)C1C1CO1,0.215
CCC12OC(=O)C1C2C,0.2742
C1C2(C13COC3)COC2,0.2988
CC1CC(C)=C(C)C1C,0.2526
CC1(COC(=N1)CO)C,0.2763
CC1(C)CC2(O)CCC12,0.322
CCCC1=NCC(=O)O1,0.2495
OCC12CCC1C(=N)O2,0.2814
COC1(CC1)COC=O,0.2811
CCN1C2CC2C1C#N,0.2415
CC(C#N)C1(CN1)C#C,0.2698
C1CC1(CC(=O)C#N)O,0.1877
OC1C2NC=NC2C1=O,0.184
OC1CC23CC(CO2)C13,0.2977
c1c2c(n[nH]c2[nH]n1)N,0.2153
CC1C=CC(=N)OC1=O,0.2195
CC1CCC(N)=CC1=O,0.1978
Cc1c(n(c(=O)[nH]1)C)C,0.2274
CC1C2C3N1C(=N)C23O,0.2577
c1c(oc(n1)CO)N,0.2128
C#CCCOCC#C,0.2889
CCCC(CC)OC=O,0.2858
CC1CC2C1OCC2C,0.3144
CCCOC1COC1,0.3184
C(=O)Oc1nc(no1)O,0.2241
COC1(C)CC(O)C1C,0.3157
OC1(CC2CC2C1)C#N,0.3041
c1c([nH]cnc1=O)CN,0.2016
CC12OC1CCC21CO1,0.3316
CCC1OCC1=O,0.2249
CC1=CC=NC(=N)N=C1,0.1687
CC1C2CC2CC1C#C,0.3069
CC1CCCC(O)C1O,0.3217
CNC1C(OC1=N)C=O,0.1933
CC(C=O)C1(CO1)C#C,0.2203
Cc1conc1C2CC2,0.2443
CC1C=C2CC3(C)C1C23,0.1771
CC12CC(OCC1)C2O,0.3201
CC12C(O)C3C(N13)C2=O,0.234
O=CC12COC1C1CN21,0.2021
CC1=NC2CCC2O1,0.2638
OC1COC1(C=O)C#N,0.1947
COC1COC1C(N)=O,0.2618
CCC1CC(C#N)C1=O,0.2187
Cc1ccc(n1C)C=O,0.1761
c1c(non1)C#CC#N,0.1961
OC1CCNCC1=O,0.2074
O=C1CCC23CC12OC3,0.2166
C1OC2CC3OC3C1O2,0.3427
c1c[nH]nc1C2CCC2,0.2626
CC1CCCC(=N)O1,0.2774
COC1CC2CC12O,0.3303
O=CNCC1OC1C=O,0.2147
CC(=O)C(CO)(CO)O,0.2153
N#CCC12C3C4C1N4C23,0.2546
CC1(C)COC(=N)OC1,0.2852
CNC1=C(N)NC(=N)O1,0.2264
CC12C3OC3C1CC2=O,0.2119
CC1CN1C(=N)C#N,0.2075
CC1CC(C)C2OCC12,0.3185
Cc1cc(=O)nc([nH]1)F,0.2122
O=CC1=CC2CN2C1,0.1709
c1c(oc(=O)[nH]1)OC=O,0.2068
c1nc(=O)nc2n1CC2,0.2019
CCC(OC=N)C=O,0.2149
C1CN(C1)C(=O)C2CC2,0.2605
Cc1ccc(cn1)C=O,0.1831
CC1=CC=CCCCC1,0.2023
OC12CC(C1)C(=O)CC2,0.2279
O=CC1C2CC2C2CC12,0.2248
C1OCC23NC2C=CC13,0.2375
C(CO)N(C=O)C(=O)N,0.2374
CC1(CO1)C1CC(=N)O1,0.2845
CN(C)c1cnoc1,0.2015
CCNc1cc(co1)N,0.2179
OC1C2OCC1(O)C=C2,0.2447
CC1=CCCC2(C)CC12,0.2433
N#CC12CC(C1)C21CN1,0.2707
CC1C=CCC1C#N,0.2647
OCCC12CC(O1)C2O,0.3252
c1c(c(c([nH]1)O)CO)O,0.2213
C1OC2CN=C3NC1C23,0.2265
CCCC(=O)CC(=O)N,0.2156
COc1c[nH]nc1C#C,0.2098
CCC(CC)CC1CO1,0.3527
CC1C2N1CC21CCC1,0.3016
OCCC#CC1CCO1,0.2718
CC(=O)N(C)C(=N)CO,0.2395
N=C1OC(C#C)C2OC12,0.269
C1NC2C3OC12C=C3,0.2053
CC#CCCC#CCO,0.272
ON=C1CC(O)C11CN1,0.2237
CC(CO)(C=O)C1CC1,0.2234
C1C=C2C3OC4C1C2C34,0.1762
CC1C2OC(C#N)C12O,0.249
CCc1c(cc(o1)N)O,0.2151
CCC1(O)CNC1=O,0.2678
CCC(=O)OC(=N)C#C,0.2259
CN=C1OCC(O)C1=O,0.1821
c1c[nH]cc1C#CC=O,0.1705
C1OC2C3CC(C3)OC12,0.3179
C1C2C3C4C(CCN24)N13,0.2752
CC12C3C4N=C(OC14)N23,0.1463
Cc1ccc(=O)oc1O,0.1689
Cc1nc2c(o1)OCC2,0.2132
CC1CN1C1=CN=CO1,0.2223
O=CC1C2C3C1C(=O)N23,0.2137
CC(O)C1CN2C(C)C12,0.2848
CC1CC1C#CC#C,0.2167
Cn1c(cnn1)O,0.2482
C1CC23CCCC(O2)C13,0.3192
CCN=C1ON=NC=C1,0.1532
CCn1c(=O)ocn1,0.2388
c1c(n(cn1)C=O)CO,0.1859
Cc1ccc(=O)[nH]n1,0.174
CNC(=O)CCC(C)O,0.2813
CC(C)CC1(C)CC1C,0.3335
CC12COC1CC2CO,0.309
C#CC1COCCN1,0.2581
OC1C2OCOC(=N)C12,0.2526
CC1CC1C(N)=O,0.2734
CC(C)C#CC1NC1C,0.2745
c1c(c([nH]c1N)O)CO,0.229
O=C1CCC2NC2CN1,0.2674
C#CC(=N)NC(=N)C=O,0.1841
CCOCC1CC(=O)N1,0.2864
OC12CC3C1C2C31CO1,0.3221
OCC1C2CN1C21CC1,0.3124
CC12C3C1C1=CC3N2C1,0.1065
CC12CC(CC#C)C1O2,0.3026
C(Cc1nnon1)C#N,0.2456
CCOC(CNC)C#N,0.2493
c1cc(nc(c1)O)O,0.2072
O=CNC(C#C)C1CN1,0.2612
c1cc(oc(=O)c1N)F,0.1593
NC1(CC1C#C)C#N,0.2674
CC1N(C)C1(C)C#N,0.2715
CC(O)C1CC(=O)C1,0.2224
CC1(COCC1=O)C#C,0.2064
CCc1c(nc(o1)C)C,0.2327
C1C2C3C4CC1C(C4)N23,0.3091
N#CCC12CC1OCC2,0.2747
CC1(O)C(O)C1CC=O,0.2221
N=COC12CC1N1CC21,0.2483
COCC#CCCC#N,0.277
CC1CCC(O1)C1CO1,0.3271
CC12CC1N1CC21C#N,0.2397
CC1C2C3C(CC3=O)N12,0.1974
CC12CC1(C=O)C1CN21,0.2093
CC12OC1(C#C)C1NC21,0.2571
OC1(C=O)C2CC1C=C2,0.1917
CCC(=O)CC(=O)CC,0.2082
CC(C#N)C(F)(F)F,0.3552
O=C1NCC2CCCC12,0.2728
CC1(C)OC1(C)C=O,0.2147
CC12CC1(CC2O)C#C,0.2666
CC(=O)N(C)C(=O)N,0.2557
CC1OCC(=O)C1(C)O,0.2141
O=C1OCCC2CN12,0.2889
c1coc(n1)CC#N,0.2423
C1C2CC1C1=C2NN=N1,0.228
C1CC1C(=O)C(=O)N,0.1777
CC(=O)N(C)CC#N,0.2707
CC12OC1CCC1NC21,0.3126
COC1CN2CC12CO,0.2949
CNC1C(=O)COC1=O,0.1863
CCOc1cc([nH]c1)N,0.2312
CCC(C#N)C(C)C=O,0.2236
CCC1C2CC(O)C12,0.3211
CC1(CCN=CO1)C#N,0.2678
CNC12COC1C2OC,0.278
c1c(c(n[nH]c1=O)N)O,0.1656
OCC(=O)C1OCC=C1,0.2066
CC(C)C(=O)CC(=O)C,0.2106
COCC(O)C(C)OC,0.3307
N=C1CC(O1)C(=O)C=O,0.1495
C1C2C1C1C3C4C2C1N34,0.3192
CN=c1occ(o1)C#C,0.1841
CCc1cnc([nH]1)OC,0.2433
CC1C(=O)OC11CCC1,0.2802
CCC1CC2CC12C#N,0.2862
OC1CC1C#CC#N,0.2161
CC12C(O)C1C=CC2O,0.2319
OC12COC1C=CC2=O,0.19
CN1C(CC1=O)C=O,0.2061
O=C1OC2(CC2)C2OC12,0.2489
CC1CCC(C)C1O,0.3232
OCC1(CN1)C#CC#C,0.2208
CC12OCOC1CC2O,0.31
C(C=O)OC(=O)N,0.2283
CC1(O)C(O)CC11CN1,0.3038
O=C1OC=NC2CNC12,0.2131
CC1=C(C=CN1)C1CO1,0.2381
N=COC1=NC=CC=C1,0.2086
CC1OC2=NCCC12,0.2663
CC1(NC=O)C2CC1C2,0.2789
CC1OC(C)(C#N)C1O,0.2826
Cc1c([nH]nn1)C=O,0.1973
CC(=O)C1CC2(CC2)O1,0.2127
C1C2CC3OC(CC13)O2,0.3297
CN1C2C3C1C2C31CN1,0.2953
CC12CC1N1CC1C2=O,0.2109
CN1CC2NC(C=O)C12,0.1921
c1c[nH]c(c1CCO)O,0.2238
CC1N2C(=O)OCC12C,0.2806
c1c(cnc(=O)[nH]1)O,0.1556
OC1CCC(=O)NC1=N,0.2405
CC1C2OC3CC2C1O3,0.3334
C#CC1COCOC=N1,0.2596
NC1CNC2=C1ON=N2,0.1756
c1cc(c(cc1N)N)F,0.1977
CC1OC2C3CC2C13O,0.3015
CCC1CN(C=O)C1=N,0.2285
C1CC23OCC2=CCC13,0.2364
CC1(C)C(O)C1N1CC1,0.3051
CCCCC1=CCCC1,0.2588
CC(O)C1=C(C)C=CN1,0.2337
CC#CC(OC=O)C#N,0.2633
N=C1OCC1N1CCC1,0.2485
CC(CNC=O)C=O,0.2215
CCCC(C#C)C(C)C,0.3127
CC(=N)OC1=NC=CO1,0.245
OC1COCC2(CN2)C1,0.3049
OC1C2C3CC2OC1O3,0.3218
OC1C(C#N)C2CC12O,0.2983
O=C1CCC2CC=CN12,0.2104
COC1COCC(C)=C1,0.2558
CCC1(CC#C)CC1C,0.3101
CC1OCOCC2CC12,0.334
OC12CC1CCCC2,0.3295
C1CC2C3NC3C2=C1,0.2366
CCCC(OC)C(C)=O,0.2184
CC1CC(C)=C(C1)C=O,0.1923
CNC1=NC(CO1)C=O,0.1958
CC1CC(N1)(C=O)C=O,0.1831
C1NC1C1=CN=CN1,0.2404
OC1CCC2C1OC2=N,0.2891
c1c(ncc(n1)O)CO,0.1936
C#Cc1c[nH]c(=O)o1,0.1916
c1cncc2c1coc2,0.1537
CC#CCC(N)C#N,0.2754
CC1CCC(C)=CC1O,0.257
CN1C(=N)C2(O)CC12C,0.2375
Cc1nc(=O)ccn1C,0.2047
CC1COC(C)(C)C1O,0.2993
N=C1CC2(CCO2)CO1,0.2763
CC(CO)C(O)CCO,0.3268
CCCC(=O)CCO,0.2346
CCC(C)(C=O)C#CC,0.2153
ON=C1CC2(O)CCC12,0.245
COCC(C)(C)C1CO1,0.3354
COCC(NC=O)C#C,0.2758
c1c2c(oc1N)CC=C2,0.1739
OCCC(O)C#CCO,0.2875
CN1C2COCC=CC12,0.2141
CC1=CCC2OC2(C)C1,0.2633
C#CC(C=O)(C=O)C#N,0.2042
CN1CC2(CN2)C1C#C,0.2564
CC1(CN1)C1(CO1)C#N,0.2694
CC1=CC(C(=O)C1)(C)C,0.2214
CCc1cncnc1,0.2099
CC#Cc1c(nn[nH]1)N,0.1833
OCC1CC2CC3C1N23,0.3026
OCC1COCCC=C1,0.2484
N1C2C3OC4C1C4OC23,0.2305
CCC1OCCC1OC,0.3232
NC12CC1(C#N)C(O)C2,0.2692
CC1C2CC1(O2)C=O,0.2089
CC1CC2(C1)CC(C)O2,0.3173
CC12CN1C(=O)C2,0.2375
O=CCN1C2CC1CC2,0.2027
OC1C2OC(CC=O)C12,0.2207
CC1=CCC(C#C)C1=O,0.191
CC1N=C(N)N(C)C1=O,0.233
CC12CC3CC(C13)C2=O,0.2193
CC1C2C3C2C1C3C#C,0.3017
CC1CC(C#C)C1O,0.2874
N=C1OC2CC1C=CC2,0.2517
CCCC(C)C(C)C#C,0.3148
CC(N)(C#N)C(F)(F)F,0.2984
CCC1OC2CC12OC,0.3073
Cc1c(nc[nH]1)NC,0.21
COC1C(C)C(C)C1C,0.3061
C#CCOC1(CC1)C#N,0.2766
CC1C2C(O)C(C)N12,0.2829
OC1COC(=O)C(O)C1,0.2615
OC12CC3C4C(CC13)C24,0.3246
Cc1cc(c[nH]1)OC=O,0.2199
O=CC1C2C3N=CN1C23,0.1994
OCCC1(O)C2CCC12,0.3068
CC1C2C3OC4C(C23)C14,0.3001
Cc1c(oc(n1)CN)C,0.2344
C1COCOC1=O,0.2721
C#CC12OCC1C1NC21,0.2503
CCC1C2COC12CC,0.3027
OC(C#C)C1OC1C=O,0.2171
COCC1C(O)C1CO,0.3022
NC1C2OC(=N)C12C#N,0.2408
CN=C1C(=O)CCN1,0.1813
c1cnc(c(c1F)F)N,0.2092
CC(C#N)C#CC#N,0.2443
CC1C2OC2CC1(C)O,0.3302
C1CCOCCOC1,0.3164
CC1C2OC2C(C)C1O,0.3362
CC1OCC2=CNN=C12,0.2445
O=C1CN=C2OCC12,0.208
CC(C)N=C1CC(C)O1,0.2703
OCC1CC11CCCC1,0.3333
OC1C2CC(O2)C11CC1,0.3007
CC12CC3OC1C3(C)N2,0.3057
N=C1ON=C(O1)N1CC1,0.2451
C(C(=O)N(C=O)C=O)O,0.2118
CC(O)CC(=N)NC=O,0.2288
CNc1c(n(nn1)C)O,0.2385
CC1CC1(O)CCC#N,0.3056
CC12CC3C4OC(C13)C24,0.3077
CCC1(OCCO1)C#N,0.3096
CC(O)C1CN1C(C)C,0.2952
COC1CC(C)C1OC,0.3125
OCC1(C=O)C2CCC12,0.2248
CC12C3CC1C(O)C23,0.314
c1c2n(c(=O)o1)CCN2,0.2383
Cc1c(onc1O)C#N,0.2117
CC12CCOC1C(=O)O2,0.2509
CC12OC3C(OC1=O)C23,0.242
CC1C(O)C2NC(=O)C12,0.2669
N#CC12CCC1CC=C2,0.2598
C1NC11CC2(CCO2)C1,0.3018
CN1C2CN(C2)CC1=O,0.2397
COCC(O)C1CC1O,0.2919
OCC1C2CC2C2NC12,0.3019
CC1N2C3CC1(C=O)C23,0.2034
CC1=CC2CC1C2C=O,0.1938
C1C(CO1)(CO)NC=O,0.2699
CCCc1ccc([nH]1)C,0.2335
CC12C3CC1(CC2=O)O3,0.1898
CC#CC(=O)C1CO1,0.2007
CC1(C=CNC(=O)O1)C,0.2272
OCC12CC(C=C1)C=C2,0.216
OCC1OC(CO)C1O,0.2932
OC1COC(C=O)C1O,0.2102
C#CCc1cc[nH]c1,0.2503
CC1C2CC(O)(C#C)C12,0.2863
CC1OC2(CC12C)C=O,0.2174
CC1OC2C(O)C1C2O,0.2765
CC(O)C(C#C)C1CN1,0.2864
FC(F)(F)C1CCC1=O,0.2221
CN1C=CN=C(O)C1=N,0.1625
CCC#CCOCC#N,0.2575
CC(=O)C1C=CC2CN12,0.2105
CC(OC(N)=O)C(N)=O,0.278
OCCC1(CC1)OC=N,0.2821
OC1CCC1(O)CC#N,0.2854
CCC1COC(=N)C1C,0.2841
CC12CC(C=C1)C(=O)O2,0.2245
CCc1nnn(n1)C,0.2573
CC1(CNC=N1)C#N,0.2473
CCC(=N)OC(C)CO,0.2922
CC1(C)OCOC1CO,0.3258
O=C1C2CCC2C1C#N,0.2168
C1C=CCN(C=N1)C=O,0.2166
O=C1NC=C2C3CC3C12,0.1961
CCC1(C)CC2NC12C,0.2984
O=CC12CCN1CC2=O,0.1911
c1cncc(c1N)F,0.2204
CC1NC2(C)C1OC2=N,0.2595
c1c(c(no1)N)C2CC2,0.2361
NC(C#N)C1NC2CC12,0.2591
CC1CC1O,0.334
OCC1CC2(CO)OC12,0.3167
CC1OC11C2CC1CC2,0.3456
CC12CC1CC1OC21,0.3349
CC12CC3C=CC(C1)C23,0.2496
OC12COC1C(C2)C#N,0.28
O=C1C2COC2C11CO1,0.1954
CCC(=O)COC=N,0.2212
CCNc1cc(no1)N,0.2335
CC1(CO)C2CC1C=C2,0.2319
CCC1CC1OCC#C,0.2825
OC1C=CC2(CN2)C1=O,0.2015
CC1NC=[NH+]C1C([O-])=O,0.2388
CC1OCCC1(O)CO,0.3003
CC1COC2(CCC2)C1,0.3157
CC(O)C1(CC1)C(C)O,0.3291
O=CN1CC2OC2C1=O,0.2095
CCn1cccc1N,0.2368
OC1C2CC1C2O,0.3263
Cc1c(onc1N)C=O,0.1738
Cc1c([nH]nc1N)C,0.2344
CCN1CCC(=O)C1=N,0.1679
CC(C)(C)n1cnnc1,0.2678
COC(C)(CO)C1CC1,0.3343
CN=C1C=N[N-]C(N)=[NH+]1,0.1688
COCC12C3CN1CC23,0.298
C1C2CCC3CCC12O3,0.3074
N#CCC12CCN1CC2,0.2548
NC1C(CC#N)OC1=O,0.2517
CNC(C)C(=O)OC,0.2312
C1CC11OC2CC=CC12,0.2444
CC(OC=N)C1COC1,0.2718
CC12NC3C1NC23C#N,0.2433
COC1=NC=NC(=N)N1,0.1911
CC1(C2(CC2)C(=O)O1)C,0.278
CC1=CON=C1C1CO1,0.2435
COC(CC(C)O)C#C,0.2965
CC1OC2CC3C2C13O,0.2999
CCn1cc(nn1)O,0.2265
N#CC12CCNC1CO2,0.2555
C#Cc1c(c([nH]n1)N)O,0.2067
c1c2c([nH]n1)nno2,0.1976
CC(=O)C#CCCC#N,0.2073
CC1N2CC2(C)C11CC1,0.3068
CCC1OCCC(=N)O1,0.2776
O=C1C2CC1C(=C2)C#C,0.1963
C1OC1C12C3CC1CN23,0.3119
OCCC1CC1C#N,0.3034
Cc1ncc(c(n1)F)N,0.1953
CCc1cc(ccn1)F,0.2404
c1(c(n[nH]n1)O)C(=O)N,0.2036
c1conc1CN2CC2,0.2358
CC1N2CC(C2)C1=NO,0.2418
COC1CC2(O)CC2O1,0.3148
CCC1=CC(=O)C(=O)N1,0.1497
C#CCC1OC1C#C,0.2756
c1cn(cc1N)C(=O)N,0.1852
CC12CC3C1C(C#C)C23,0.3008
c1concc1=NO,0.1638
CCOC(C)(C)COC,0.328
CC(CC=O)C#CCO,0.2193
OC1C2CC3CN=C1N23,0.2275
COC1C(O)C1C(C)O,0.2914
CC1C2N3CC2(C#N)C13,0.2713
C1CC(=NO)C=CC=C1,0.1581
CCC1CCC(O)CC1,0.3184
C1CC1C1OCC11CN1,0.3064
C1CCC(C1)COC=O,0.2866
C#Cc1cc(=O)nco1,0.1827
CC1CCC1C#CCO,0.2725
OC1CC1(OC=O)C=O,0.2137
CC1=CC2CC2OCC1,0.2485
CC(C)C1(CO)NC1C,0.3038
CC1N2CC1(C#C)C2C,0.2726
CCCn1cc(nc1)O,0.2285
CC12CC(CO1)C2(C)C,0.3137
c1c2c(on1)C(=O)CC2,0.1871
CCC#CC(=O)C(C)C,0.2055
N=COC1CC(C1)C=O,0.2282
OC1=CNC=C(O)C1=N,0.1741
OC(C#N)C(=O)N1CC1,0.2536
NC(=O)C1(CCN1)C#N,0.2435
CC1(O)C(C#C)C1(C)O,0.2711
CCOC1(C)CCC1O,0.3221
C#CC12NC3C1COC23,0.2599
OC1C(CC1=O)NC=O,0.2049
COc1cc[nH]c1O,0.2342
N=C1CC2C(CC2=O)O1,0.2144
OC1COCC(=O)OC1,0.254
CC1CC2COC(=O)N12,0.2873
COc1conc1N,0.2301
OCCC1COCO1,0.3332
O=C1COC2CCC1C2,0.2139
CCC#CC1OC1C,0.274
c1c(c(=O)nc(o1)N)N,0.1913
CC(=NO)C#CC(=O)N,0.1877
CC(COC=N)C1CO1,0.2836
OC12COC1C2(O)C#C,0.2471
COC1=NC=CNC1=N,0.1686
CC12CC(CC#C)(C1)C2,0.3134
CC1=NCCOCO1,0.2555
CCC1CC=CC=CC1,0.1917
NC(=O)C1CC2(CC2)O1,0.2603
COC1CCC1(C)O,0.3235
CC1C(O)C2N(C)C12C,0.2841
CC(C#N)N1CC1C,0.2768
CC1=C(CCOC1)C=O,0.192
Cc1ccncc1CO,0.2272
CC12CN3CC(O)C1C23,0.2831
OC1C2CC1OCCO2,0.2974
CC12C3CCCC1OC23,0.3056
CC1CC1C1=CC=CN1,0.2373
N=C1CC(O1)C#CC#N,0.2208
OC1(COC=NC1)C#N,0.2675
CC1=Cc2c([nH]cn2)C1,0.1905
CC1OC2(CCC12)C=O,0.2061
CC1(CC1(O)CO)C#N,0.2979
OC1CC1(O)COC=O,0.2547
CCC1CC=CC1(C)C,0.2644
O=CC12CC1COC=N2,0.2192
CC1C=CCC2CC12O,0.2634
CCc1ccc(=O)oc1,0.1747
O=CC1(CN=CO1)C#N,0.2065
CC1C2C3NC3C12C#C,0.2365
C[NH+](C)C(C)(C)C([O-])=O,0.2591
CC1NC1CC(C)=O,0.2293
Cc1c[nH]c(cc1=O)F,0.2085
N=C1CC(O1)C#CC=O,0.2028
CC(=N)N1CC=CC1=O,0.2012
CC1C2(C)CC1(C)C2,0.3678
NC(C#N)C1CC1,0.2852
OCC1C2CCC12O,0.3174
C1C2NCC3OC2OC13,0.2937
Cc1c(c(on1)N)C=O,0.194
CC1C2C1C1CC2O1,0.339
OC12COC11COC1C2,0.2979
OCC1(CO1)C1COC1,0.3176
COC1CCC11CN1,0.315
CC1=CC2CC1(O)C2=O,0.2346
c1c(oc(=O)[nH]1)CC=O,0.1868
COC1(C)CC1CCO,0.3277
CCCC1CC1O,0.3337
CC(O)C1=CN=CN=N1,0.1691
CN=C1C(O)C2C(C)N12,0.2347
OC12CNC1C(=O)NC2,0.2484
CC1CC=C(C#C)C1O,0.2096
ON=C1CC2CC3C2C13,0.2429
CCC12OC1C=CC2=O,0.1699
C1C2C1C13CC21COC3,0.2701
CC#CC12NC1CC2C,0.2508
CC1OC(C)C(C=O)=C1,0.1819
CC(C)(C)OC(=O)CN,0.26
CC1CCC(C#N)C1=O,0.2201
CCC1(C)C2C3CC3N12,0.2771
CC12CN1CC(C)(C)C2,0.2997
OC12C3C1N1C3C2C1=O,0.218
CC1NC11CC2C1N2C,0.2986
C#CC1CCOC1C#C,0.2915
CC1C2OC1C(O)C=C2,0.2339
CC12CCC=C1CO2,0.241
CC1CC23CC4C2C1N34,0.3131
c1conc(c1=O)C=O,0.1507
CC1CC=C(C)C(O)C1,0.2592
CC(=O)C1(C)OC1C#N,0.218
CC12CC1C1(CO1)C2O,0.3286
CC1CC2CN2C(=O)O1,0.2888
CC1COC1C#CCO,0.2693
COC1CC1CCC#N,0.2908
Cc1c(n(nn1)C)C#N,0.2172
CNC1=COC=NC1=N,0.1764
OC1C2OCCCC12O,0.3014
CC12CC3CC1(O)CC23,0.3225
C1C23COCC12N=CN3,0.2401
OC1CC2(CC12)C#C,0.271
OC1C2C3OCCN2C13,0.2815
CC#CC(C)(N)C#N,0.268
CCCC(O)C(O)CO,0.3209
CCC1OC1CC1CO1,0.3489
CC(C)(C)C1(CN1)C=O,0.2227
CC1C=C(C)C2(C)NC12,0.247
OCC1CC=CCC1=O,0.2185
O=C1NC23CC(C2)CC13,0.2657
CNC(=O)N(C)CC=O,0.2101
CN=c1nc([nH]nn1)N,0.1664
OC1C2C=CC3CC2C13,0.2412
OC12CC1(CC2)C#N,0.2637
CC(C#N)C#CC1CC1,0.2687
CC(C)(C)OCC1CO1,0.3258
CC(O)C1CCOC=N1,0.2649
C1CC23C4C5C4C12CC35,0.2857
CC1C2CC1C2C1CC1,0.3632
CC1C2N3CC1C23C=O,0.218
C1CC(C1)C#CCC#N,0.2809
c1c(nn[nH]1)NC2CC2,0.2104
CCOC1CC2CC1C2,0.3351
C1Cn2c1nc(n2)CO,0.2632
C#CC1C2OC3CN1C23,0.2398
CC(C)c1cocc1N,0.2267
NC1C2CC2NC1C#N,0.2466
C#CCC(C#N)N1CC1,0.2745
O=C1C=CC2OCOC12,0.1735
OC1C(NCC1=O)C#C,0.198
CCOCc1[nH]ncn1,0.2714
Cc1cc(ccn1)C#N,0.2018
C1CC1C12CC1C1CN21,0.285
[O-]C(=O)C12CC(C1)[NH2+]2,0.2156
OCC#CC1NC1C#C,0.256
OCC1=CC2CC2(O)C1,0.2388
CC1C(C#N)N1C(N)=O,0.2598
CC(C)C1NC1C(C)=O,0.2221
C1C2=C(COC2)NC1=O,0.2073
c1c(c(ncn1)CO)F,0.21
N=C1NC=NN1CC#N,0.2142
CN=c1cn[nH]cc1F,0.1667
CC12NC3=NCC1(O)C23,0.1742
CC1C(=O)C=CC11CC1,0.1909
CC12C(O)C3(C)C1OC23,0.2958
CN=C1NC2CCOC12,0.2499
CCOC(=N)C(C)(C)O,0.2773
O=C1N2C3C2C2C3CN12,0.2392
CC(C=O)C#CCC#C,0.2181
CCCOCCCC#C,0.3103
C1C2C3C=CC1C23,0.2379
OC1CN=C2OCC12O,0.2405
CC1CC1C1CC(O)C1,0.3261
C#CCC#CC1(CC1)O,0.2699
C1C2OC3CN=COC123,0.2511
CC1(O)C2CC(C2)C1=O,0.2176
CC#CC12CN1CC2C,0.2492
CC1(O)CC(C1)NC=O,0.2787
C1CCN(C1)C(=O)C#N,0.217
CC1CC(C=C1)N1CC1,0.2516
OC1CC2NC2CC=C1,0.2539
C1CC11CC2COC1C2,0.3237
CC1OC1(C)CCC=O,0.229
OC12CC1N1CC1CC2,0.29
C1C=CC2=CC3NC3C12,0.1917
OC1CCN(C=N)C1=O,0.2231
CC(O)CN1C=CN=N1,0.2575
c1conc1CC#N,0.2524
CC1(CO)C2CC(=O)N12,0.2362
C#Cc1cc(c[nH]1)O,0.189
CC#CC1(C)CCOC1,0.2979
C1C2C3C4COC4C3N12,0.2676
CCC(C)(CC#N)C#C,0.3017
CCC(COC)CC=O,0.229
CCC(O)C(=O)C1CC1,0.2348
C1C2CCOCC1O2,0.3223
O=C1CCC(=C1)C1CN1,0.1896
c1c([nH]nn1)CC=O,0.2125
CC1(CCO)COC1=N,0.2874
NC1=COC(=N)N=C1,0.1444
c1c(nc(o1)CC#N)N,0.2049
CC1C2CC1C=C(C)C2,0.2469
N#CC12NC1C1CC2C1,0.2645
CC#CC(=O)OCC#C,0.2335
COC(=N)C(CO)CO,0.2786
CC(C([NH3+])C#C)C([O-])=O,0.2641
CCC1=NNC(=N)N=C1,0.1459
CC1(C)CC1C1(C)CO1,0.3247
CC1CC2COCOC12,0.3342
Cc1ccc(c(c1)N)N,0.2015
C#CC1=CC2CC(C2)C1,0.2037
COC1C2CC3N2C13C,0.3142
CC1CC(C)C(=O)CO1,0.2098
N=C1CN=C2C=CCN12,0.1765
Cc1c(nc([nH]1)C#N)O,0.1793
OC1(CNC1=O)C#C,0.2472
CC#CC(C)C#CCO,0.2706
C1CN(C=N1)C(=O)C#N,0.1952
O=C1COCCC2OC12,0.2002
NC1C2CN3C2C13C#N,0.2647
CC([NH3+])C1=N[N-]C(O)=N1,0.2419
CC1CN2N=NC=C2C1,0.2556
CC(C)N1C2C3OC2C13,0.2836
OC1CC2OCC1O2,0.3156
CCC(C)C1OC1C#N,0.2919
CC(=O)CN(C)CC=O,0.1999
CC1C2(O)CC(=O)C12O,0.2206
CC1=CCc2c1nco2,0.1981
OC12C3CC1C(=O)OC23,0.2633
OC1C2CC(O2)C1=O,0.1949
CC1CC2CC2C(C)O1,0.3237
CC#CC(=O)OC=NC,0.2108
CC1[NH2+]C1CCC([O-])=O,0.2757
CC(O)C(O)C1CN1,0.307
CCC12CC1COC=N2,0.2503
C(C1COC1)C1CCO1,0.3086
CC12C3C4C(C1O)N4C23,0.2912
CC1OC2C(O)C(C)C12,0.2891
COC12CC1C(=O)NC2,0.2659
CC1OCC1CC#C,0.2948
CCC1(O)C2CCC12,0.3114
OC1CCOC11CCC1,0.3001
CC1OC1C1=NON=N1,0.211
CC1N2CC11CC(O)C21,0.2499
COc1cccc(=O)[nH]1,0.1778
c1ncnc(n1)O,0.2238
CCOC(=O)COC=O,0.2676
OCC1=CC2CCC1O2,0.2532
CC1(CO)C2C3OC3C12,0.2813
OC1COCC1O,0.3026
C1C2C3CC(C4NC34)N12,0.3004
CC1(CC#N)CC2CC12,0.3019
C(C(=O)N)N=COC=O,0.238
N=C1OCC=CC2NC12,0.2255
CC12C(O)C1N1CC21C,0.2783
OCC1COCOC1=N,0.2523
c1cnn(c1)CC#N,0.2579
C1C2CC3OC4C2N1C34,0.2756
C1NC1C1C2OC=NC12,0.2516
CNc1cc(co1)N,0.2185
CC12CCCC1C2C#C,0.2854
ON=C1CN2CC1(O)C2,0.2426
CCN=C(C(=O)C)NC,0.1643
CC12CCC3C(C13)C2O,0.3132
CN1C2CC=CC1C2O,0.2107
O=C1NC2=NCC3C1C23,0.2071
CC1COCC(O1)C#N,0.2763
CCC12CC3(C)C1OC23,0.3086
CCC(C)OC(=N)C#C,0.2357
CC1(NCCC1=O)C=O,0.1826
OC1=NOC(OC=N)=C1,0.2272
c1c2c([nH]c1N)CC=C2,0.1884
CC12CC1OC=NCC2,0.2591
CN1C(=N)ON=C1CN,0.2298
CC12C3C4C3N1C(=O)C24,0.2278
CC1OC11C2OC1C2C,0.3172
C#CC1=CC(=O)CCC1,0.1694
C1CN1CC#CCC#N,0.2562
CCC(C=O)C(C)=NO,0.2059
O=CC1NC1C#C,0.2179
CN1C2CCC3(CN3)C12,0.2894
CC1OCCC(=O)O1,0.2719
OC1C(O)C1CCC#N,0.281
OC1C2C3(CO3)CC12O,0.3081
CCCC12CC1C(=N)O2,0.2793
COCC1NC1(C)C#C,0.2761
N#CC1CC=CCO1,0.2651
C1C(=O)CC1(C#N)O,0.2222
C1CC=CNC(=O)OC1,0.2266
Cn1cc(nc1C#N)N,0.1751
OCC1(O)CCNC1=O,0.2569
CNC(CC#N)CC#N,0.2534
CC(CC1CO1)=NO,0.255
CC1C=CC2(CO2)C1C,0.2485
Cn1c2c(cn1)OCO2,0.2215
CC1CC(C)N1C(C)=O,0.2609
CC1OC(=N)C=C1N,0.2135
CC12CCCOCC1N2,0.3123
C(CCO)CNC(=O)N,0.3029
OCC12CN=C3CC1N23,0.1918
OC(COC1CC1)C#N,0.2683
C1C2COC3C4CC23C14,0.2302
OC1C2OC3CC2(O)C13,0.302
N=C1COCOC(=N)N1,0.2377
C1C=CC23NC2C=CC13,0.2201
CN=c1c(ncn[nH]1)F,0.1641
NC1CC1(CC#N)C#N,0.2867
C1C(CC1=O)CC#N,0.2219
CCOCC1C(C)N1C,0.291
N=COC12CC1OCC2,0.2576
OC1COC2C(C=O)C12,0.2207
CC1CCC(=C1)C1CC1,0.2453
COC(C)C#CC1CN1,0.2625
C1C(=O)C(O1)(CO)CO,0.217
c1c(nc([nH]1)N)OC=O,0.2126
CC(=O)C(=O)CC1CN1,0.148
CC(CCCCO)C#C,0.3153
N=C1C=CON=C1,0.1854
CCC1=CCCC1(C)C,0.2548
CN1C2C3(C)OC3C12C,0.2666
C#CC1N=CN2CC12,0.2451
CC(CO)OCCC=O,0.2276
CN(C)c1noc(=O)o1,0.2584
CC1CC(C)(CO1)C#N,0.2923
OC1COC2=C1ON=N2,0.1868
OCCC1COC1C=O,0.2142
C(C1CO1)C1=COC=N1,0.2442
CCN1C2C3C(C)C2C13,0.2936
CC1(C)CCOC1C#N,0.2959
CC1CC=CCC1(C)O,0.2681
O=COCC1OC1C#N,0.2648
CC1CC2OC1C2O,0.3354
CCC(O)C(C)=NO,0.2547
OC12CCC1CC1NC21,0.3043
CC(O)C1CCC(=N)O1,0.2871
C(C(CO)C(=O)CO)O,0.2261
NC1=NC(=N)NN=C1F,0.1567
CC#CC(O)C#N,0.2697
N#CC1=C2CC3C(C1)C23,0.1561
C1OC=NCC2OC12,0.2592
CC1C2C1C1(CN1)C2O,0.32
CC12N=CN3CC1(N)C23,0.2217
O=C1NCC2C(C#C)N12,0.2575
CC(C(O)C#N)C1CN1,0.2628
CC1(C)CC2(C)OCC12,0.3173
CCOc1cnco1,0.2338
C1C2OC=NC3CNC123,0.2456
CC12NC1CCC1OC21,0.31
CCN1C=CC(C)C1=O,0.2079
CC(C)CC1(CC1)CO,0.3338
CC1=CC(=O)CCN1,0.1897
CCC1(CCC1)CC#N,0.3319
c1c2c([nH]n1)CN=CO2,0.2251
CCOC(CCO)C#N,0.2907
CCC1OC(CO)C=C1,0.2438
Cc1cnn(c1C)C=O,0.203
CC1CC2(CC#N)CC12,0.301
CCN1N=CC=NC1=N,0.1462
C1OC11C=CC=CC=C1,0.1478
CC1C2C=CC(=NO)C12,0.1831
O=COCC1CN=CO1,0.2673
CC(C)(CCCC#N)O,0.3113
CC1C(CN2CC2)N1C,0.2936
CC1C2C3OC3C12C=O,0.2161
c1c(nnc(n1)C=O)O,0.1651
CC(=N)OC1=NNN=C1,0.2351
CC(O)C1CCC(C)O1,0.3285
CCOC1OC(C)C=C1,0.2606
CC1C2C1C1C2N1C,0.2727
OC1CC1C(C=O)C#N,0.2275
C1CC(C1)C2CC2,0.3527
CC1=CC2C3C4C2C1N34,0.2365
COC1OC(C)(C)C=C1,0.2622
OC12C3CC1COC2C3,0.3043
CC1CC(=O)C1(O)C#N,0.2132
OCC12CC3OC1C23,0.2903
c1c(nc(c(=O)o1)F)F,0.1627
OC1COC(=N)C11CN1,0.2584
CC1C2C3OCC1C23O,0.2891
C1OC2C3C4CC2C1C34,0.3239
c1nc(c(o1)C(=O)N)O,0.1945
CCOC12C3CC1CC23,0.3205
c1cnc2c(n1)nno2,0.1779
Cc1cc([nH]n1)N,0.2457
CC(CO)OCC(N)=O,0.2391
CNc1ncc(o1)N,0.2273
O=C1CCCC2CCC12,0.2222
O=CC1CC2CC1O2,0.2214
CC1(C(=O)C2(N1)CC2)C,0.2094
COC1C2(C)CCC12C,0.312
COC1=CC=NC(=N)O1,0.1703
CC1=C(CNC1=O)N,0.2125
OC1C2OC=NCC12O,0.265
CNC1(CCC1C)C#N,0.2676
CC1=CCC2CC2C1=O,0.1953
CCC(O)C1CC2NC12,0.2957
OC1C2OCC1C(=N)O2,0.2792
c1cnoc1NCC=O,0.1874
OC1CC1N(C=N)C=O,0.2215
c1conc1C(=O)N,0.2195
CN1CCC(=O)C=C1,0.1834
CC12OC3C(CC13)C2=O,0.2099
CC(O)C12CC1CCO2,0.3001
CCC(C)C#C,0.3157
Cc1cn(c(c1O)N)C,0.2288
N=C1CC2C3CC2(C3)O1,0.2796
CN1CC11C2CCC1O2,0.3169
CC1(CC1C(N)=O)C#C,0.2545
CC1C2C(O)C1(C)N2C,0.2831
c1[nH]nc(n1)CC(=O)N,0.2291
CC(C=O)C(O)C(N)=O,0.2202
COc1cc(no1)C#N,0.2049
CC1N=C(C)OC1C#C,0.2663
OCCC1(CC1O)C=O,0.2294
CN=C(C(=O)COC)N,0.1906
CCCC(O)C1OC1C,0.324
CC12COC3C(C1)OC23,0.3203
c1c(nn[nH]1)CCC=O,0.2246
COC1CC2(C)C1N2C,0.3151
CCC(C)N=C1CCO1,0.2773
CCCCC1CCCO1,0.3245
C1CC(C1)(C=O)C#N,0.2255
CNc1cn(nn1)C=O,0.1579
OCC1CC(O)C1C#N,0.2981
OC1C(OC1=N)C=O,0.2191
OCC12CC1C1OCC21,0.3014
C(COC(=O)C=O)C=O,0.1729
CN1C(=N)CN=C1CN,0.2213
C#CC12CC1(CN2)C#N,0.234
CC1=CC2CN2C1C#C,0.2314
CCC1=CC(=N)NC1=O,0.1903
COc1cc2n(n1)CC2,0.2385
OCC1(CO)NC1C#C,0.2808
CCC1COCC11CO1,0.3179
OC1C2C3C1N2CC3O,0.2976
C#CCOC(=O)C(=N)N,0.2099
OCC1NC1C#CC#N,0.218
O=C1CC2C3CCN2C13,0.2214
CC1OCCC(O1)C=O,0.2147
CC1N2CC3CC1(O)C23,0.2745
O=C1C2CC3N1C23C#N,0.2466
CC1CCC11COC1=N,0.2825
OCC(NC=O)C#N,0.2755
c1coc(n1)N,0.2373
CC(=O)C1CC=CCO1,0.2297
CC#CC(O)C1(C)CC1,0.2877
OC12C3C1C1OC3C21O,0.2812
CC(=O)C12CC1C(O)C2,0.2245
CC(C)(C)C1(CO)CO1,0.3352
c1c(nc([nH]1)CO)N,0.2169
CC1OC(C=O)C1C,0.2116
CC1C2OCCN1C2C,0.2901
CN1C2C3CC2(O3)C1=N,0.2387
OC1CCC2COC1O2,0.3174
Cc1ncc(cn1)C#N,0.1975
CC1CCC=CC(C)C1,0.2575
C(=O)NC(=N)N,0.2189
O=C1CC2(C1)NC2C#N,0.2176
CN1N=NNC(=O)C1=N,0.1941
c1c(nnn1C2CC2)N,0.213
CCC1(CC)CC(C)O1,0.3234
c1[nH]c(c(n1)C2CC2)O,0.2405
NC(=O)CC1CN=CO1,0.2534
N#CC1C2N1CC21CO1,0.2706
CC1C=CCN1C(N)=O,0.2386
N=C1C=CN=COC1=O,0.1739
C#CC1CC11CCOC1,0.2871
C1OC11CCC2CN2C1,0.3024
CCc1cc([nH]c1)C,0.241
COC12CC(O)C1C2C,0.3057
OC1=NC(=O)OC(=N)O1,0.2474
OC12CC1C1COCC21,0.306
O=CCC#CCC1CN1,0.2196
CC(C)(C)N1CC(=O)C1,0.2008
CCC1C2C3C4C3N1C24,0.2969
O=C1NC2CC3CC1C23,0.2652
COC12CC1C1NC21,0.2869
CC1C2C3OC(=N)C3N12,0.2449
O=C1ON=NC(=O)N=C1,0.2554
CCC1C(C)N1CC,0.2867
CCC1=COC(=N)C=N1,0.1592
CC#CCC1COCO1,0.2981
NC1(C#C)C2OC1C2O,0.2617
CN1C(=N)ON=C1N,0.2418
OCC1CCOC(=N)C1,0.2777
CCC1(OC1(C)C)C#N,0.2966
OCC1NC1(C=O)C#N,0.2237
C1CC2(C1)COCC=C2,0.259
CCN1CC1C1(O)CC1,0.2889
CC1(CC(O)C#C)CC1,0.2883
CCC1(CO)CC2CN12,0.2996
CC1C(=O)CC(O)C1=O,0.2007
CC1CC(O1)C(=O)C=O,0.144
OC12C=CC3CC1C2O3,0.228
O=C1COCC(N1)C#C,0.259
CN1CC23CC(CO2)C13,0.2739
C1OC23CC4(COC24)C13,0.1998
CC1CN2CC2(C1)C#C,0.2696
O1C2C1C1OC1C1OC21,0.3287
c1cncnccoc1,0.1795
CC12NC1C(C#N)C2O,0.282
C#Cc1cocc1CO,0.2154
CC(CO)C1=CON=N1,0.2244
CN1C2C1C1C2C1(C)C,0.264
CN=C1OC=NC(C)=N1,0.1816
CC(C)(CC#N)C1CO1,0.3111
c1c(=O)oc(c(n1)N)O,0.1283
OCC12CC1CN=CO2,0.2736
C(C#N)OC(=O)C#N,0.2479
O=C1CC2C3CC2(C3)O1,0.2757
CC(C)C1C2NC2C1=O,0.2162
CC12CC=C3C1C2C3O,0.181
CC1CC2COC12C=O,0.2051
C1OC2CC34CN(C3)C124,0.2691
CCC1(CO)CC1(C)O,0.3157
OC1(CC2NC12)C#N,0.2797
OC1CCC2(CC12)C#C,0.2836
CCC1C(C)C1OC,0.3135
CCC1NC1C(=O)NC,0.2641
O=C1NC2=C(NCC2)O1,0.2224
c1c(c(on1)NC=N)N,0.2029
CC12OC3CNC1C2O3,0.2757
OC1CC=CC1CC=O,0.2274
C1C2CC11CC=CC1C2,0.2582
N=C1NC(=NO1)C1CN1,0.2203
CC(C)C1(CCC1)O,0.3185
C#CCC12CC=CC1N2,0.2341
CCC(=O)NC(=O)C=O,0.1596
CCC1(O)CC2CC2C1,0.3265
CC1(C#N)C2COC12,0.2781
C#CC12CC3COC1C23,0.261
OC12CCC1NCC2=O,0.19
CC1NCCCC1=O,0.2103
CC1(C)OC2(C)CCC12,0.3157
CC(C=O)(C=O)C1CN1,0.1892
O=C1CC(=O)C2CC1C2,0.2148
C(C(=O)N)NC(=O)N,0.2657
CC(C(O)CO)C(N)=O,0.2712
c1conc1OCC=O,0.2275
CC1C2N1CC1OC21C,0.2952
CCC1(C)CNC1=O,0.2806
CC12CC1(C)CC=CC2,0.2652
O=COC1CC1C1CC1,0.265
N=C1NCCCN1C=O,0.2305
C1C2OC1C=CC=C2,0.1742
c1nc(c(o1)N)CO,0.2167
CNc1cnoc1NC,0.2169
CCC(O)C(C)C#N,0.3181
CC(O)C(O)C#N,0.2896
OC1CNC1=NCC#N,0.258
O=C1NC=C2CNC12,0.1913
CC(O)C1=CNC(=O)C1,0.2113
CC1CC11C(C)OC1=N,0.2808
CC12OC3CC(O)C1C23,0.3108
[NH3+]CC1CCC1C([O-])=O,0.1225
COC(N)=NC(C)C#C,0.2785
OC1C2CC2(O)C1=O,0.219
CC(CC#C)C(C)=O,0.2281
N=C(C=O)N1CC1C#C,0.1865
CC1C=CC2(C)CC12O,0.2437
CCc1ccncc1N,0.1993
OC1CCC2CN2C1=O,0.2497
CC12CC3CC3C1C2O,0.3003
OC1CC(OC1=N)C=O,0.2184
O=C1CC23CC(C2)C3N1,0.271
OC1CC2OC1C2C#N,0.2984
CC1OCC11CN1C,0.3109
COCCC#CC1CO1,0.2752
CC12CCC1(CC=O)O2,0.2178
CN(C)CC(=O)CCO,0.2078
CC1=CCC2CCOC12,0.2637
C#CC12C3C4CC1N2C34,0.2448
OCC1CN1C1CC1,0.2856
CC(C#C)C(C)(C)C,0.3126
CCC1(O)CC(O)C1C,0.3183
O=C1CC2CCC12C#N,0.2166
N=C1OCCN2CCC12,0.2457
c1c(cnc(c1F)F)O,0.2006
CC1(CCC(=O)C1)C#C,0.222
CC(O)C1=CNC(=N)O1,0.2193
COC1(C)CC2NC12C,0.3012
CN1C2C3C2C1(C)C3=O,0.2164
CC1=CC(=O)NCC=C1,0.1828
CC1COC2C3CC1C23,0.305
O=C1C2COC1C2C#N,0.2066
C[NH2+]C(C1CN1)C([O-])=O,0.2625
CCOC1(C)CC(C)C1,0.324
[NH3+]CC1=N[N-]N=NC1=O,0.1412
C1CC1C1CCC11CO1,0.3214
CN1CC2(O)CC12CO,0.2574
c1c(oc(n1)OC=O)N,0.2156
c1c(n2c(n1)[nH]cn2)N,0.2094
CC1OCOC1C#N,0.2919
CC#CC1C(C)C1C,0.2795
N#CC1=CC2CN2CC1,0.1897
N=C1NC(=O)OCO1,0.2672
c1c(c[nH]c1C#N)C#N,0.2106
COCCOC,0.336
C1C2CC3(CCCO3)C12,0.3197
CC1CC(C#N)C1C#C,0.2907
CCCC(O)C(O)C=O,0.2244
CC(C)(O)C(O)C=O,0.2307
O=C1OC2C3C4OC13C24,0.2585
C1C2OCC12C1COC1,0.3031
O=C1OCCC2CC1O2,0.249
C[NH2+]CC(O)CC([O-])=O,0.2741
CCC(=O)CCCC#N,0.2356
OCC1(CO)OCC1O,0.2985
CC(C)CC1CC1,0.3557
N=COC1=COC=C1,0.2325
OCC(=O)C1(CN1)C=O,0.221
N=C1CCCC(O1)C#N,0.278
CC1CC2C(C1)C2C#N,0.3138
CC1(O)C2CC(=O)C1O2,0.2102
c1[nH]nc(n1)CCO,0.2688
CCN1CC1C(=O)OC,0.2318
C(C(=O)C#N)NC(=O)N,0.1745
CC1C2(C)CC1(O2)C#N,0.2561
CC1C2CNC(=O)C12O,0.261
CC(=O)N1CCC=C1,0.208
CNC(=O)C1CC(C)C1,0.2732
CC1=NC(CCO)CO1,0.2682
CC(C)C(=O)C(=N)NC,0.1715
N=C1C=CNN=N1,0.1694
C#CC1CC2COC12,0.2848
C#CCC12NC1C1CC21,0.2535
OC1C2CCN2C1C#N,0.2327
CC12CN1CC1OC1C2,0.301
CC(C)C1CC1C#N,0.3162
CC1=CNC(=N1)C1CN1,0.2327
OC12CC3OC1C2C=C3,0.226
OC1CN2N=NC(O)=C12,0.2276
CC(C)(C)COC=O,0.2869
OCC12CN3C(C=C1)C23,0.2308
C1C2CC1C1OC1C2,0.3468
CC1(OCCC=C1)C#N,0.2613
O=C1OC2C1OCC2=O,0.1994
CC12CC1C1(C)CC21O,0.2757
C#CCCc1cnco1,0.2402
OC1CC(=O)NC11CC1,0.2665
N=COC(C#N)C1CN1,0.2586
OCC1CC1CC1CO1,0.3342
CC1CN(C1)C(=O)C#C,0.2192
N#CC1C2C3COC2C13,0.2834
CC(C)C#C,0.316
CC(=O)C1(O)C2COC12,0.2102
COCC1NC1CC=O,0.2207
COC1C2CC3(CC3)C12,0.329
C#CC1CC(=O)C(=O)C1,0.1445
C[NH2+]C1CCC1C([O-])=O,0.2721
CC12CC1(O)C(CO)C2,0.3145
CC1C2OC2CC1C#C,0.3029
CCC1=CCNC1C#N,0.2396
CC#CC(C)NCC#N,0.2612
c1ccnc(c1)F,0.2278
CCC12CC(O)(C1)C2C,0.3345
CC1CN=COC1CO,0.2697
OCC(O)CCC#C,0.3091
N=COC1COC1=O,0.2507
CC1N2CC=CC12C=O,0.2019
C1CNC=CC(=O)OC1,0.1946
NC1=NC=NC=NC1=N,0.1756
CC1(C2(O1)CN(C2)C)C,0.2943
OCC1(CN1)C1CCC1,0.2976
OC1(CNC(=O)C1)C#N,0.2624
OC1(C=O)C2CC1CC2,0.2087
CC1(NC2CNC12)C#N,0.2587
CCCOC1C(O)C1O,0.2891
COC1(CC(C)C1)C=O,0.2113
CCNc1cocn1,0.2119
CC(O)C1CN1CC=O,0.2209
CC1(C)NC1C(=O)C#N,0.1852
OCC1=CC2NC2C1O,0.2397
c1nc(c(c(=O)o1)O)O,0.1702
CC1OC(=N)C11CCO1,0.2611
c1c(nn[nH]1)COC=O,0.2551
CC(C#C)C1(C)CC1C,0.3107
CC(C#C)C1(CO)CC1,0.3094
C1CC2(O1)C1OC2C=C1,0.2394
N#CCC1C2C3OC3C12,0.282
N#CC12C=CC3OC1C23,0.2184
CC(C)(CCO)C#C,0.3183
CC1(O)C(O)C1(C)C=O,0.2086
CC1=CN(C(=O)NC1)C,0.2151
CCC1(C=O)C(C)C1C,0.231
CCC1(O)C2NC1C=C2,0.2203
CC1(C)C(O)C1NC=O,0.2629
N=C1NC(=O)C=C1C#N,0.1725
CCCC#CCCC#C,0.2899
C1CC2CCCC1CO2,0.3042
c1cc(=O)oc(c1O)N,0.1599
CN=c1[nH]c(nn1C)O,0.2261
C1OC2CC1CCOC2,0.3012
COCC1CC2(C)NC12,0.3017
C1C(COCO1)(C#N)O,0.2805
CCC(C)(C#C)C#N,0.2963
CC12CC1CC=CCO2,0.2566
CC1OC2OCC3C1C23,0.3259
c1coc2c1[nH]c(c2)N,0.1951
O=C1NCC2C=CCN12,0.2462
C1C2C3C4C5C3C1C2N45,0.329
C1CC2OC2CC2OC12,0.3321
CC12C3CC(N13)C2(C)C,0.3179
CCC12CC1C1C2N1C,0.2735
CC1CC(C)C(C)(C)O1,0.3121
CC1C2C3C2C2OC3C12,0.3202
C1C2C3CC1N23,0.3314
CC#CCCOCCO,0.3049
OC1C=CCCCC1=O,0.2082
OC1CC1N1CC(=O)C1,0.1956
CC12C3C4C(N14)C23O,0.2671
C#CC1NC11COC1,0.2723
CC1CCC11CN2CC12,0.3034
CC12C3CC1C=CC2C3,0.2487
C#CC12CC(N1)C1OC21,0.2586
CC1=CCC2OC2CC1,0.2542
CC(O)CC1CC1C=O,0.2284
OCC1CC2C(O)C2O1,0.3069
CC1C(O)C2(O)CCC12,0.2896
CC(CC1(C)CN1)C#N,0.2767
CC1COCOC(C)C1,0.332
O=C1C2N3C1CC23C#C,0.2269
NC(=O)C1C2OC2C1=O,0.2027
OCC12CC1OC(=N)C2,0.2731
CC(=NO)C(C)(C)OC,0.2558
C1CC12CCOC=NC2,0.2582
CC1OC1C#CC1CN1,0.25
CCNc1c(nno1)N,0.2
C1CC11C2NC2C2NC12,0.2874
CC1C(O)CC11CC1O,0.3139
CC12OC3C1C=CC23,0.2224
CC1(C#C)C(O)CC1=O,0.2091
CC(=O)NCC#N,0.2732
CNc1ccoc1NC,0.2082
N=C1NC(=O)OC=C1,0.2163
N#CC12C3CC1OC2C3,0.2725
O=CC1CC2C3CC2N13,0.22
CN=C1NC2(C)COC12,0.2402
COC1CCC1CC=O,0.2283
CC1OCC(=O)O1,0.2765
O=CC1N2CCC12C=O,0.1921
CCC(O)COC=NC,0.2714
CC1(C)CC2OCC1O2,0.3314
CC12OCC1(O)CC2=O,0.2014
CCC(C)(CO)NC=O,0.2736
CC1(C)C2OC2C1=O,0.211
NC1=CC(=N)C=C(F)N1,0.1983
CC1C(O)C2C(C#N)N12,0.2651
CC1C2CC2C(=O)N1C,0.2625
OC12CCC3=CCC1C23,0.2198
NC(=O)CC1CCOC1,0.2748
CC(C)CC1OC1C#C,0.2802
CC1(O)CC11OCC1O,0.288
O=C1CN2CC3C2CC13,0.1963
CCCC(C)C(O)C=O,0.2305
CC1=CCC(C1)C(N)=O,0.2577
OCC1C2N1C1CC21O,0.2888
OCC1(CC1O)NC=O,0.2547
OC1C2CC1C1(CC1)C2,0.3109
O=CNC12CCC1OC2,0.2667
O=CCC1OCC2OC12,0.2261
CCC12OC1C1CC21,0.2941
C1CCC(C1)(CO)C=O,0.2249
O=C1NC(=O)N2CCC12,0.2403
O=CN1C2C3OCC1C23,0.2444
CNC(=O)C1OC1C#C,0.2473
C1CC2CC3OC2C13,0.3219
C#CC(C#C)(C(=N)N)O,0.2277
CC(=O)CCC(=O)N,0.2359
CC#CCC#CC1CC1,0.2758
Cc1cocc1C(=O)C,0.1968
CC#Cc1ncccn1,0.2003
C1CC23C=CC(C=C2)C13,0.2107
CCC(O)(CC#C)C#N,0.3007
C(=O)c1nc(no1)C#N,0.1855
COC1(C)C(C)CC1O,0.3068
CC#CCn1ncnn1,0.244
CCC12CC1(O)CC2,0.3198
OC1CN2CC3(O)C1C23,0.2799
CC1COC2=C1C=CN2,0.2317
c1c(n2cn[nH]c2n1)O,0.2026
CN(C=O)C1CCC=C1,0.2386
CC1CC(=N)OC1=O,0.2627
C1C(CC12COC2)C#N,0.282
C1OC2CCCN3C1C23,0.3048
C(#N)c1c(nc([nH]1)O)N,0.1975
NC1C2(O)COC12C#N,0.2283
CCC(CO)(CO)C#N,0.2993
CCOC1CC(C1)C=O,0.2276
CCCC1CC1CCO,0.342
OC1COC11CCC=C1,0.2504
CC1C(C)(O)C1(C)C#C,0.2863
CC12C3NC1C3N2C=O,0.2511
CC(C)NC(=O)C1CO1,0.2636
CC12C3CC1(C3)OC2=N,0.2625
OCC12CC3C1N2C3=O,0.251
CN(C)CC(=O)C#N,0.1543
CCC1OC1(C)C#N,0.3003
CCCC1=CCCC1O,0.2571
Cc1c2n(nc1N)CC2,0.227
CC12CC3C(C1)C23C#N,0.2742
CC1N2CC(C)(C)C12C,0.294
C1CC1N2CC23COC3,0.2976
c1c(c(=O)nc(o1)F)N,0.1881
c1n[nH]c2n1nc(n2)N,0.2206
CCC(C)NC(=O)CC,0.2767
CCc1cc(ncn1)C,0.2129
OCC(C#C)C(=O)C#C,0.1927
O=C1CC23CC(CC12)O3,0.2272
CCCC1(C)COC1=O,0.2796
CN1CC(C=O)C1C#N,0.2143
CCC1NC1C(C)C#N,0.2983
COC1C(O)C1CC#C,0.2919
CC1OCC2(COC2)O1,0.3181
NC(=O)N1C2CC(O)C12,0.2694
NC(=O)C12CC3C1CC23,0.2595
OC1C2OC1C2CC#C,0.3013
CC1CC2C(O)C12C#N,0.2817
OC1CC11CCC(=N)O1,0.2753
OCC1C2CCCC12,0.3217
OCC12CC3C(CO1)C23,0.3304
c1c2n(nc1N)CC2,0.2295
CC(C)OC1C2CCC12,0.3174
CN1C2CC3CC2(C)C13,0.2904
CNC(=N)c1cn[nH]n1,0.1933
OC12CC1C1(CCO1)C2,0.314
C1CC2(C1)C(=O)CO2,0.2207
c1ccc(c(c1)O)F,0.2213
Cn1cnc2c1C=CC2,0.1823
C#CC1C2CC1C2C#C,0.2907
CCN1N=NC=NC1=N,0.1577
OC1(CC1OC=O)C#N,0.28
C(=O)Nc1c(onn1)N,0.1919
OCC(=O)C12CCC1N2,0.2271
CC1C2C3OC3C12CO,0.282
CCC12OC3C1C=CC23,0.2226
CC12CC(O)C1(C)CO2,0.2995
CC(O)C1C2COC12C,0.3052
CC(=N)OCCCC#N,0.2961
Cc1c(noc1NC)N,0.2297
c1c(non1)CC2CC2,0.2525
c1coc2c1N=COC2,0.193
O=C1CC23CN(C2)C13,0.1893
CCC(O)(CO)CCO,0.3232
CC1=CC(O)C(=O)C1,0.2214
CCNc1coc(n1)O,0.2283
COC12CN3C(C13)C2=O,0.2087
C(=O)c1c(onn1)C=O,0.1617
CCN1CC1C(C)OC,0.2921
CC1CC2(C)OC12C=O,0.2131
CC1=C(COC1=O)C#N,0.2028
COC1CC(=O)C2CC12,0.2268
CC#CCO,0.2789
CCCCCOCCC,0.337
CC1OC2C(=O)CC12O,0.2006
CC1CC2(C)C(O)CC12,0.3221
CC#CCOC(C)C#N,0.2628
OCC12CC3CCN1C23,0.317
CC1C2N(C)C1C21CO1,0.3053
c1c(ocn1)N2CC2,0.234
CC1C(O)C1(C)C#C,0.2861
C1C2C=C3CC4C1N2C34,0.1966
C1C2OCC=CC12,0.2356
CC1(C)C2C1C(O)C2O,0.3042
O=CC12OC3CC1C2O3,0.2253
COC1(C)OCC2NC12,0.3152
c1coc2c1nc([nH]2)N,0.2146
Cc1ncc(n1C)CO,0.2345
CN1CC2(CC12)C(C)=O,0.2047
COCC(CO)CC#C,0.3
CC1CC1(CC=O)C#N,0.2242
Cc1coc(=O)c(n1)C,0.1685
CCN=COCCC#N,0.2688
OCCC1CC(O)C1O,0.2926
C#CCC1CC2OC2C1,0.3107
COC1CCC2(O)CC12,0.3255
O=C1CCC=CC1C#N,0.2253
C1NC1C12OC3CC1C23,0.2904
C#CCC#CCN1CC1,0.2666
OC1CC(=O)OCC1=O,0.2236
OCC1CN2CC12C=O,0.2105
C1OC11CCOC1,0.3263
CCOC1CCN2CC12,0.3116
CCc1cccoc1=O,0.1776
CN1N=C(OC1=N)C#C,0.1697
O=C1OCC1NC1CC1,0.2347
CCCCc1n[nH]nn1,0.2601
C1CC11C2C3C4C3C1C24,0.3328
CCC1CC11CC(=O)O1,0.2806
CC1CNC(C)(C1)C#N,0.2745
C#CCCC1CCC1,0.3154
CN=C1OCC1(O)CO,0.2687
CCC#CC(C)(O)CC,0.2922
NC(=O)NC1COC1=O,0.2624
CC1CC2(C1)CC(=O)N2,0.2847
O=CC12C3CN1C(=O)C23,0.2055
CC1=CC(=O)C2(N1)CC2,0.1874
NC(=O)CC1(CO)CN1,0.2668
Cc1c2c(nco2)no1,0.2017
CC(N(C)C)C(F)(F)F,0.2896
OC1CC2CC3C2C13,0.3253
CC1(COC=N1)C#N,0.2695
N#CC12CC(C1)C21CC1,0.3082
C#CC#CC(CO)CO,0.2265
Cc1c(nc[nH]1)NC=N,0.2161
Cn1cnc2c1nno2,0.1936
COC1CCC=C1C#C,0.2068
c1c2c(on1)CC(=O)C2,0.2157
OC1=NC(=N)C(F)=CN1,0.1991
CC1CCC(C)(O)C1C,0.3233
O=C1C=CC2C3CN1C23,0.1744
O=CC1OCC2CC2O1,0.2238
C(CO)C#CC#N,0.2459
NC1=[NH+]C(=CN1)C([O-])=O,0.1749
CC#CC1(CC1)C2CC2,0.2803
OC1C2C1C1=CC=CN21,0.2242
CC12CC1OCCC=C2,0.2497
CC1C2(CC2)OC13CC3,0.292
C#CC12COC1CO2,0.2571
CC1CCCCOC1,0.323
CC1OC(C)C(=O)C1C,0.2186
O=C1CC(CC#C)CN1,0.2731
O=CC1NC2CCC=C12,0.2027
CC1(CO)OCC2OC12,0.3282
O=C1CCN=C2NCC12,0.206
CC1(C#N)C2C3CC2C13,0.3296
CC1=CC2(CC2)COC1,0.2474
CCC1C(C)CC1(C)O,0.3231
CC1C2OC(=N)C2N1C,0.2434
O=C1NC2C(CC#N)C12,0.2525
CC1NCC1=NO,0.2331
CCCC(=O)COC=N,0.2209
C1CC(C1)CCCC#N,0.3353
COC12CC1N(C2)C=O,0.2562
O=C1CC2C3CC(C1)N23,0.2204
c1c(c([nH]n1)CO)CO,0.2517
CC(CC=O)OC1CC1,0.221
CC1(O)COC1(C)C#C,0.2792
COC1C2OC2C1C#N,0.2842
CCc1ncnc(n1)O,0.2272
CC12CCCC1C(=O)O2,0.2783
CC1(CC11CCO1)C=O,0.2202
CC1C2(O)CC2C11CO1,0.3216
CC1(C)C2OC3C2C13O,0.283
C1OC2C3COC2C1N3,0.3013
CC(C)n1cccc1,0.2495
C(c1nnc(o1)CN)N,0.2461
NC1=NON=C1C1CO1,0.2036
O=CN1C2CC2C1C#C,0.2551
CC(C)CCC(C)CO,0.3411
CCOc1c[nH]cn1,0.2275
CC1=CCC2(CC2)C1O,0.2606
C1CC2(O1)C=CC1OC21,0.2262
O=C1C2CC3C=CC1C23,0.2059
OC12CC3CC1C23O,0.2964
CN=C1OCC11CCN1,0.2513
OC1C2CC1C1OC1C2,0.3294
CCCCOCC1CO1,0.3411
CC1CC(N)(C1)C#N,0.2936
CC1CC2C(CO)C2O1,0.3176
C(C(=O)N)O,0.2733
C1OC11C2C3C=CC2C13,0.2239
C1c2c(non2)CO1,0.2211
CC(NC(=N)C=O)C#N,0.1761
CC1(CCOC1=O)C#N,0.2648
OC(C=O)C1=NC=CO1,0.1985
CC1=NC2(CC2O)CO1,0.2409
COc1[nH]c(cn1)C#C,0.1988
NC(=O)C12CC1OC2=O,0.2478
O=C1C2CC1(C2)C#C,0.2446
Cc1c(nc([nH]1)C)O,0.2186
CC#CCC(=O)C#C,0.192
C#CC1=NCCC(=O)N1,0.2072
OC1C2OC11C=CCC21,0.23
CC#CC12NC1C1OC21,0.2337
CCC1=CC2OC2C1C,0.2402
CCC1C(CC)N1C=O,0.2546
CC1(C)NC(=O)N2CC12,0.2875
C1OC2CC=CCCC12,0.2555
OC1CC2NC2C1O,0.3064
CC1N2C3CC(C23)=C1C,0.1612
CCC1NC(=N)C11CO1,0.2531
CC1(C)CC1(O)CC#N,0.2961
NC(=O)C1C2CCOC12,0.2628
CN1C2C3NC2C13C#N,0.2394
COC1C2(C)CC1(O)C2,0.3208
CN1C2C(CC12C)C#N,0.2811
CC(=O)C(=O)C=O,0.134
C1C(CO1)(C(=O)C=O)O,0.1546
CC1CC11CC2(O)CC12,0.3183
C1C2C1C1C3OC1C23,0.3173
CC(C)C12CCC1OC2,0.3016
OC1CNC(=N)C(=O)C1,0.1744
CC(CO)C12CC(C1)O2,0.3079
CCCOC(C)CCC,0.3339
C1C2OC2C2=NC=NN12,0.248
NC1=CNN=NC1=N,0.1609
CC1OC=NC(C)C1C,0.2689
CCc1ccccc1,0.241
OC(CCC1CC1)C#N,0.296
CC12CC1C1OC21C#C,0.2381
CC1(O)CC2(CC2)C1=O,0.2023
CCC1(C)C2CC1OC2,0.3177
C1CC(=O)CC1=NO,0.2177
CCCc1cnon1,0.2565
CC12C=CCN3C1CC23,0.2279
CC12OC3C(O1)C3C2=O,0.202
CC1CC2(O)CC2CO1,0.3233
OC1CC2OC3C2C13,0.3122
C#CC12CC3C4C3C1C24,0.2741
CNC(CC1CN1)C#N,0.271
OC1CCC=C1NC=O,0.2147
CCC12OC3C(C13)C2O,0.3073
CC(O)CC1=NOC=C1,0.253
CCC1OCCC11CO1,0.322
Cc1ccnc(c1)O,0.2159
ON=C1C2CCCC1O2,0.2536
O=C1C2NC2CC11CC1,0.2146
C#CC12CC3CC(C1)N23,0.2506
CC12C3N1C1C=C3C=C21,0.1418
O=CC12C3CC4C(C14)C23,0.2182
Cc1c(cc[nH]1)C#N,0.2231
CC1OC1(CCO)C#N,0.2816
CN1C2C=CC(O)C12C,0.2181
OC1COC1C#C,0.2759
CC1OC1C1(CC1)C=O,0.2214
CC12OCC1OC2C#N,0.2618
CN=C1OC(=O)OC=N1,0.2154
CC(C)(C(=O)N)C(=O)N,0.2494
OC12C3C4C3C1(C#N)C24,0.2592
c1c(c(no1)N)N2CC2,0.2257
CC(C)n1cnnc1,0.2688
CC1(CCC1O)OC=O,0.2728
CC#CC12C3CC1OC23,0.2522
C1C2OC3C4C=C1C2C34,0.2013
OC1=COC(=O)OC1=N,0.1988
CC1(COC(=O)O1)C#C,0.299
O=C1CCCCN2CC12,0.2037
CCC1C2CCCC12O,0.3202
CC1NC11CC2OC12,0.3158
OC1CC2CC1OC2=N,0.2834
C(CC#N)COCC=O,0.2295
C1OC2C=CCC3NC123,0.2511
OCC1N2CC1(O)CC2,0.2961
O=C1C=CC2NC12C#N,0.1781
O=C1C(CC11CC1)C#N,0.2172
CC#CC(C=O)C(C)O,0.208
CC1C=CC2OC12CO,0.2446
CC1(O)CC1(N)C#N,0.2792
CCC1CC(C=O)C1C,0.2223
CC#CC(=O)CCC#C,0.204
CC1CC=C(C#N)C1O,0.2207
c1c(nn[nH]1)NCCO,0.2092
CCn1nc(c(n1)O)O,0.2145
CC1(O)CC2OCC12,0.3104
COCC#CC(N)C#N,0.2673
CC(=O)C12CC(O1)C2O,0.218
CCC1OC(=N)C=C1N,0.2132
COC12COC1CC2=O,0.1972
CC12CCC1C(=O)N2,0.2696
CC1C2CC2N(C)C1=O,0.2574
C1C2NC22COCOC12,0.3287
C(=O)C(C#N)(C#N)O,0.2285
CC1=CC(NC1=O)C=O,0.2033
CC1C2C(NC12C)C#N,0.2482
CN(C=O)C(=O)C#N,0.1984
CC1C2CC3C2C13C#N,0.2894
ON=C1C2CC2(O)C1O,0.2344
C1CC(=O)NC=C1CO,0.2095
COC(CO)C(C)(C)C,0.3132
OCC1C(O)CC1C#N,0.289
CCC1NCCOC1=O,0.2526
OC1CC(O)C(=O)C1O,0.2231
c1cn(cn1)CC2CC2,0.2523
C1C2C3CC4C2C1C34,0.3561
CN(CC=O)CC1CO1,0.2036
CC12COC3C(OC1)C23,0.3038
OCCCC12CN(C1)C2,0.3009
CC1CC2OC2C(=O)C1,0.2175
N=C1OC(=O)N=CC=N1,0.172
CC12CN3C4C(CC14)C23,0.2963
c1cc([nH]c(=O)c1)CO,0.1766
CCC#CC1C2CCC12,0.2819
CCOCC1(CCC1)C,0.3315
CN(C)C(=O)C(O)C#C,0.2637
CN1C2CC1(C=O)C=C2,0.1858
CC1C2COC(C)C12,0.3246
CC(C)C(=O)NC(C)C,0.2769
CC1CC2=CNC(=O)N12,0.227
CC(C)C1=CC(=O)NC1,0.2175
COCC1C2CC1(C)O2,0.3109
c1c(cn(n1)C=O)N,0.1777
[NH3+]CC1=C([N-]N=N1)C#N,0.2396
NC1=NC(=N)ON=C1F,0.1662
C1C2C3C4OC1C4N23,0.2948
CN1CC2(C)CC12C#N,0.2377
CCC1CCC2OCC12,0.3187
O=CCC1=CCN2CC12,0.1903
N=C1CC2=C(N1)OC=N2,0.207
OCCC1C2OCC12O,0.2871
C(=O)C(=O)C#CC#N,0.1394
COC12CC3C1N3C2=O,0.2309
CC12CC1C1(CCO1)C2,0.3165
C1C2CN3C=CN=C3N12,0.2383
CC1(CO)C2CC2C1=O,0.2242
CC1C(O)C1(C)CC=O,0.2198
CCC1C2N1CC2(C)O,0.2905
CC1C2C3N1C2C3(C)C,0.3082
O=C1C2NC1(C=C2)C#C,0.2342
CCC1CC(C)(C)CO1,0.3141
CC1CC2CN2CC1O,0.277
N=C1OCC2CC3C2C13,0.2725
CC1C2N1CC1NC21C,0.2915
CC1CC2COCC1O2,0.3111
CCn1c(=NC)[nH]nn1,0.1942
CCCOCC=O,0.2293
CC12NC1CCC1NC21,0.2957
CCC1=CC2COC1O2,0.2443
CC12CCCC(N1)C2=O,0.2233
CC1C2C3C=CC2C13O,0.2256
CC1CC2(CC=O)CC12,0.2192
C#CCCOCC1CN1,0.3001
CC1(O)CC(C)(C1)C#C,0.3056
C1OC2C3C4N3C2C4=C1,0.1989
COC12CC1CC2(C)C,0.3097
CC(CC(C)=O)OC=N,0.2307
OCC1COC(=O)C1=O,0.1692
COC1CCC1C=O,0.2264
CC1(CC#N)OCC=C1,0.2481
CC1N(C)C(=O)C=C1N,0.2148
CC1=CC2(CC2)C(=O)N1,0.2054
CC1(O)C2CC3CC3C12,0.3169
CC1=CC(=O)OCC1O,0.2163
O=C1COC2OCCC12,0.2157
CNc1ccc([nH]1)C#C,0.1834
CC#CCC(=O)CCO,0.2276
O=C(C1CO1)C1CCO1,0.203
CC12OC1CCCC2=O,0.2179
CCC12CC1C1NC21,0.2821
N=COCC(=O)C1CC1,0.221
[NH3+]C1(C2CCC12)C([O-])=O,0.2677
Cc1c(c[nH]c1CO)N,0.2168
OC1CC11C2OC1C2O,0.2973
CN=C(C(=O)CO)N,0.1855
OCC1(CO)OC1C#N,0.2601
CC12CC1OC(=N)CN2,0.2469
CC1CC2C3C2C2C3C12,0.2872
CC(CO)C1(CC1)C#C,0.2925
COC1CC(O)(C1)C#N,0.2739
OCC1CC(CC#C)O1,0.2943
OCC1(O)CC1CC#N,0.304
O=C1NC(CO1)C1CN1,0.3059
CC1C(C1(C)C)(C)C,0.3255
OC(CC#C)C1COC1,0.2908
CC(=O)CC(=O)OC,0.2277
COC(C)C1(CC1)OC,0.329
CC1COCCC2CN12,0.3048
C(C#N)c1[nH]nc(n1)N,0.227
C#CC1=CCC2OC12,0.201
Cc1nc(=NC)nco1,0.2061
NC(=O)C1C(O)CC1=O,0.2167
CCCCN=C(C#N)N,0.2175
OC1C2CC(O)(C#N)C12,0.2899
OCC1OC11CCC1,0.3244
CC(=O)C1(O)C2CC1C2,0.223
Cc1c(onn1)OC,0.2116
NC1=C(F)C(=N)OC=C1,0.167
CCNC(=O)COC=N,0.2544
CCC[NH2+]C(C)C([O-])=O,0.2661
CC(=O)N1CCN=C1N,0.2131
O=C1C2C3NC1(C#N)C23,0.2242
CC1=CC2(C)CCC2C1,0.2576
OC12CC=CC1C1NC21,0.2596
O=CCCN1CC1C#N,0.228
OCCC(O)(C=O)C#C,0.2145
c1nc(c(o1)N)NC=O,0.1937
O=CC1OC2CC1C2=O,0.1955
C(c1c(oc(n1)O)N)O,0.2228
CN=COC(C=O)C#C,0.2021
CC1CN2C1=COC2=N,0.2122
CC1N2C3CC1(C)C23,0.3132
C#CC12C3CC1OC2C3,0.2761
CCC1(O)C2CC1(C)O2,0.3311
CC#Cc1c([nH]cn1)O,0.2183
CC1C2CC(CC12)C#N,0.3159
CC1CC2CC11CCC21,0.3124
OC1CC2CCCC2=C1,0.2487
CC1=CC2(CN2)CC1O,0.2352
CC(C)(C)O,0.3265
CCC1CN(C=O)C1C,0.2647
CCC1NC1C(=O)CC,0.2233
OC1(CC1)C1NC1C#N,0.261
O=C1CC2CCCC12,0.2156
NC(C#N)C1(CO)CC1,0.2757
c1c2ncnnn2cn1,0.1367
O=C1OC2CC1COC2,0.2736
CC(C)C(=NO)C(C)O,0.2511
CC12CC3C(=O)C1C23C,0.2431
CCCC1CC(C1)C=O,0.2263
CC12CCOC11CN2C1,0.2944
COc1c(ocn1)CO,0.2116
CC1=CC(=N)OC=C1N,0.1542
O=CCC1CCC2OC12,0.2259
CCC12C3C4C(N14)C23O,0.2672
OCC12CCC1N=CO2,0.262
COC(=O)C(C)C#C,0.2637
COC12C3CC(C13)C2C,0.3165
NC(=O)CC1CN1C=O,0.2537
CC1NC(=O)C2(C)NC12,0.2572
CC1CC23CC(C2)C3O1,0.3372
CN1CC(O)(C1)C1CN1,0.2994
CCC12CC(=O)C1(C)N2,0.219
N#CC12CC3(CN3)C1O2,0.2566
N=COCCNC=O,0.2418
CC1(CCCC1)CC=O,0.2251
CC1C2C3CC1(O)C23C,0.3007
[NH2+]=C1O[CH-]C(=O)C=C1,0.1111
Cc1coc2c1NCC2,0.2078
CC1N2CCC12C#N,0.2529
CC#CCc1cc[nH]c1,0.2504
CCC1(O)CNC1C#N,0.2666
N#CC12NC(C=C1)C=C2,0.1999
OCC1OC2CC1C=C2,0.2374
CC1CCOC(CO)C1,0.3375
CCC#CC1(CN1)C#C,0.251
OC1C2CC(C=O)C1O2,0.2014
CC12CC1(O)C(=N)OC2,0.2603
CC1C(O)C1OCC#C,0.2522
CC(CO)C1=NNC=N1,0.268
O=CNC1CCOC1,0.2775
COCC1(C)CC(C)O1,0.3207
CCc1cnc(cn1)N,0.1823
CC1C2CC3C2CC13O,0.3285
COC1CC1(C)C1CO1,0.3236
Cn1c(cc(n1)C#N)O,0.221
C(C(=N)NC(=N)C#N)O,0.1913
CC(O)COC=O,0.2851
CC(CO)C1(O)COC1,0.307
CC1OCC2(O)CC12,0.3187
OCC1CN1C1COC1,0.2835
CN1C2C(CO)CC12C,0.3019
NC1CC2OC12C#N,0.2456
CC1(C=O)C2C3OC1C23,0.214
CC12OCC1(O)C1CC21,0.3026
C1CC(C1)CCN2CC2,0.3172
O=CC1(CN1)C(=O)C#C,0.1915
Cn1cncc1C=O,0.1899
CC12CCC1C=CCO2,0.2613
OC1CCC=C1C#C,0.2107
CC(O)CC(C)(O)C#C,0.3027
CCc1cc(c(o1)N)O,0.2097
CC(C)(C#C)C1CC1,0.317
OCC12C3CC4C1N4C23,0.2799
C(=O)NC(=N)C(=O)N,0.2043
N=C1OCC2CC3C2N13,0.2712
CC1C2OCC12OC=N,0.2574
CC12C3C4CC(C14)C23O,0.3048
CC1C2CC1OC(=N)C2,0.2735
CC1OC1(C)C(=O)CO,0.2229
CC(=O)Cc1cnno1,0.2324
CC1C2OC(CO)C12,0.3079
C1CC2C1C21CC=CC1,0.2639
C1CNc2c1n[nH]c2O,0.2288
C1OC11COCC2OC12,0.3209
CCC1(CCO)CN1C,0.3072
CC12CC3C4C(O1)C2N34,0.2976
O=CC1C=CC(=O)C1=O,0.1403
CC1(O)C(CO)OC1=N,0.283
OC1C2OC2CC11CC1,0.3274
OC1COC1(C=O)C=O,0.1814
CC1N(C)C(=O)OC1=N,0.2576
OCC1(O)CC1CC=O,0.2154
CC1(C)OC1COC=N,0.2819
C1C(=NO)C(=O)NC=N1,0.1941
CC#CC1(CO1)C1CN1,0.2671
CC1(O)CC=CNC1=O,0.2132
C1CC2CC1COC2,0.3235
CN1CC1C1CCC=C1,0.2424
Cc1cncnc1O,0.229
COC1OC=NC1CO,0.2639
C#CC1OC2C(C#N)C12,0.2652
CC(=O)C1OCC1C#N,0.2182
CCC1C2C3C1CC23C,0.3297
CC(O)C1C2CC(=O)C12,0.231
c1c(nc[nH]c1=O)C#N,0.1784
CC#CC12NC1CC=C2,0.2274
C#CC(=NO)CO,0.2056
ON=C1CC=CC11CO1,0.2258
CC1CC2CC=CC1O2,0.2559
CC1(CO1)C(O)CO,0.3322
O=C1CC2(NC12)C#N,0.2155
CCC(C)(C)CO,0.3344
CCC(O)C1CCC1=O,0.2203
CC1CC1C(C#C)C#N,0.2981
O=C1CC(N1)C1CN1,0.2708
CC(C)C1OC(=N)C1C,0.2881
C1CC2C3OC(=N1)C23,0.2036
C1CC(O1)C1=NCCO1,0.2566
CC1N2CC1(C)C2C#N,0.255
CCOC1CCC1O,0.3256
CC12C3CC1(OC23)C#N,0.2479
NC1=NCC2OC12C=O,0.1782
OC1C2CCC1(O)CO2,0.296
CC12CCC1=CCOC2,0.2566
OC12CN3CC(=CC1)C23,0.2017
O=CN1CCC2NC2C1,0.272
CC(O)C[NH2+]CC([O-])=O,0.269
CC1CC23CC(C2)OC13,0.3152
CNC(=O)C1(CC1)C#N,0.2734
CC1COC2=NCCC12,0.2736
CN(C)C1(CC1O)C=O,0.1974
CN1C=NCC1C#N,0.234
CC1OCC1C(=O)CO,0.2181
CC1COC2COC1C2,0.3196
C1CC2C3COCC23O1,0.3194
CCC1CCOCOC1,0.3318
C1CC2CC=CC22OC12,0.2425
NC1(CC2CCC12)C#N,0.2908
O=CC#CC1CC(=O)N1,0.1919
CC1CN1CC1CCC1,0.31
c1c(cc(oc1=O)F)F,0.1894
c1cc([nH]c1C=O)O,0.1746
CCOCC1(C)NC1C,0.3195
CCC12CC=CC1O2,0.2464
c1c[nH]nc1C(=O)C#N,0.1941
CC1C(C)C1(C)C(C)=O,0.2312
OC1CNCC(=O)C1O,0.188
Cc1nc(c(o1)NC)O,0.2029
CCCC1(CN1)C#C,0.2869
CC1CC2OC12C1CC1,0.3224
CN1CC2CC(=O)C12,0.1791
NC12CC1COC2C#N,0.2663
O=C1NCC11CC2OC12,0.2669
CC1CC11N=COC1C,0.2492
COCC1=CCCC1=O,0.1994
CC1C(C)C1(O)C#C,0.2693
CC#CCC1CC1(C)C,0.3013
CCC1C2C=CC(C)C12,0.242
CC1(CC(=O)CN1)C#N,0.2079
C1CCCC2OC2CC1,0.3293
CC12C=CC(C1O)C2O,0.2397
CC12CCC(=NO)C1O2,0.2433
C1NC23C=CC4C2NC134,0.203
CCC1CC2CC(C2)O1,0.318
OC12CC1OCC2C#N,0.2725
C#Cc1cc(=O)[nH]nc1,0.1635
O=C1CCCC2CC1O2,0.213
CC(O)CNC=O,0.2821
CC(=NC1COC1)OC,0.2599
c1c(onn1)COC=O,0.2336
C#CC1C2CC3(CC3)N12,0.2609
CC1CC2OC(C)C1O2,0.3181
CC1(O)COC2C(O)C12,0.3043
CCC1(C)OC1C(C)O,0.3382
OC12CC3(O)C4C1C2C34,0.28
O=CC1OC1CC#C,0.2178
c1coc(c1C=O)C=O,0.1707
CC1(C#C)C2CC3C2N13,0.2821
CC1C(C)N1C1CC1,0.2974
CC1NC(=O)NC=C1,0.2249
c1c[nH]nc(c1=NO)N,0.1673
CC1CCC11C2CC1C2,0.3588
CC1(CCOC=O)CO1,0.2881
CC(C)(COC=N)C#N,0.2845
CC1OCC2=C1C=NN2,0.2474
CC1OCCC(=C1)C#C,0.2111
N=C1CCC=CC(=O)N1,0.2007
CC(=NO)CC#CCO,0.2545
O=CCNC1C2COC12,0.2025
CCN=c1cncno1,0.1597
CCC1(CCCO)CO1,0.339
C1CC2C1C1C3OC3C21,0.3101
CCC1COC1(C)C#C,0.2773
Cc1cc2c([nH]1)C=CC2,0.1746
CCC(CCO)NC=O,0.281
CC(C)CC(N)C#N,0.2964
C1C2C3OC4CC(C34)N12,0.2871
c1c2c([nH]n1)C=CCO2,0.1695
CC1N(C)C1(C)C1CC1,0.2939
C1OC23CN(CCC2)C13,0.2523
O=CC1CC11CC(=O)O1,0.2254
CN1C2COC2C1C#N,0.2505
COC1C=CC(O)C1=O,0.2226
CC1C(C)C2(CC2)C1=O,0.2151
NC1CN2CC1(C2)C#N,0.2636
OC12CC(C1)C(=O)C=C2,0.186
N#CCC12CC=CC1N2,0.2374
NC(=[NH2+])C(CC#N)=N[O-],0.1398
CNc1ccno1,0.224
CC(O)C(C)C(O)C#N,0.3022
CC12C3N1C1CC3=CC21,0.2246
Cc1cc(c(nc1)F)F,0.216
N=C1OC2CCC1NC2,0.2591
OC12C3NC1C3C2C#C,0.2803
CCOC1CC(=O)C1O,0.2078
CN(C=N)C(=O)CC#C,0.2357
CC12CC1CC(=O)O2,0.2783
CN=COCC1CC1C,0.2724
CC1=C(C)C2OC3C2C13,0.2263
CC(C=O)N1CC1C=O,0.2033
C(COC(C#N)C#N)O,0.2441
CC1=C(N)N=NNC1=N,0.1527
CC1(O)CC2CCC1C2,0.3276
CC1OC1(C)CCC#C,0.3112
C1C2CC3OC4C3C4N12,0.2859
CC1C(O)C(=O)CN1C,0.1841
c1nnn(n1)CC=O,0.2263
CC(C)CC12CCC1O2,0.3234
CC1C2OCC1(O)C2C,0.2953
CC1CN2C1=CC=C2N,0.228
CC1C2C3(C)CN3C12C,0.2868
CCOC(=N)C(N)C#C,0.2587
CC1(C)C2OCCC12O,0.2959
C#CC1COCO1,0.2881
CCC1=CC2OC3C2C13,0.2274
OC1CC2(OC12)C1CO1,0.3065
CC1CC(C)(C)C2CN12,0.3055
CCN(C=O)C(=O)CN,0.2116
CC12CC=CC1=CCO2,0.1951
O=CC1=NCC2CC2O1,0.1963
CCC#CCOC=NC,0.2664
CC(O)C1(C)CNC1=O,0.2755
CC(=O)Nc1ccc[nH]1,0.1978
c1c(con1)C2(CC2)O,0.2341
COCC1CC1C=O,0.2288
OCC1(CC(O)C1)C#C,0.2935
O=CC1OC2CCC2O1,0.2082
CC(C)N(C)C(=N)C#N,0.1979
OC1C2CC3C(N23)C1=O,0.2206
OC1C2NC2C1OC=O,0.2669
N#CC12COC3C(O1)C23,0.2328
CCC12C3OC1C(=O)C23,0.2244
C1NC2C1N1C=CN=C21,0.2405
N#CCC1CN=CO1,0.2735
CC(C#N)N1CCC1,0.2676
O=C1NC2CCC12,0.2714
OCC12CCC1C(=O)C2,0.2179
CC12CC3(C)CN1C23C,0.305
Cn1c(nc(n1)C=O)O,0.1999
COC12CN(C1)CC2O,0.3028
CCC1C2CC1C1OC21,0.3425
CC1(C=CCC(=O)N1)C,0.25
CCCC1NC1(C)CO,0.3048
O=CC12CC1CC=C2,0.2222
CC(=O)C1CC=CC1=O,0.1913
CC([N-]C(=O)C[NH3+])C#N,0.2708
CC1C2COCCC12O,0.316
CC(O)C1=NC2CC2O1,0.2629
CCc1cc(n[nH]1)C,0.2583
CC12C3NC(=CC1=O)C23,0.1533
CCCC12OCC1C2O,0.2951
CCC1C2C3CC1N23,0.3118
OC(CC=O)C(O)C#C,0.2235
OC1CCC2NC12C#N,0.2722
CC1=CCCOCC1=O,0.1869
N#CC12CC3CC1CC23,0.3063
COC12C3OC1C(C)C23,0.3036
Cc1c[nH]cc1CC=O,0.1946
C#CC1=CCCOC1,0.213
CC12CC1(CC2)C=O,0.2177
c1cncnc1,0.2116
CC1C(=O)CC=C1C=O,0.1811
CC1(NC1CC#N)C=O,0.2254
NC(=O)C12COC1CN2,0.2458
CC12CC1CC1COC21,0.3143
CC#CC1=CC2OC2C1,0.1945
CC1CCCN1C=O,0.2655
CC12CC3(C1)N=COC23,0.2581
N=COC1CC1CC=O,0.2272
Cc1cnn2c1CCC2,0.252
C1CC(C1)C(=O)CC#N,0.2271
CCC1=NC(=N)C=NN1,0.1839
Cc1c2c([nH]n1)nc[nH]2,0.2195
CC(C)COC1CCC1,0.3298
CC1=CC(C#C)C2NC12,0.2433
CNc1ccc([nH]1)C=O,0.1634
CCC1(C#N)C2CC1C2,0.3263
CC#Cc1cc(n[nH]1)N,0.1938
CCC(C)CNC(N)=O,0.3008
CC1COC(=O)C(N)C1,0.2489
OC1CN2C3CC3N=C12,0.2281
Cc1c(c[nH]c1C#C)O,0.1901
CC(C)NC1COC1=N,0.2551
Cc1c(cno1)C#C,0.2152
Cc1c2c(no1)NCC2,0.225
NC(=O)C1COC(=N)O1,0.2645
N=COCC#CC#C,0.2218
C1C2C3COC1C1C3N21,0.3186
Cc1c2c(no1)OCO2,0.2272
C1CC1(CCO)N2CC2,0.2986
CC1(CC2(CC2)C=C1)C,0.2469
CNc1cccnc1F,0.1936
COCC1(CO1)C#N,0.2794
CC1OC2CCC1C2C,0.314
CC(=O)NCCC#C,0.2742
CCC12CC(C1)NC2=O,0.258
CCOCC(C)CCO,0.3297
CNC(CCC#C)C#N,0.2684
CC(=O)CC(C)(C)CO,0.2267
O=C1NC2C1CNC2=O,0.2514
CCC(O)C(O)C=O,0.2252
CC12CC3C(CN13)OC2,0.2998
OC1C2CC1(C2)C1CC1,0.3229
C1OC2C3CCC12C=C3,0.256
c1c(ncn1C(=O)N)O,0.1885
CC1=C(C#C)C2OC2C1,0.1972
NC(=O)C1=NOC(=N)O1,0.1978
CN1C2CC1C2CC#N,0.2504
NC1C(CO)OC1C#N,0.252
O=C1CCC2CNC=C12,0.172
CC12CC=CC1CC2O,0.2578
C1C2CC3C4C2C1N34,0.3004
O=C1NC2C3OC12C=C3,0.2125
c1ccnc(c1)OC=O,0.2185
Cc1c(noc(=O)n1)N,0.1612
OC1C2OC3CC1CC23,0.3132
OCC1(C=O)C2CC1C2,0.2091
CC12C3CC1C(O)C23O,0.2773
CC12CC1C1NC21,0.2855
CC(O)(C=O)C#CCO,0.2129
[NH3+]CC1=C([O-])OC(=O)O1,0.1893
O=C1C2COC3CC2C13,0.2245
C1OCC2OC3C1C3O2,0.3074
CC1(O)C2CC2OC1=N,0.2701
N#CC12CCCC1N2,0.2934
N=C1OCC2(NC12)C=O,0.2135
c1c(nc([nH]1)N(=O)=O)N,0.1364
c1cc(oc1)OC=O,0.2206
CC12CC1C=CC21CN1,0.2362
C1C(=CC(=O)C(=O)N1)N,0.1741
COC1(C)CC2CC1C2,0.3305
CC1C2C3NC3(C)C12O,0.3159
CC1(C)CN2C3CC1C23,0.3133
CC12CC(C)(CC1)C2=O,0.2266
COc1c(con1)C#N,0.2295
Cc1c(c(cn1C)N)O,0.2213
CC1(C)CCC2CC1O2,0.3113
c1cnc(c(c1O)O)O,0.2184
N#CC1C2COC1CO2,0.2887
OCC1(CC1C#N)C#C,0.2712
CC1OC2C(O)C2C1O,0.3121
c1coc(=O)[nH]1,0.2422
CCC1OC2CC1C2,0.3295
N=C1OC2CCC1OC2,0.2776
CC(=O)C1C2OC1C2=O,0.2241
CC(CO)(C#C)N1CC1,0.2867
CCOC(=N)C1CC1,0.2825
CC12C3N=CN(C13)C2=O,0.2062
Cc1cc([nH]c1)C=O,0.1812
CCC(O)COC1CC1,0.3045
O=CC1CN2C(C#C)C12,0.2107
CC1OC(C)C1=NO,0.2438
CC(=NC)OC(=O)C,0.2582
OC1CC1C1CCO1,0.2929
C1CC2C3OC3C12,0.3253
CC(N)C(N)(CN)C#N,0.261
CC(=O)C(=O)NC,0.1795
N=C1OC2(COC12)C#N,0.256
CC1CC2(C1)NCC2=O,0.2117
COC(C#C)C1CC1C,0.2985
c1coc(n1)CC=O,0.2106
CC1OC2C3NC3C2=C1,0.2242
Cc1nc(on1)C=O,0.1901
CC12CCCC1C(=N)O2,0.2876
CC1(CC1)COCC=O,0.2289
COC1C2NC2C=C1C,0.2338
O=CC1OCCC1C#C,0.218
CC[NH2+]CC(C=O)=N[O-],0.1593
CC1CN1C1=NC=CN1,0.2398
O=CNC(=O)C1CN1,0.219
OC1CC2CC(O)C1C2,0.2996
CC1C2CC1C2C(N)=O,0.2666
CC(O)C1=CNC(O)=N1,0.2526
CN1C(C#N)C1C(N)=O,0.2476
CC(C)(O)C1CC1(C)C,0.3204
OC12C(OC1=O)C2C#N,0.2531
C#CC12CC(C#N)C1N2,0.2648
O=C1NC2C3NC3C12,0.2564
CN1CCC11C2CC1O2,0.2885
CC(=O)C1CC1NC=O,0.2112
C#CC1NC1C1CCO1,0.2708
CC(C1CC1)C1CC1O,0.3316
c1c(nnc(n1)F)N,0.1686
NC(=O)CC1CC2CC12,0.2766
CC12NCC1=CNC2=O,0.1944
CC1CC2(O)C3CC2N13,0.297
OCCC1CCCCO1,0.3247
N#CC1C2CC3CC3C12,0.2862
CC(=O)C1=CCCOC1,0.1957
Cc1ncn(n1)C,0.2646
CN=C1OC2CC12C#N,0.2651
OCC12CN1CC=C2,0.2337
CC(=O)C(=O)C1(CC1)C,0.1651
COCC1C2CCCN12,0.2949
O=C(C1CN1)N1CC1,0.2454
C#CC1OC=NC1C#C,0.2676
OC1C2C3CC4C(C23)C14,0.3071
CCCC(CC=O)C#N,0.2255
NC1(C#N)C2C3CC2C13,0.2947
CC#CC12CC1CCO2,0.2619
C1NC11C2C3C4C2C1N34,0.2985
C1C(=CNC1=O)CCO,0.2096
CC12CC=CC(N1)C2=O,0.2142
COCC1(C)NC1C=O,0.22
OC1CCC11COC1,0.3035
COCC1CC1OC=N,0.2703
CC1(CN1C2CCC2)C,0.2993
NC(=O)C12CC1NC=N2,0.2382
c1nnn(n1)C(=O)C=O,0.1628
CC(C)CCC#CC#N,0.2458
COC1CC2CC1C2C,0.3388
OCC12CCCC1C2O,0.3122
Cn1cc2c(n1)nco2,0.2166
CC12C3C4CCC1C4N23,0.3144
C1CC1C1CC2CCC12,0.3375
CC1N2C=CC(=O)C12C,0.1857
OC12CC1NC21COC1,0.2736
c1c(nc(o1)O)N2CC2,0.2427
CC(C)Nc1n[nH]nn1,0.2046
CC12OC1C=CC21CO1,0.232
N=C1COC(=N)CO1,0.2643
CC1C2CC3C2C=CC13,0.2445
CC1(O)CC(CO)C1O,0.3151
c1[nH]nc(n1)C#CCO,0.2226
C1Oc2c(non2)O1,0.2243
CC1CCOC(=N)C1C,0.2779
CCCC1OC2CCC12,0.3168
OC1CC2OC(C1)C2=O,0.2271
Cc1cncc(=O)o1,0.169
CC1NC(=N)C1(O)C=O,0.2118
CC(C#N)C(=O)N(C)C,0.2574
CC(C)C1CC1,0.3665
FC(F)(F)C12CC1CC2,0.3596
N=C1C=CON=NC1=N,0.1437
OCC1CC2OCC12O,0.3021
CC1(O)CC1CCCO,0.324
C1OC2C1C1OCC21,0.3034
CCC(NCC#N)C#C,0.2597
CCCC1(CC1)OCC,0.3257
C1CC1N=C(C(=O)N)N,0.2006
CC1CC23CC(C)(O2)C13,0.2988
Cc1n[nH]c2n1cnn2,0.2114
C1OC=NC11CC=CC1,0.2643
CC1(C)OC1(C)C1CC1,0.343
OCC(NCC=O)C#N,0.2192
Cc1[nH]c(=O)nc(n1)C,0.2029
CC1CCC2=C1NN=C2,0.2474
c1cn(cn1)C=O,0.1969
C1C2(COC2)C11CCO1,0.2943
CC(O)C(CC#C)C=O,0.228
OC12CCC(C1)C(=O)C2,0.2228
COC=NCC1(C)CN1,0.2635
CC12CC3C(O1)C(O)C23,0.3117
CC1CN1C(CO)CO,0.3129
CCC1CC1N1CC1C,0.3099
CC(O)C(CC#C)C#C,0.2923
c1(c(nnoc1=O)O)N,0.1487
C#CC12NC1C1CC2C1,0.2566
OC12CC1OCOC2,0.316
CC(O)C1N=CNC1=O,0.2292
CC#CC1CC2(CO2)C1,0.2961
COC1CC23CC(O2)C13,0.2876
OC1CC11NC2COC12,0.2802
CN1CC2(C1)COCO2,0.2892
CC1(C=CC(=O)O1)C,0.2235
CC12NC1(C=O)C1OC21,0.218
CCC(=O)C1CC(O)C1,0.2184
OCC1C2C(O)C(=O)N12,0.2214
CC12C=CC3(O)C1CC23,0.226
N#CCNC1CCOC1,0.2729
C1C2CC3(COC3)CC12,0.3113
c1c(nc(o1)C#N)CO,0.2003
C1COCC(=O)NC=C1,0.2218
O=CC12CC(=O)C1N2,0.1993
O=C1CC2(CO2)C2CC12,0.2266
OC1CC2OC3CC3C12,0.2903
c1nc(nnn1)O,0.1675
C1OC11CC2OC2C=C1,0.2311
O=CC1CC2(OC12)C#C,0.21
CCC12OC(C)C1C2O,0.2984
CN1CC2CC12C=O,0.1959
C1CN(C1=O)CCO,0.2771
CC1=C(C#C)C2CC1O2,0.1888
CN=C1OC(C)C2OC12,0.2565
CC1(C#C)N2CC2C1=O,0.2101
N=C1OC2C3NC12C=C3,0.2054
CC(O)C1CC2NC2C1,0.3071
O=CC12CC1CCC2,0.2313
CCn1ccc(c1)C=O,0.2021
CC#CC12CC(C1)C=C2,0.2379
CC1OC1C1CC(O)C1,0.3289
CC1(C)CCC2CCC12,0.3523
CC#CC1(O)C2COC12,0.2527
CC#CC1=NCCO1,0.2174
CC1(CC2OC12)C1CC1,0.3333
CC(C=O)C1C2CN1C2,0.2151
CC1C=C(C)CC2CC12,0.2581
C#CC(C#C)C1CCO1,0.2772
CC1(CNC1=O)C,0.2823
C(C#N)N=C(N)NC=O,0.2246
COC1C(O)CC1=O,0.1969
c1cc(cc(c1)N)N,0.2065
CC12COC1C(O)C2=O,0.1956
C#CC1N=CNC11CC1,0.2408
C1CC(=O)OCCOC1,0.2742
OC12CN3CC(C=C1)C23,0.2094
C1C=C(C(=O)C1=O)C#N,0.1392
CN=C1OCC1C#CC,0.2711
CC1OC23CN(C2C)C13,0.2553
O=CNC12CN(C1)C2,0.2596
c1c(ncc(n1)F)CO,0.2052
CCn1cnc(n1)CO,0.2569
CNc1c(onn1)C=O,0.1535
CC1(C)CC2CC2(O)C1,0.3016
C1CNC(=O)CC=C1,0.2468
CC1C(=O)NC2CC12C,0.2622
C1COCCC(=C1)C=O,0.1944
c1c(nc([nH]1)O)N2CC2,0.2501
NC(C#C)C1=NC=CO1,0.2428
CC#CC(N)(CN)C#N,0.2498
O=CNC12CC1C1CC21,0.244
O=C1C2C3C2N1C3C#C,0.2397
OC1C2CC1(O2)C1CO1,0.2946
CC(O)C1OC2COC12,0.3021
CCOC(C)C(F)(F)F,0.351
CCC#CCC1CCO1,0.2885
CC#CC(C)CC(C)C,0.2996
CC1(C)CC11CN2CC12,0.2955
CCN(C)C(C#C)C#N,0.2447
C1CC2OC2COC=N1,0.2651
Cc1cc(oc1N)C#C,0.1777
CC1(C)OC(=O)C1(C)N,0.2681
CC12C3OC3C1OC2=N,0.2826
CNc1cccc(c1)O,0.205
C1C2C1C1CCCC2O1,0.3137
OC1(C#N)C2CC1C=C2,0.2395
OCC1OC11COC1=O,0.2588
OC12CN(C1)C2CC#C,0.3009
CC1=CCC2(C)OC2C1,0.2634
COC1CC2CC=CC12,0.2614
CC(C)C1C2CC(O)C12,0.3192
CC12C3CC(C13)C2C#C,0.2885
CC(=O)C1C2CC1C2,0.2236
CC(O)C1OCC=C1C,0.2471
CC12OCC1C1C(O)C21,0.3004
OC1=NOC(=O)OC1=N,0.2066
CC1(C)OC(=O)C2NC12,0.2529
CC1CC2(CC2O1)C=O,0.2272
CCC(C)(C)CC#C,0.3099
CC(=O)Nc1ccoc1,0.2163
CNc1cnc([nH]1)OC,0.2392
CCOCCC#CC#C,0.2305
CN=C1OC(C)=CC=N1,0.1581
CC1C(C2CN12)C(C)=O,0.2203
C#CCCCO,0.3158
OC1CN2C(CC12)C#C,0.251
CC1OC=NCCC=C1,0.251
CC1CC2C1C2(N)C#N,0.2969
OC12CC3C1C3(C2)C#C,0.2739
CC12CC(=O)CC1(C)N2,0.2259
OC1C(C=O)C1C1CN1,0.2169
CCOC1C2OC=NC12,0.2523
CC#CC1CC(O)C1C,0.2939
C1CC1CCCCC=O,0.2286
CC1=CC(O)C(=O)C1=O,0.141
CC1C(O)CCC1C#N,0.3141
CN(C)c1c[nH]nc1N,0.2214
CCC1C(NC1=O)C#C,0.2705
CC(=O)CC(O)CC=O,0.2134
C1CC2CN=C3OC1C23,0.243
O=C(C#CC#N)C1CO1,0.18
OC1(C=CCC1=O)C#C,0.2104
C1C2OC1C13CC(O1)C23,0.302
C1C=CCC2C3OC3C12,0.2605
CC1NC(CC1=O)C#N,0.2222
CCC1NC1CNC=O,0.2802
CCc1ccc(cc1)N,0.2024
C#CC1C2C3COC2C13,0.2852
C1C(=C(CO1)N)C(=O)N,0.1982
NC1=NC2C(O)CC2O1,0.2742
CC(C)C#CC(O)C=O,0.212
OC1CCC1CCC#C,0.3122
[O-]C(=O)C[NH2+]CCC=O,0.2203
CC12C3N1C1C3(O)C21O,0.2537
Cn1cc2c(n1)C=CC2,0.2033
CC(C)(C(C)(C)O)O,0.3242
COCCC(O)CC#C,0.298
CCC(O)C(=O)C#C,0.1984
CN=COC(C)C(C)O,0.2726
CC(O)C1C(O)CC1=O,0.2187
CC12C3C4C(C1N34)C2=O,0.2194
CC(C)C1CCOC1,0.318
CC1=C(C)C2(CN2)CC1,0.2375
CCC(C=O)C1CC1O,0.2046
C(CNC=O)C#CC#N,0.2295
CC(C)N=C(C(=O)C)N,0.1905
CCC1CCC=CC1O,0.2618
CCC12C(O)C1C1CC21,0.2729
COC(=O)C1CCO1,0.2439
OC12CCCC11CC2O1,0.2932
OC1CC1N1N=CC=N1,0.2267
CC1C2N1C(C)(C)C2=O,0.2117
OC1=CN=COC1=N,0.177
CC1=CCN(C(=O)C1)C,0.2538
CC1C2CC2C2OC12,0.334
OC1CC23NC4C2NC134,0.2652
O=C1CN2C3CC(N1)C23,0.2537
CC1C(CCO)CC1=O,0.221
O=CCC1(CN1)C=O,0.2148
COCC(=O)COC=N,0.2191
CC(N)(C#N)C(O)C#C,0.2615
CC1C(O)C1(CO)C#C,0.2852
OC1COCC(=O)C1,0.2144
OCC1=CCCCC1O,0.2561
CC12C3CC4OC(C13)C24,0.3099
c1c(nc(c(=O)[nH]1)N)F,0.1625
CC1COC(C)(C)O1,0.3333
CC1(C(=O)OC12CC2)C,0.2808
CC1=CCC(=O)N2CC12,0.2364
OC1C2OCC12C#C,0.262
COC1(C)CC1C(C)O,0.3253
CC1CC1C(C)(C)C#C,0.3102
CC1OC(=O)COC1=N,0.262
CC1CCOC(O1)C#C,0.2959
C1CN(C(=N1)N)C=O,0.2102
Cc1c(c([nH]c1C)N)C,0.2375
CC1(C#N)C2CC1C2,0.3282
C#CC(=NO)CN1CC1,0.1852
Cn1ccc2c1[nH]nn2,0.2133
CN(C=O)C12CN(C1)C2,0.2701
CC1C=CC2OC=NC12,0.2526
CN1CC11C2C3CC1C23,0.3181
N=C1OCC2(CC12)C#C,0.2613
NC12CN=C3NC1C23,0.1744
C1OC1C12CC1CC=C2,0.246
CC1CC2(CO2)CO1,0.3253
CCCC(O)(C=O)C#C,0.2147
C1OC11CCCCC=C1,0.2493
CC1(CO1)C1(CO1)C=O,0.217
CCN=C1OC2CC12C,0.2713
COC1(CC1)C1NC1C,0.3011
N#CC1COC2CCC12,0.2956
c1cc(n(c1O)C=O)O,0.1482
CC12NC1C=CC2C#N,0.2388
CNc1c(onn1)C#C,0.1593
CC12CC1CN=CO2,0.2716
c1coc(n1)NCCO,0.2315
c1cnc(=O)ncn1,0.1481
C#Cc1cnc(o1)C=O,0.164
CC1C(C=O)N1CC#N,0.2025
CC12CC1OC(=N2)C#C,0.2091
O=CN1C2CCC=CC12,0.2406
CC1CC2=CCOC12C,0.2331
Cc1cc(oc1)C(=O)C,0.1873
CCC1(CC1OC)C#C,0.2802
c1c([nH]nn1)CC(=O)N,0.247
c1cnc([nH]1)C2CC2,0.2433
OC1C2COC1C=CC2,0.2496
CNc1[nH]c(cn1)OC,0.2335
CCCc1cnccn1,0.1966
C1C2OCC11COCC21,0.3193
CC1CC1C1(C)OC1C,0.3378
COCCOC(C)C#N,0.2816
COCC1(O)CCC1=O,0.2054
C#CC1CC(O1)C1CC1,0.2766
CC1=CC2C3N2CC13C,0.2281
N=C1OC=NC=C1C#N,0.165
CC12CC3OC1(C)C23O,0.2813
C1OC1C1CCC=C1,0.2642
CC12CC1C(C2)N1CC1,0.3195
C1C2N1CC1=NOC=C21,0.2212
O=CC1=CNC2CC2C1,0.1865
CC1CC1C1=CC=CO1,0.2241
CC1C2CC(O)(C2)C1=O,0.2279
CCCCOC(C)C=O,0.2267
CC1C2C3C(N2C)C13C,0.2819
CCCN1C=CCC1=O,0.2081
Cc1cc(c(o1)N)N,0.2132
CCOC1C2C3NC3C12,0.2651
COC(=NCCO)C#N,0.2085
CC1CC2C1N2CC#N,0.285
C#CCN1CC2(C1)CN2,0.2591
CC1C(C)N1CC1CN1,0.3037
c1c[nH]nc(c1=O)N,0.1802
O=CC12CC(O1)C=CC2,0.2063
CCC(CC)N(C)C=O,0.272
CC12CC3C1CC23O,0.3317
C1C2C3C4C3C3C4C1N23,0.288
C(CC#CCO)CC#N,0.278
NC(=O)C1CCOC1=N,0.2574
OC1C2CC3=CCC1C23,0.2143
CC(C)(C#N)C(O)C=O,0.2308
CC(O)CC1NCC1=O,0.2148
OC1CC2CC1(C2)C#N,0.3092
CC(O)(CCC#N)C#C,0.2995
OC(CC#CC#C)C#N,0.2266
CCc1c(oc(n1)O)N,0.2397
CC1C(C)=CCC1(C)O,0.2611
CN=C1C(=O)NCCO1,0.2198
CC1CCC(C)(C)C1C,0.3546
C1OC2=NC3C4OC13C24,0.182
C#CC1CN2CC12C#C,0.2504
CN1N=CC=C(N)C1=N,0.1609
O=CCCN1C2CC1C2,0.2049
CCC(O)CN(C)C=O,0.266
CC1=CC2(CC2)C2OC12,0.2339
CCCC1(C)OC1C,0.3431
CC1(CO)N=CN2CC12,0.2397
CCC1C(C2CN2)N1C,0.2913
CN=C1OCC1(C)C=O,0.216
N=C1N=COC=C1C#C,0.1852
CC12NCC1OC2=O,0.2462
[NH3+]C1CC(O)C1C([O-])=O,0.2731
OC1C=CC2NC12,0.2378
C1OC1C1OC2CC1C2,0.324
CC12CC(O1)C(C2)C#C,0.2918
O=CC1CC=CCC1=O,0.2128
CC12CCC1(O)CO2,0.3004
OC1C2(CN2)CC11CN1,0.2971
CC1NC1(CO)C(C)=O,0.2321
CCCC(C)N1CC1,0.3187
CCCCC(=O)C(=N)N,0.1973
Cc1c[nH]c2c1OCC2,0.2205
N=CN1C(CC1=O)C=O,0.2056
OC1CN2CC12C#N,0.26
ON=C1COC1CC=O,0.2211
C1NC1C1=CN=CC=C1,0.2209
CC(=O)Nc1nc[nH]n1,0.233
CC1(CCN2CC2)CO1,0.3222
CC(=O)OCC1CN1,0.2519
CC1C2C3C2N2C3C12,0.2993
CCC12COC1C(O)C2,0.2965
CC1N2CC2C11CC1O,0.2958
OC1C2(O)CCC12O,0.2926
Cn1c(nc(n1)OC)N,0.2373
CCC1(O)CC=C(C)C1,0.2622
O=C1COC1CCC#N,0.2252
NC(CCCC#C)C#N,0.2901
O=C1CC2C3CC1CC23,0.2258
CC(C)(C=O)C#N,0.2257
CC1(C)NC11COC1=O,0.261
COC1C(OC)C1OC,0.299
CC12NC1C1OCC21O,0.2846
CCC(C)C1COC1,0.3136
O=CC12CC1(CN2)C#C,0.2054
CC12C3C4C(C4C1=O)C23,0.2087
CC1(C)OCC1C#N,0.2819
CCCC1CC(=O)N1,0.284
CC1C(C)N1CCC#C,0.275
CCC(C)(OC=O)C=O,0.2194
N=C1CN2C=CC=C2O1,0.1979
OC1CC2(O)CCCC12,0.3119
CC1OC(C)C(=N)O1,0.2904
O=CC1CC1(C#C)C#N,0.2154
OCC1CC(=O)N1C=O,0.2186
CCCCC(C)N1CC1,0.3184
OC1C2C3OC2(C#C)C13,0.246
OC1CC1C1NC1C=O,0.2213
CC1CC(=O)C(=O)N1,0.1726
OC12C3CC1=CCC2O3,0.2072
OC12C3OC3C1NC2=N,0.2551
OC12CCC1C1CN1C2,0.2947
CCC(C)C(N)=O,0.2774
OCC1C(O)C1C1CO1,0.3021
CC1=C(C)C2OC1C=C2,0.1987
N#CC1C2C=CC3C2N13,0.2296
CCC1C(O)C1CCO,0.2968
CC1C(=O)OCC11CO1,0.2713
C1CC1C1CCC2OC12,0.3398
OC1CN2CC3(CO3)C12,0.2682
OC1C2COC(=O)C12,0.2601
CC1C2OC(C)C(O)C12,0.2948
CN=COCC(=O)C#N,0.1646
Cn1ccc(c1C#N)O,0.2008
O=COCC12CCC1N2,0.279
CCn1ccc(c1N)C,0.2397
CNc1cocnc1=O,0.1743
O=C1OCCCN2CC12,0.2392
N=C1OCC1C#CC#C,0.2244
OC1CC2(O)CC12C#N,0.2609
CCCc1ncn(n1)C,0.263
Cc1ncc(o1)C(=O)C,0.1939
C#CC1CC11COC=N1,0.2409
c1cnoc1C#N,0.2156
CCC1OC23CC(C2)C13,0.3019
N=COC(=O)NC=O,0.2344
COC1C(C)C2COC12,0.29
CC1=CC2OC3C2OC13,0.2344
CNC1C(=O)COC1=N,0.1863
CC1(O)CC11CC=CC1,0.2645
N=C1NC=C(O1)C1CO1,0.2058
CC1OC2CC2(O1)C=O,0.221
CC1CC2CC2C1(C)C,0.3344
CC12CC3OC(C=C1)C23,0.2346
OC12CC(C3OC13)C2=O,0.2324
O=CC#CC1CCO1,0.2022
COC=NCC(=O)C#N,0.1888
ON=C1CC2CC2C1=O,0.1721
c1c[nH]c2c1c(no2)O,0.2304
CC1(CNC(=O)C1)C#N,0.2731
O=C1C2CC1(CC#N)N2,0.2504
CC1N=COC2CC1C2,0.2715
CCC12OC1C1NC21C,0.2757
OCC(O)C1CC1O,0.3138
OC12C3C4OC1C4C23O,0.2983
c1cnoc1NC(=O)N,0.2263
OC1CC2(CC#C)OC12,0.2942
COC(=O)c1cnc[nH]1,0.2098
Cc1cc2c(o1)CCN2,0.2015
NC1CCCC1(N)C#N,0.2723
CC12CC1(O)C1CCC21,0.3196
CCC1CCC(C)O1,0.3308
CC1CC(O)C(O1)C=O,0.2086
CC1(COCO1)C1CN1,0.3237
CC(O)CN1CC1C#N,0.252
COC1COC(C1)=NC,0.2752
NC(=O)C1OCC1O,0.2604
CN=COCCC(=O)N,0.2685
COC1(C)CC2CC12C,0.3226
C1CC(=O)OCCC=C1,0.2527
N#CC1C2C3C4C1C2N34,0.2704
CC1(C(N1)(C#N)C#N)C,0.261
CC1=CC2OCC1C2=O,0.2175
CC1CC11OCC1(C)O,0.29
CC12CC1C1(O)CC1C2,0.3186
CC1CC1N(C)C(C)=O,0.2641
CC1(CC1)C(=O)C#N,0.2064
N#CCNC12CC1CC2,0.266
OC1CC23CCC12OC3,0.2872
C1NC2C3OCC1OC23,0.2561
COCC12CC3C1OC23,0.3106
CC1CNC(=O)C(C)=C1,0.2124
CC1CC(C)C2(CC2)O1,0.3054
OC1C2CC1C(O)C2,0.3255
OC1C2C3C4C2C1N34,0.2918
Cc1c(=O)cc[nH]c1F,0.2046
CCC1(NC1(C)C)C#C,0.2704
c1c(cnc(n1)O)CO,0.2079
COCC(CO)C1CN1,0.3022
O=C1C2C3C4C2C1N34,0.2112
C1c2c(non2)CN1,0.2114
CC1=C(C)C(=N)NN=C1,0.1595
CC1(CN1C(=O)C#C)C,0.2165
CC1=C(C)OC(=N)O1,0.2367
CCC12CN1CC1NC21,0.2911
COC1COC(C)C1O,0.3075
c1c2c(no1)CC=C2,0.2049
CC1CC(C)(C)C1(C)O,0.3148
CC12C=CC3=CCC1C23,0.1739
CN1CCC(=O)C(O)C1,0.2015
OCC1CC2(CC12)C=O,0.2263
C#CC1C(C#N)C1C#N,0.2601
OC12COC3C4C3C1C24,0.2761
CC(O)CN1CC1C#C,0.2622
CNCC1=NOC(=N)O1,0.2322
c1c(cncn1)OC=O,0.2047
CC1C2COCC12CO,0.3118
CC12CC3(COC3C1)C2,0.324
CCc1nc(=O)cco1,0.2057
N=C1C2OCC3C2N13,0.2424
CC1(CCC11CN1)C=O,0.2205
CC1(C)CCCCC1O,0.3316
CC1OCC2NC2C1C,0.3085
CN(CCOC)C=O,0.2731
CC(O)C1OCCC=C1,0.2636
CNc1coc(n1)C#C,0.1692
C1C2C3OCCOC2C13,0.3456
CCCN=C1CN=CN1,0.2205
OC12CC1OCC21CN1,0.2848
CC1=C(OC(=N)O1)C#N,0.1914
CC(=NC)NC(=O)NC,0.2412
OC(C=O)C1NC1C=O,0.197
CCC12CC(C)(C1)CO2,0.3183
N=C1NC(C#C)C1C#N,0.2614
CC(C)c1cc(no1)O,0.2478
CN=CN(C)C(=O)N,0.2448
CC1CC(O)C11CCO1,0.2903
CN1CC(=O)C1(C)C=O,0.1682
COC1(C)C2COC12,0.2984
CCCCCCC1CC1,0.3604
OCC1(CNC1=O)C=O,0.21
Cc1ncno1,0.2639
CC(O)C(O)CC#C,0.2993
c1c(oc(n1)C#N)C=O,0.1784
C1C(CO1)CO,0.3118
CCC12CC3(C)C1CN23,0.3159
CC1OC(=N)C(=O)C1C,0.1884
CN1C=NC(=N)N=C1,0.1882
c1c(c(n[nH]1)N)CC#N,0.2281
CC1C2NC2C1NC=O,0.2721
CC#CCn1ccnc1,0.2479
O=CC1CCC2CCC12,0.2233
CC1C2C3C4C3C1OC24,0.3343
CCNc1cnncn1,0.178
CCOC12CC(O)(C1)C2,0.3214
O=CC1C2CC3(CO3)C12,0.2209
CC(=O)N(C)C1COC1,0.266
O=C1OC=NC1C1CC1,0.24
C1CC1C12OC1C1NC21,0.2778
CCOc1ncncn1,0.2226
N#CC12CCCC1CN2,0.2661
CC1(C=O)N=COC1=O,0.2159
CCn1cc(cc1N)O,0.2254
OCC1OC2(CC12)C=O,0.2197
CCCC1OC(=N)C1O,0.2828
C#CC1(C#C)C2CCN12,0.2437
Cc1cccc(c1)NC,0.2032
C#CC1CCC(C1)C#C,0.2996
CC1NC(=O)C(=O)C=C1,0.1633
CC1(CCCO1)C=O,0.2131
CC1C2C[NH+]1C2C([O-])=O,0.2121
CC1(CCC2CO2)CO1,0.3525
CCCC(C)C#CC=O,0.2052
CC12CC(C1)C1COC21,0.3259
CCCC1C2OC=NC12,0.255
OC12CN3C1C1NC1C23,0.3044
O=CCNC1CN2CC12,0.2011
CC(O)(CCO)C(N)=O,0.2719
FC(F)(F)C12CCC1O2,0.3377
CCC1CN2C1CC2=O,0.2372
CCCC1CC1(C)C#C,0.2931
CC12CC1C([NH2+]2)C([O-])=O,0.264
CC12NC1C1NC21C#C,0.2264
NC(=O)N1CC1C1CO1,0.2793
OC1C2C(=N)OC12C#N,0.2469
CC1C2CC1(C)C2,0.3785
CC1OC(=O)C11CCC1,0.2751
CC1CCC2C3CC12O3,0.306
CC1C2C3C(CN23)C1O,0.2882
CC12C3C4CN(C14)C23C,0.3021
CC(O)C1=CCOC1=O,0.2213
C1CC2(O1)C1CCC2O1,0.3201
CC1C(O)C(=NO)C1O,0.2443
CC12CC1(COC2)C#C,0.2843
CC12CC3C(O)C1CN23,0.2895
C1CC=CCN(C1)C=O,0.2451
CC1(CC1(C)C#N)C=O,0.2277
C1OC2C1C21CCC=C1,0.2328
C#Cc1c(onn1)C=O,0.1679
C1CC11COCC2NC12,0.3045
CCC1(C)CC2CCC12,0.3378
O=CC1OC=NC2CC12,0.2109
CC1C2N1C(CO)C2=O,0.215
CCC1(C)OCC1C,0.3195
NC(C#N)C1=CNN=N1,0.2469
C#CCc1ncccn1,0.2093
c1cc(c(cc1O)O)N,0.1896
CCC1(CC1(C)C)CC,0.3257
CC(=O)N1CCC1=N,0.2348
CC1CC2OC12CC#C,0.298
CCc1cc([nH]c1)C#N,0.2065
CC12C3C1N1CC3C21C,0.3016
O=C1CC2OCC1CO2,0.2237
CC(C#C)C1(C)COC1,0.2938
CC1NCC(=O)C=C1C,0.1802
C1NC2C3COCC12O3,0.2703
CC1C2OC2C11CC1O,0.3203
CC1(OC2CC2O1)C#N,0.2927
O=C1C2CCCC1O2,0.2271
CC(C)(C)C1COC=N1,0.2682
O=C1CC2CC=CN12,0.2165
C1C2OC3=C(OC=N3)C12,0.2045
O=C1NC2C3CC2C13,0.2521
C1C2C=CC3COC3C12,0.2481
N=C1OCC=CCO1,0.2339
CC(O)C(C)(C)OC=O,0.2764
CCC1CC1(O)C#N,0.2938
CCC(C)(C#N)N1CC1,0.2819
OCC(O)CC#N,0.3064
CCc1[nH]c(cn1)CO,0.2374
CC1(C#N)C2OCOC12,0.2873
CC12CC1OC(=O)CO2,0.245
NC(=O)N1CC1CC#N,0.2789
CC1CC(=O)CC1CO,0.2222
CCOC1C2CC2C1C,0.3216
CCC1CC2(CC2O)C1,0.3256
CC1NC11CCOC1C,0.3147
CC12C3C=CC1=CCN23,0.1719
C1C2OC3C2C=CCC13,0.2516
CC1(CC(=O)C(=N1)N)C,0.1849
CC(C)C#CC(C)O,0.2894
FC1=CC(=N)C=C(F)N1,0.2039
c1c(ncnn1)O,0.1798
CN1C2C3CC2(N3)C1=O,0.2417
CCC1CN2C(C#C)C12,0.26
OC1C(CC=O)OC1=O,0.2259
OC12C3C1N1C4C1C2C34,0.308
CCCC1=CCOC1=O,0.23
N=C1NC(=NO1)C#C,0.1809
C1CC23CC(CC12)O3,0.3211
CCOCC(C)NC=O,0.2819
CC1CC(O1)(C=O)C=O,0.1988
OCC1C2OC1C2C#N,0.2762
CC12NCCC1OC2=N,0.2649
N#CC1C2C3C4C3N1C24,0.2542
CC1C2CCC1C(O)C2,0.335
N=C1OCC2CCC1C2,0.2832
N#CC12NC1CC21CC1,0.2568
CNC(=N)C(=O)COC,0.1722
COC1CC2CC2CO1,0.3328
CC12C(CO)N1CC2=O,0.2189
CCCC(=O)NCC,0.2775
CCC(=NO)CO,0.2553
OC1(CN2CCC12)C#N,0.2337
CN1N=NC(=N)NC1=N,0.1832
CCCC1C(C)CC1O,0.3155
CCN(C)C(=O)C1CN1,0.2586
c1coc(=O)cc1CO,0.183
c1c(=O)c(coc1O)O,0.2061
CC1CNC=C1C(C)=O,0.1771
CNc1ccnn1C=O,0.1932
CCC1CC23CC(C2)N13,0.2824
c1coc(c1N)O,0.2165
CC1(CC=O)CC2CN12,0.2165
CC(C)(OC=O)C1CN1,0.2501
OCC(=N)N1CC1C#N,0.2493
CN1C2COC(=O)CC12,0.2447
N=C1N=CC=COC1=O,0.1865
CC1C2OC1(C)C2C=O,0.2025
CC1(CCO1)C1CCO1,0.3028
CNC1=NC2CC2C1=O,0.1679
COc1cocc1C#C,0.213
C#CC1CC2CCOC12,0.2878
CC1CC(O)C2CC12,0.329
OCC(=O)C12CC(C1)C2,0.222
CC1=C2CC3C2N3C1=O,0.1436
O=CC1C2CCC=CC12,0.2125
CC1(CC2NC12)C#C,0.287
OCC1C(C=O)C1C=O,0.2127
O=C1CC2C1C=CC2=O,0.187
CNC1C=CCOC1=N,0.2197
CC(C)OC(=NC)C,0.2722
CC(=N)NC(=O)N(C)C,0.251
CC1COC(C)C2CC12,0.3245
CN1CC1C1(C)CC1,0.3036
CCC1(O)C2CC1N2C,0.3203
OC1CCOCC=C1,0.2536
CC1CCCCCC1=O,0.2226
Cc1ncc(cn1)O,0.2041
c1c(c([nH]n1)O)CCO,0.2469
c1cc(cnc1)CCO,0.2281
OC1(CC(C1)C=O)C#C,0.2264
CC12CC(O)(C#N)C1N2,0.2707
c1cc(n[nH]c1=O)O,0.163
CC1CC1C1=NNC=N1,0.2488
O=C1CC2=CCC3C1C23,0.2033
CCC(N)C(N)C#N,0.2848
c1coc(n1)CN,0.2464
CCCC1(CC1)CC,0.3417
N=C1OCCOCC1=O,0.1946
CC1C2C3OC1(C#N)C23,0.2515
CC1CC1(CO)C(C)=O,0.2267
CC(=O)C(=O)C(=O)N,0.1569
C1C2CC(CC12)N1CC1,0.3135
CC1OC(C=C1)C#C,0.2532
COC1(C)CC2CCC12,0.3217
c1c(nc(nc1F)N)O,0.2239
CC1C(C#N)C1C1CC1,0.2977
CC1(C)CC(CO1)C=O,0.228
C(CCOCC#N)CO,0.2824
C1C2CC3CC12OCO3,0.3222
CC(C#C)C1(C)OC1C,0.305
CC(O)C1C(CO)N1C,0.2892
CCC(C)C(CO)CO,0.3115
CNC(=O)C(C)NC=O,0.2471
CC1=CCC(C1)C1CO1,0.2604
CC(=O)C(=N)NC=N,0.1842
O=C1CC=CC2CC1O2,0.2155
O=CCC12CC(C1)CO2,0.2194
CCC(C)(NC)C#N,0.2724
CC12C3CN1C3C21CC1,0.3085
Cc1cc(=O)c(c[nH]1)C,0.2022
C1OCC2COCCC12,0.3309
c1cc([nH]c1C#N)O,0.199
CC(C)c1cc([nH]c1)N,0.2374
N=C1COC2CCC2O1,0.275
C(CC#N)C#CCC=O,0.2227
O=CCCCC1CO1,0.2286
OC1CCC2CC1C2,0.3265
c1cn2c(c1O)CC2,0.2351
CCC(O)(C#N)C(C)=O,0.2218
COC12CC3C1C2C3=O,0.2427
COC12CC3=CCC1C23,0.1758
C1C=CCC1=C2COC2,0.2357
CN=C1NN=CN=C1C,0.1577
N=COC1CNCC1=O,0.1894
CC(O)C1=NOC(C)=C1,0.2469
CNC(=O)C(OC)C=O,0.2095
CC1(CO1)C1=CCCC1,0.2519
N=C1C=NN(C=O)N=N1,0.1668
C(CNC=O)NCC#N,0.2706
CC(C#C)N1N=NN=N1,0.2503
N=C1OC2C(NC12)C=O,0.2008
C(C(CO)C(=O)N)O,0.2717
COC1(C)C2C3OC2C13,0.3028
CC(C)C(CO)C(C)C,0.332
OC1C2CC(CC=O)C12,0.1885
COC12CCC(CO1)C2,0.3191
CC1(Cc2n1nnc2)C,0.2619
NC1=C(F)OC=NC1=N,0.174
O=C1C2CN2C2COC12,0.1972
CC1=NCC2(CN2)CO1,0.2722
OC1(CC11CCC1)C#C,0.2706
OC12C3COCC1OC23,0.288
CC12CC3C1OC(=N)C23,0.2729
CC1C(C)C(=O)C1C#C,0.215
CC1OC1C1CC1(C)O,0.3269
CNc1c[nH]c(n1)C#C,0.1733
O=CC#CC1CC1C#N,0.2006
CN1C2CC1C1(C)NC21,0.2734
CC1=C(CNC1=O)NC,0.206
CC1(C)C(O)C1C#N,0.2955
CN1N=CC(F)=CC1=N,0.1582
NC(=O)C1CC(O)C=C1,0.2384
OC(CC#C)CN1CC1,0.3008
OC1(CC(C1)C#N)C=O,0.2336
CN=C1N=CNC=N1,0.1848
C1N2C3C2C2C4OC12C34,0.3002
c1cc(oc1)CC2CC2,0.2347
CC12CN3CC1C23C#N,0.248
CC(O)C1C2OC1C2C,0.3098
CCC12CC3(C)CN1C23,0.3129
CC1(C)C2OCC12C#N,0.2686
CC1(OC1CO)C=O,0.2207
OC1C2C1C1OC2C=C1,0.2434
CN=COCCC1CO1,0.2738
CC12CC(C1)C(=O)NC2,0.2731
CC1(CCNC(=O)O1)C,0.308
OCC1(CCC1=O)C=O,0.193
CC1C2N=CN(C=O)C12,0.21
C#CC12CC1OC=NC2,0.2597
OC1C(COC1=O)C#C,0.2663
CCCC(=N)OCC#N,0.2856
N#CC1=CC2CC1C2,0.2003
N=C(C=O)N1CC1C#N,0.1916
CC1NC11CC=CC1=O,0.1926
CCC(OCC#C)C=O,0.2127
C1OC1C12CC3C1OC23,0.3075
NC1=NC=C(O)OC1=N,0.1519
CC1CC(C)(C1)C1CO1,0.3519
CC12NC1C(=O)C2(C)O,0.213
OCC12NC1CN1CC21,0.2757
CC12C(O)C1CC1OC21,0.3014
CCCNC(=O)C,0.2781
CC1(C)CC2CCCC12,0.3458
CCC1(C)OC(C)C1C,0.3138
CC1OCC(=O)C11CN1,0.2059
CC1=COC=C1OC=N,0.2315
CC12CN3CC1C(=O)C23,0.2187
COCC#CC1CO1,0.2699
OC(C=O)C1OC1C#N,0.2288
O=CC1(COC=N1)C#C,0.2118
CC1C2N3CC1C23C#N,0.2649
C[NH2+]CC(C)CC([O-])=O,0.2724
C1C=CC2=CCCCC12,0.1973
C1OC2CC1CCC=C2,0.246
CC1CC2OC(=O)C12,0.2775
CC1(C)CC2NC2CO1,0.3045
CC12OC1CCC2C#C,0.3026
CC1CC1N=C(N)C#N,0.1997
CC1C2CN2C(=O)C1O,0.2376
O=CC1C2CN1CCO2,0.1932
CC1CC2=CC(C)=NN12,0.2622
CCC1C2OC1C2C#N,0.2761
O=CCC1NC1CC#C,0.2205
CC1(C)OC2(CC12)C#C,0.2495
CCc1ccccc1N,0.2073
C1C2N1CC1=C2NC=N1,0.2293
CC(C)C1CCNC1=O,0.2706
CC12OC3COC1C23O,0.277
OC12C=CC3C1C=CC23,0.1932
COC12C3CC1CC2C3,0.3076
CC1COC(=O)C1C#C,0.2594
CCC1C2CC1C2C#C,0.2985
CC1(CC(=O)C=C1)C,0.1922
O=CC1C2C=CC3C2N13,0.202
CC12CC(=O)N1CC2O,0.237
CC12CC1C1CC(C2)O1,0.322
O=CCNC1CNC1=O,0.218
CC12COC3CC1C23,0.3305
O=C1NC2CCC1C2,0.2653
OC1C2OC2(C#N)C1O,0.2636
Cc1c(cc([nH]1)O)C#C,0.2024
CC1=NOC=NC1=N,0.2057
OCC(CN1CC1)C#N,0.2808
N=C1OC(C#N)C11CC1,0.2682
CC1C2C3COC2C13C,0.3224
CC1C2OC2C1C(C)=O,0.2261
CC12CC3C1COC23C,0.3219
C(COC(=O)C=O)O,0.1809
CNC1=NCC(=O)C1O,0.1948
COc1cc(co1)C#C,0.1996
O=C1OCC2OC2C1=O,0.1812
CCOC(CC)C(C)O,0.3188
C1C(CO1)CCO,0.3178
CNC1C(C#N)C1C#N,0.2363
COc1c(cc[nH]1)CO,0.2371
CC#CC12CC(C)(C1)O2,0.2571
CC(C#N)(C#N)N(C)C,0.2441
CNC(CCOC)C#N,0.2716
c1nc(nc(=O)o1)C#N,0.1863
CC12C3C(C#C)C1CN23,0.2812
OCC12CNC1C(=O)N2,0.2415
Cn1ncnn1,0.2662
C1CC2=CCCC12,0.2464
CCC12CC1NC2C#N,0.2489
CC1(CCC11CC1)C#N,0.3142
CC1(CO)CNC1=O,0.2787
CC1=CCOC=NCC1,0.2384
N=C1CC(CC#N)O1,0.2895
CC12CC(C1O)N2C=O,0.2504
C#CCc1cocn1,0.2469
CN1C2CCC12CCO,0.3116
CC1(O)CCC2CC1C2,0.3287
CC(O)C1(C)CC(=N)O1,0.2902
C1C=CC2C=CCCC12,0.2475
c1(c(=O)nc(on1)N)N,0.2011
OCC1=CCN2CC2C1,0.2449
C1CC(C1)C2(CC2)C#N,0.3139
CCC1OC1C(C)OC,0.3298
CN(C)C(C)(C=O)C#N,0.1864
OCC1=CCNC1C#N,0.2393
CC1(C)C(C)(O)C1(C)O,0.2829
CC1C2NC2C1CCO,0.3034
CC#CC1CC(O1)C#N,0.2509
N#CC1C2CN3C2CC13,0.2743
C#Cc1nc(co1)N,0.1735
OC1C2(CN2)CC11CO1,0.2953
CC12C3COC1CN23,0.3187
C1CN(C(=C1)C#N)C=O,0.1838
CC1OC2C1C2(O)CO,0.3006
OC12CC1CC2OC=O,0.2719
c1nc(nn1C=O)O,0.2012
CC1=CC2NC2CCC1,0.249
COC1CNC(=O)C1,0.2765
CC1C(C)C11CC(=O)N1,0.2717
CC(=O)c1ccncn1,0.1707
CC(=O)C(=O)COC=N,0.1496
CCC1=CC2CC2(O)C1,0.2376
OC1CCC23CC12CO3,0.2808
CC(C)C1CCCC1O,0.3161
NC1C(OC=O)C1C#N,0.2361
CC12C3N1C1CC2C3=C1,0.1494
CC12CC1C1CCC21,0.3136
N=C1OCC1C1CN1,0.2582
O=CC1C2CC2C2CN12,0.206
CC1NC2C1C2(N)C#N,0.2585
CCCCC(N)C#N,0.2865
NC=[NH+]C1=C([O-])OC=C1,0.1157
CN=C1OC2(C)C(O)C12,0.2615
CCOC(=N)C1CC1C,0.2834
CC1C2CC2C2CC12O,0.3157
OC1CC2C3OC3C12O,0.2995
CC1C2C3OC1OC23C,0.3287
C1C2OC3C4CC1(O4)C23,0.2529
CCN1N=NNC1=N,0.2016
OCC1CCC=CCC1,0.2586
CN1CC2CC12C#N,0.2399
CC1CC2=C(OC=N2)O1,0.2161
NC(=O)C1CNCC1=O,0.1966
CC1C2CC1N2CC#N,0.2675
CC1NC11C2OC1C2O,0.2979
CCC1(C)COC=N1,0.2714
CC1(CC1)CC(=O)C=O,0.1501
CC12C3CC(=CC1O)C23,0.178
CCCOCCOCC,0.3365
OCC12OC1CC1NC21,0.2927
CCC1CC2(CCC2)O1,0.3144
CCC1CC1C(C)O,0.3338
CC12NC1C(=O)C21CC1,0.216
COc1ccn2c1CC2,0.2321
Cc1cc(no1)C2CC2,0.2449
NC1CCOCOC1=O,0.2549
O=C1CC2(CC1O2)C#C,0.2148
COC1CC(C)(O)C1=O,0.1985
CC1(C=O)C2C3CN1C23,0.213
C[NH2+]C(COC)C([O-])=O,0.2616
CC(C)C1CC(C)C1C,0.349
CC1C2C3CC(O3)C12C,0.3262
FC1=NC(=N)NC(=O)N1,0.2253
C#CC1CN1CC1CN1,0.2615
OC12CCC3C1N3C2=N,0.258
c1cc(c(nc1)F)C=O,0.1826
CC1CC(=NO)C1C#C,0.2478
CC1OC2CC12C=O,0.2183
CC1=NNC(=N)C(C)=N1,0.1592
C[C-]1C(=[NH2+])NC=CC1=O,0.1997
CN=C1NN=C(N)C=N1,0.1238
CCC1C2C3C1C(=O)N23,0.2503
CCn1c(ccc1O)C,0.2322
CC1CN1CCCC#C,0.2837
O=C1C=CC2NC2C1=O,0.1448
[NH3+]C1COC(C1)C([O-])=O,0.1347
Cc1c(onn1)CC#C,0.2257
CN=COC(CO)CO,0.259
C#Cc1c(c[nH]n1)CO,0.2243
CCC1(C)NC1C#C,0.2791
CC(=O)C1CCCC=C1,0.2187
c1cn[nH]c1NCC=O,0.1818
CC#CC(=N)OC=O,0.2296
OC1CC1(O)COC=N,0.2369
O=CN1CC11CCOC1,0.249
CC12C3C(CN13)C2C#N,0.2814
CC12CCC3C(CC13)C2,0.3583
CC(C)C1(C)OC1(C)C,0.3276
c1nc2c(o1)non2,0.2177
N=C1OC2(CCC12)C=O,0.2114
OC1C2NC2C1N1CC1,0.2872
CC1C2C3CC3C(=O)N12,0.2305
CCn1ccnc1,0.2538
CC(=O)N(C)C=NC,0.2279
C1CC1CC=O,0.2258
C[NH+]1CCC1(C)C([O-])=O,0.2142
CCC1=C(COC1)C,0.2465
C#CCCC#CC=O,0.2047
NC(=O)C1(CC1O)C=O,0.2164
N=C1NC2CC(C2)C1=O,0.1869
CCN1C2C1C1CC2O1,0.2974
COC12C(O)C1C1CC21,0.28
[O-]C(=O)CCCC1C[NH2+]1,0.2779
CC12CC3N1CC23C=O,0.1911
CCC1(C)CNC(=O)N1,0.3036
CCOC(C=O)C#N,0.2229
O=CC1OCC=C1C=O,0.1626
CC1OC(C#N)C1C=O,0.2202
c1c[nH]cc1NC=O,0.2149
CC1OC1C1C2CC1O2,0.3204
O=C1NCC2(CO2)C1=O,0.1613
CC1CCC2CC3C2C13,0.3253
O=CNC1CCC(=O)C1,0.2189
CC1C(C2CN2)N1C,0.2927
C#CCC12CC1C1NC21,0.259
CC#CC1CNC1C#N,0.2578
CCC(CC)OC(C)C,0.3235
OCC1(CO)CC2NC12,0.2931
CN1CC1(C)C(C)=O,0.2171
c1cnc-2nc[nH]cc12,0.1599
CC1(O)CCCC11CC1,0.3211
CN1N=CC(C)=CC1=N,0.1574
O=CC12CNC(=O)C1O2,0.2022
CC1CC(=O)C1C#C,0.2148
OC1CC(O)(CC#N)C1,0.2951
NC1=CNN=CC1=N,0.163
OC12C3CCN(C13)C2=O,0.2355
CC#CC1OCOC1=N,0.269
CC1(O)C(CO)C1(C)O,0.3001
CC12NC1C1CCC2O1,0.308
CCCOC(C)C=O,0.2267
CC12CC3C1CC23C#C,0.2886
CC1C2CN3CC3C1O2,0.2898
CC1NC(C#N)C1O,0.2715
Cn1c(=O)cnc(n1)N,0.1406
CC(=N)OCC(C)=O,0.2352
CC1CC2CCN=C2O1,0.2731
N#CC12CCCC1CO2,0.283
C(CNC(=N)C#N)CO,0.2115
C1C(=O)CN1CCO,0.2091
COC1C2CNC12C=O,0.1921
CC12CC3C1OC23C,0.3134
CC12NC1CC2=O,0.2212
CC1(CC#N)CC1CO,0.3027
CN1CC2(O)CC(O)C12,0.2866
N#CC1C=CC2CC1N2,0.2295
CC1OCC=C1C(N)=O,0.2026
CN=C(C#N)N1CC1,0.2069
O=CN1C2CC(C#C)C12,0.2461
CC1C2OCC(C)C12,0.3036
CCC1CC2CCOC12,0.3148
COCC1OCC1(C)C,0.3121
COC=NC(C)C1CC1,0.268
O=CC1=CN2CC3C2C13,0.169
CC1=CCC2(CC12)C#C,0.2441
C1CC=C2C3OC3C2C1,0.2481
CN1N=NC(=N)N=C1O,0.1717
NCC(O)(CC#C)C#N,0.2638
CC1C2CCC1(O2)C=O,0.2178
CC(O)(C#C)C#N,0.2864
c1nc(nn1CC=O)O,0.1978
OC1C2C=CC(C#C)C12,0.2274
CC1(O)C2OC2C1C#C,0.2844
C(OC1CCC1)C1CO1,0.3311
O=CC12CC3=CCC1C23,0.1742
CC1CC(=O)CN=CO1,0.2166
O=CC1(CN1)C1CC1,0.2204
N=C1NC(=O)C2CN12,0.238
OC12CC(C=C1)C21CO1,0.2441
COC1CCOC1=O,0.2494
CCOC(=N)CC#N,0.2923
OC1C2C1N1C2CC1=O,0.2305
CC(C=O)C(=O)CCO,0.2014
Cc1c(onc1NC)N,0.2378
N=C1OC=C(N=C1)C#N,0.1613
OC1CC(=O)C(=O)C=C1,0.1496
CCN1CC(=O)C1,0.2071
c1cnc(c(=O)nc1)N,0.1634
OC(CC1CC1)C1CC1,0.3251
CCC12CC1C(O2)C#N,0.263
NC1(CO)COC1=N,0.2617
C1C=CNC(=O)C=C1N,0.1869
FC1=NC(=N)N=CO1,0.2165
CC(O)C1C=CCC1C,0.2567
C1CC2(C1)CN(C2)C=O,0.266
c1c(nc(oc1=O)F)N,0.2
OC12C3C4C(N4C13)C2=O,0.1964
O=C1NC2CN=COC12,0.255
CN1C(=N)OC(O)=C1O,0.2161
CC1(CC1C#C)N1CC1,0.2753
C1COCCNC1=O,0.2665
CC1CC(=O)NC11CC1,0.2672
NC1C2OC2COC1=O,0.2611
CC12C3C1C1=CCN3C21,0.1581
OC1C2CC=C(C#N)C12,0.1972
CCC(O)C(C)C(C)=O,0.2306
CC1COC(=O)CN1,0.2401
O=CNC12CN3C1CC23,0.2592
OC(C#N)C1CN2CC12,0.2546
CC1(OCC(=O)CO1)C,0.2061
COC(=O)C(C#C)C#N,0.2651
OCC1CC1NC=O,0.2707
c1cn[nH]c1C(=O)C=O,0.1536
COC(C)C(C)C(C)O,0.3156
Cc1c([nH]cc1C#N)C,0.2178
C#CC1OCC11CO1,0.2691
NC(=O)C12CC(O)(C1)C2,0.2687
CCC12CC3C1OC23,0.3072
CC1(O)C=CC2(O)CC12,0.2423
CC1(CC(O)CO1)C#C,0.2914
CC1CC2(N)C1OC2=O,0.2494
CC1C(C)C1C(F)(F)F,0.3568
CC12CC3N1C2C3(C)O,0.3099
C#CCN(CC#N)C=O,0.2758
COc1cc(oc1N)N,0.2125
CCN=COC(=O)C#N,0.2053
CC1C=CC2=C1N=CN2,0.1823
CC(C)CCC(C)C=O,0.2266
C1C2CC1C1NC1CO2,0.3009
CC(C)C1OCC1(C)O,0.3059
CC1CCC2N1CC2=O,0.2038
O=CCNC12CN(C1)C2,0.2074
OCC(O)C#CCC=O,0.2213
CC12CCC3C4C(C14)N23,0.3008
OC12CC1(O)C(C2)C=O,0.1992
OC1CC2(C1)NCC2=O,0.2047
C#CC(C1CN1)N1CC1,0.2736
CNC(=O)C#CCCO,0.2362
CC1(C)OCC(O)C=C1,0.2501
CC1C(O)CC1CC=O,0.225
CNc1nc(=O)cco1,0.2089
OC1CCC11CC(=O)C1,0.223
c1c(n(c(=O)o1)C=O)N,0.1921
CCC(C)CC(C)C,0.3736
C1Cn2c1c(nn2)C#N,0.2445
CC(=O)c1cc(c[nH]1)N,0.162
OC1CNC(C=O)=NC1,0.1705
CN1C2C(=O)NCC12C,0.2511
CCOc1ncon1,0.2468
C1CC(=O)C(C1=O)O,0.1929
COCC1(CO1)C(N)=O,0.2557
CC1(CCC1)COC,0.3328
O=CNCC12CN1CC2,0.2701
OC(C=O)C(C=O)C#C,0.217
COCC(CC#N)C#C,0.3059
COC1=NCC(CO)N1,0.2707
CC1CC(=N)OC(C)O1,0.279
CC1N2CC11COCC21,0.2944
c1c(nc(o1)N2CC2)O,0.2187
CC(C#C)(C#N)C1CO1,0.2881
Cn1c2nccn2cn1,0.2057
CCC(C#C)C1CN1C,0.2737
CC(=O)C(=O)C(O)C#C,0.1579
CC1OC11C=CCC1=O,0.204
CC1CC2OC2(CO)C1,0.3176
OCC1C2C3C(N13)C2=O,0.229
c1c(cn[nH]1)O,0.2369
C#CC1C2NC2C11CC1,0.2763
CC1(C)C2CN(C=O)C12,0.2564
CN1CC1C1=NON=N1,0.1758
CC(=NO)C1NCC1=O,0.2192
NC(=O)C1CCCC1O,0.2655
OC12C3CC1(C3)NC2=O,0.2231
CC1(C)CC2(C)COC12,0.3099
N=C1C=NNN=N1,0.1763
COC1(CC#N)CC1O,0.2731
CC1N2C3C2C2C3C12C,0.2942
CC1CC1C1CCCO1,0.3263
NC1(COC11CC1)C#N,0.2661
CC1OCC2C1N2C=O,0.2494
CC(C#C)C(=O)CCO,0.2245
CCC#CCC(=O)C#C,0.1908
CN1C2COCC12C#N,0.263
CCCCCC(C)(C)O,0.3246
CC1C2(CC2)CC1(C)C,0.3378
COC1CC(C#N)C1C,0.2929
C1OCC11C2C3NC3C12,0.2758
NC(=[NH2+])[C-](C#C)C#N,0.1896
COC1C2CC2C1(C)C,0.3188
CCc1c(c[nH]n1)C#N,0.2405
CC1CC2C(O)C2CO1,0.2997
N#CCOC1C2CC1C2,0.2888
CC12CCC3C4C(C14)C23,0.3235
CC1C2OCC3N1C23C,0.316
OCC1=CCC2(O)CC12,0.2472
O=C1NC2CCCC2=C1,0.2148
C1C(=O)CN1C=O,0.2127
CCC1C2C3C(C)C1N23,0.3096
COC(C)CN(C)C=O,0.2725
O=C1CC2OCC2C=C1,0.1853
CC1(CC12CCC2)C,0.332
C1N2C3C4C2C11CN4C31,0.2851
C#CCC12CC1OC2,0.28
CC(C)(O)C(O)C1CC1,0.3275
CN1C(=O)NC=NC1=N,0.2069
CC1(O)CC2OCC2=C1,0.2367
CC1(CO1)C1CC1O,0.3141
[O-]C(=O)CC1=[NH+]CCN1,0.2244
C1OCC1C1C2CC1O2,0.3132
C1C2OCOC3CC2C13,0.3162
CCC1C2CC(O)C1O2,0.3086
CC1C2C3OC(=O)C3N12,0.2363
CC1C2CC1(C)CO2,0.3093
CCN1C2C(=O)CC12C,0.2092
CCOC1=NCC(=N)N1,0.2422
CC(C)C12CCC1(C)O2,0.3211
CC(CNC(C)=O)C#C,0.2767
CC1C2CC1C2(O)C#N,0.3059
OCC1(CC2CN12)C=O,0.2074
CC(O)CC(CO)C#C,0.3021
CN1CCC(O)C1C=O,0.2073
COC1CC1C#CC,0.2839
CC1(C)NC(=N)C11CO1,0.25
CC1(OCC1=NO)C#N,0.246
C#CCC1CC1,0.314
CC1N=COCC1O,0.2632
CC12CCOC1C1NC21,0.2981
CC1(CO1)C1=CNC=N1,0.2477
CC1=CCC2C1OC2=O,0.2552
CN=C(c1ncon1)N,0.1918
CC1CC2(C)C1N2C=O,0.2417
c1conc(c1=O)CO,0.1876
c1c2c(c[nH]1)onn2,0.1748
c1c2n(cn1)C=CC2=O,0.1613
C1CC2=CCCCC2O1,0.2555
CNc1nc(=O)nco1,0.215
CC1C2CC1C2C(C)=O,0.2235
CC(=O)C1=NCC(=O)O1,0.1873
CCC#CC(OC)C#N,0.2662
CC12NC1C=CCC2=O,0.2089
COC1CN(C1)CC#N,0.2575
CC1C2C3N2C1C3(C)C,0.3114
CC1=C(COCC1)C#C,0.2092
CC1CC1COC(C)=O,0.2826
CC12CC3(C)C=CC1N23,0.2151
CC#CCOC(C)C#C,0.2686
CC1OC2CC2C1C=O,0.2108
Cc1c(onc1CO)C,0.2371
COCC12CN1CCC2,0.3107
COCC1C2CC1C2=O,0.2522
CC1CC11CC(O1)C=O,0.2013
c1c(nc(c(n1)O)O)N,0.1695
CN=C(c1c[nH]nn1)N,0.213
O=CCOC1C2CC1O2,0.2134
C#CCN1CC1C1CC1,0.2631
CC1OC2(C)COC12C,0.3071
CC(=O)C1NC1(C)C,0.2207
CCC1(O)COCC=C1,0.2532
N#CCC1(CCO1)C#N,0.281
CCC12CC3C1C(O)C23,0.312
C#CC(C#N)(C#N)O,0.2672
C1C2OC3C4C(OC13)C24,0.3096
C#CC12CN3C(CO1)C23,0.2635
NC1=NC(C[NH3+])=C([O-])O1,0.1708
CC#CCC1OC1C#C,0.2632
CC#Cc1c(nn[nH]1)O,0.1921
C1C2COC3C=CC2C13,0.2453
CC1(COCOC1)C=O,0.2203
C1C2C3OC3CCN12,0.2953
CC1CC(C=O)C1C#C,0.2165
CC1C2C3C4C(N24)C13O,0.2904
C#CC(=O)C#CC(=O)N,0.181
CC1CC1CC1(C)CO1,0.3428
CC(O)C(CC=O)C#N,0.2259
CC1([NH2+]CC=C1)C([O-])=O,0.2296
c1c(c(nc(=O)[nH]1)N)O,0.1812
CC1(CO1)C1CC(=O)O1,0.2773
CC1OC1C(O)C#C,0.2829
NC1=CC(=O)C2C(O)C12,0.1958
C1C2COC11CCOC21,0.312
O=CC(=O)N1CC2CC12,0.1694
C1Cn2c(c(nn2)O)N1,0.2076
CC#CC1(NC1C)C#C,0.251
CC#CCCC(C)C=O,0.2217
NC(=O)C12CCCC1N2,0.2632
O=C1NC2CC1N1CC21,0.2551
CCC1=CC(O)CC1,0.2568
CC(=O)C12C3CN1CC23,0.2185
OC1CN2C1C(O)C2=O,0.2179
O=CC12OCC3C1NC23,0.2089
CCC(CC#N)C1CC1,0.3269
OC1CC1CCN1CC1,0.3092
C(c1c(nno1)N)O,0.1868
CC#CC1OC(=N)C1C,0.2752
Cn1cc(c(n1)CO)N,0.214
OC1(CC2(CN2)C1)C#C,0.2707
CCN1C(C#C)C1C#C,0.2424
C1CC(C1)C(=O)N2CC2,0.245
OC12C3CC1C3C21CC1,0.3099
CC(O)C1NC(=O)C=C1,0.2166
C1C2NC1C1=NON=C21,0.2251
O=CNC1C2C3CC1N23,0.2727
CN1N=NC(OC=N)=N1,0.2294
OC1C=C(NC1=O)C#N,0.186
CC1CC(=N)OCC1O,0.2767
CCN1CC2CC(=O)C12,0.1794
CN1C(=N)ON=C1C=O,0.1473
C(C=O)N=COC=O,0.2208
OCCC1CC(O)C1,0.3296
OC1CCC2C3CC1N23,0.2961
c1coc(=O)nc1C#N,0.1658
COC(C)(C#C)C1CO1,0.2882
CC1CC=CC2OC2C1,0.254
CC1(C2CO2)C2CC1O2,0.3215
NC(C#C)C(C#C)C#N,0.2704
OC1CC1C1C2CCC12,0.3228
CC1CC2(C)NC2C1=O,0.2104
CCC(O)C1CCC1,0.3271
O=C1OC(CC=C1)C#N,0.218
OC1C2COC(O2)C1=O,0.2064
NC(=O)C1(N)CN2CC12,0.2495
C1C=CNC(=O)NC=C1,0.2095
O=C1C2NC3C2C13C#C,0.225
CC12CCC1C(CO)O2,0.3081
OC1C=CC(C#N)C1=O,0.2219
CC#CC1(N)COC1=O,0.2518
CC(CC1CCO1)C#C,0.3026
COc1c[nH]c(c1O)O,0.2284
COC(C)C1(O)CC1C,0.3211
CC1=NC2CC(C)(C2)O1,0.2661
CC12CC3C1C2(C)C3O,0.3195
N=C1NC(C=O)C1C#N,0.2074
ON=C1CC=C2CCC12,0.2382
Cc1nc(on1)N(C)C,0.2376
CCC1C=CCC1OC,0.2607
CN(C)c1ncncn1,0.1998
CC1NC11CCC1C#N,0.2743
COC=Nc1ncno1,0.2006
CC1C2CC1OC(C)C2,0.3196
C(CN=COC=O)C#N,0.255
C1CC=CC=CC(=O)C1,0.1735
CCOCC1NC1C#N,0.2768
NC1=NC(F)=NNC1=N,0.1686
OC12CC(C1)CC2C=O,0.2244
CC1(OC(=N)C1O)C#C,0.2741
c1c2n(nn1)CC(=O)N2,0.2121
CC1C2OC(=O)C12C#N,0.2701
CC#CC12CC(O1)C2C,0.2571
CNc1cnc(o1)C#N,0.1735
CC(C=O)N1CC1(C)C,0.2147
c1c(noc1N)N,0.2384
C[NH2+]C(C#C)C(C)=N[O-],0.115
OC1C=CC2(NC12)C#N,0.2297
C#CC1C2CC=CCC12,0.2668
C#Cc1cnn2c1CC2,0.2291
Cc1cc(n[nH]1)C#N,0.2352
N#CC12CC3C1CN3C2,0.2636
CN=CNc1c[nH]nc1,0.2154
CC1CC(O)(C1)C1CC1,0.3182
CC1OCC2CCC=C12,0.2515
OCC12CC3CC1N23,0.3287
CC12CN1C(=N)C2C#N,0.2479
CC(C=O)C(C)(C)O,0.2273
COC1CC11COC1,0.3106
CC(C#C)C(=O)C=O,0.1508
CC(=O)C1(C)CCC1=O,0.1978
CC(C)(C)CN1CC1,0.3093
COc1cn[nH]c1C#C,0.1946
CC(CO)C1=NON=N1,0.2143
CN1CC1(CC#N)C#C,0.2664
CC1C2C(O)C=CC12O,0.2356
COC1C(O)C1OC=N,0.2403
OCC1CC2CCC=C12,0.247
CC1C2C3C=CC2C13C,0.2253
OC12CCC1N1CCC21,0.2657
NC(C#C)C1(CC1)C#N,0.2769
CN1CC11CNC(=O)C1,0.2652
NC(=O)C12CCC1CO2,0.2527
CC1NC1C(F)(F)F,0.3295
CC(O)C(C)(O)C(C)O,0.3004
CC1OCC(O)C1=NO,0.2434
c1cn2c(n1)[nH]cn2,0.216
O=C1CCC2C(C#N)N12,0.2359
CC1C2C3CC(C2O)N13,0.2964
CCC1C(C)C1(O)C=O,0.2208
CC(C=O)C1CC2CN12,0.2179
CC1(OCC1O)C(N)=O,0.2654
CCc1ccnc(n1)O,0.2147
C#CC12CC(C1)COC2,0.2913
N=C1OCC1COC=O,0.284
CC12CC1C1OC(=N)C21,0.2752
CCC(C)C(C)(O)C#N,0.3143
CC#CC12CC(C)(C1)C2,0.2932
FC1=COC=C(F)C1=N,0.1901
O=C1C2C3CC2C3C1=O,0.1493
Cc1nc2ccoc2o1,0.2175
OC(C#C)C#CC#C,0.2199
CC(=O)C1OC1(C)C,0.2205
c1[nH]c2c(n1)C=CC2=O,0.1306
C1CC12CCOC(=O)C2,0.2688
CC(C)C#CCCO,0.3014
CCOC(=NC)C1CN1,0.2603
CN=c1[nH]nc(n1C)O,0.2369
CC(=O)C1(C)CN2CC12,0.2148
CN=c1ccc(n[nH]1)O,0.1473
CN=C1OC2(C)COC12,0.2559
NC1=COC=C1C1CO1,0.2215
C1CC2(O1)C1CC=CC21,0.2289
CC(=O)n1ccc(c1)N,0.1706
CC1CC2NC2CC1=O,0.2229
COC1CC1(C)C(N)=O,0.2684
CC12C3OCC1COC23,0.3067
N=C1NC=CCN1C=O,0.2064
c1c(oc(c1N)N)C#N,0.1784
COC(C=O)C(C)C#N,0.2097
[O-]C(=O)C1=CNC(=[NH2+])C1,0.0944
CC1OC1C1(C)CN1,0.3185
COC1CCC11CCO1,0.3078
CC1C2CC(C)(O)CC12,0.3219
CCC1=CC(C)C2NC12,0.2444
Cc1c(ncoc1=O)N,0.1828
OC1CC(C1)NC=O,0.2777
OC1CCC2CC2C=C1,0.2486
COC(=O)C1CCCC1,0.2829
CC1(C)C2CC1(O)C2,0.3354
OC1(CC#N)CC1C=O,0.226
CCC(CC)(C(=O)C)O,0.2186
CC1C2C3C=C(C)C2N13,0.2114
CC1C2NC2C=C1C#C,0.1992
CN1C2C1C(=O)CC2O,0.2067
CC1COC(CCO)O1,0.3344
CCC1=C(C)COC1C,0.2466
CC1CN=C(NC=O)O1,0.232
O=C1NC2CCC2=C1,0.2135
OC(C=O)C#CCC=O,0.2083
Cc1c(ncnc1F)O,0.2339
O=CC1CCOC11CC1,0.218
CC12CC(N3CC13)C2=O,0.224
C1C2CC11OC1COC2,0.3111
CC(C)Oc1ccco1,0.2302
O=CC1C2CC1CC2,0.2253
O=CNCC1C2CN1C2,0.2763
N=C1CC2CC2(O1)C=O,0.2201
[O-]C(=O)C1[NH2+]CC1C=O,0.2182
CC1OC11C2NC2C1O,0.297
c1coc(=O)c(c1F)N,0.1653
CC(=O)C1OC1C(C)=O,0.205
c1cncc2c1nco2,0.2145
C#Cc1nc(=O)cno1,0.1778
c1c(nncn1)NC=O,0.1594
CC12CC1C(C=O)C=C2,0.2162
CCCC1=CCCC1C,0.258
CN1CC2OCC1C2O,0.2979
CC12OC3C(C13)C2C#C,0.2724
C#CCNC(=O)CO,0.2683
COCCC1C2CC1C2,0.3426
CC12N=COC1C2C#C,0.2442
CC12C3NC3C1N2C=O,0.2614
C1C2OCC=C3CCC123,0.2264
OCC1CC(=O)C=C1,0.1937
CC(C)OC(CN)C#N,0.2699
CCCOC(=O)C,0.285
CC1=CCC(O)C1(C)C,0.2595
CC1=CCOCC=C1C,0.2116
N=C1NC2C3CCC12O3,0.2365
C(#N)c1c(nc([nH]1)O)O,0.2061
CC1(COC1)C(O)C=O,0.2082
COCC1(O)CC1CO,0.3177
N=C1C=C(ON=N1)C#N,0.1555
CCC(C#C)C(C)(C)C,0.3118
CC1CN(C=O)C(=O)O1,0.2424
C(=O)Oc1nc([nH]n1)N,0.2324
CC(C)(C)C1CC(=O)C1,0.223
CC(=O)c1cn[nH]c1O,0.197
N=C1C2CC3(C#N)C2N13,0.2629
OC1CN2C3CC(=C1)C23,0.2075
CNC(=O)CC(C)O,0.2726
CN1CCC2CC1C2=O,0.196
COc1cccc(c1)O,0.2198
CCC(C#N)N1CC1,0.2836
CC1C(O)C1(O)C1CN1,0.2748
CC1OC(=N)CC1O,0.2854
O=C1C2NCC3OC2C13,0.1972
CC1OC=NCC1C#C,0.2682
CNC1=C(N=NO1)C#C,0.1568
CC(O)C1(C)COCO1,0.3369
CC1OC1C1CC1CO,0.3284
CCC(C)C1OCC=C1,0.246
O=CNC1CC2CCC12,0.2777
CC#CC1(CC1)COC,0.2865
CC1=CNC(=O)C1CO,0.2087
OCC12CN1C1CC21O,0.2776
C1C2OC3CN4C2C1C34,0.2782
CCN1CC1CC1CC1,0.3067
CC12CCCC1OC2=O,0.2791
ON=C1CC(=O)C2OC12,0.2112
C#CC1C2NC2C11CN1,0.2701
CC1OC1CC#CC=O,0.2049
CC1N2CCCC12C#C,0.2653
C#CC(C#C)NCC#N,0.2598
O=C1C2C3C1CC23C#N,0.2357
OC1CC(=O)C11CCO1,0.194
CC1(C)N=C2OC3C2C13,0.1619
c1cnoc1OC=O,0.2263
CCCC(C)OC(C)=O,0.2844
OCC1CCC2C(O)C12,0.3154
CC12CC(C)(C1)C21CC1,0.3494
NC1=CC(=N)OC(=O)N1,0.2029
CC#CC1OCC11CN1,0.2627
CNC1C(=N)OC11CC1,0.2498
CC1CC2(C)C1C2(C)O,0.3095
CC12OC1C(O)C21CN1,0.3004
CCN1CCCNC1=O,0.2867
CC1CC2CCC2C1O,0.316
CN1C2CCOCC12C,0.3005
O=CN1CC11CCC=C1,0.2414
CCC(C)(C)C,0.378
COc1nc(no1)O,0.2576
CCC12CC(O1)C2=O,0.2438
O=C1NC2C=CC3C2C13,0.228
CC1(CC1)C(O)C1CO1,0.3407
CC1C2OCC3(C)C2N13,0.3106
O=C1COC(CC#C)O1,0.2723
OC12C3C4C1CC2CN34,0.2909
C1CC11OC2CCOC12,0.3122
CC(=O)N(C)C=O,0.2336
CC1C2C1N1CC1C2O,0.2824
COC1(CO)CCC=C1,0.2606
CCC1C=CCC11CC1,0.2606
O=CC1C2C3CC2C13,0.2195
C1CC23OC2CN2C1C32,0.3016
CCNC(=O)C(O)CC,0.2763
N=C1CNCC=CCO1,0.2144
O=C1C=CC2C=CCC12,0.1904
Cc1nc(no1)C#C,0.2236
c1c[nH]nc1CC#N,0.2652
CC(C)N1C=NCC1=O,0.228
CCCC#CC(C)C#N,0.286
CN(C=[NH2+])[C-](C#N)C#N,0.1343
COC(C)CC(=O)CO,0.2393
C#CCn1c(cnn1)N,0.2281
NC(=O)C12C3C4C(C13)N24,0.2426
CC1C2N1C(=O)NC2=N,0.247
OCC1CC1C1COC1,0.3159
CC(C)(CCCCO)O,0.3252
O=CC1NC1(C#C)C#C,0.2051
N=C1CC2C3OC2C3O1,0.2665
Cc1c([nH]nc1O)OC,0.2514
O=CCC1CCCC1=O,0.2125
c1c(nno1)C(=N)N,0.1845
N=C(C#N)N1C2CC1C2,0.207
C#CC1CCC(=C1)C#C,0.2095
CC1OC(C)=NC1C,0.2692
CCC12CC(OC1)C2=O,0.2061
CCC1CNC(=O)O1,0.3141
Cc1nc2c(o1)COC2,0.2262
CC1C2CCC1C2=NO,0.2607
[NH3+]C1(CC([O-])=O)CC1,0.2756
OC1COC2CC1C2,0.3083
CC(C)OC1CN(C1)C,0.2879
C(C1CC1)C12CC1CC2,0.3298
Cn1c(=O)[nH]c(n1)C#C,0.185
C#CC1=CC(=O)C(=O)C1,0.13
C(CO)C#CCC#N,0.2872
N#CC12OC3CC1C23,0.2501
C1CC23C1N1C2CCC31,0.2697
CC12C3NC3C1CC2=O,0.2063
NC1=CNC(=N1)C1CN1,0.2111
OCC12NCC1OC2=O,0.24
ON=C1C=CC2CC12,0.1857
O=C1NC2C3CC12CO3,0.2415
C(CN1CC1)C1CO1,0.3259
OC1CC1OCC#C,0.2596
OCC1COC(O1)C#C,0.2835
CC12CNC1C(O2)C#C,0.2536
CC#CC1C2CC1C2C,0.2888
C1CC12C(=CCO2)C#N,0.1833
CC1CC(C#N)N(C)C1,0.2615
CC(=O)C1C2C3CN1C23,0.2116
CC1C2C(C)C1C2O,0.3222
OC12CCC34CC(C13)C24,0.3194
CC(=O)C(O)C#CC#N,0.2165
c1cn(cc1O)C2CC2,0.2274
O=C1CC(C=CN1)C#C,0.2138
OCC(=O)C1NC1C=O,0.198
CC(=N)NC(=O)OC,0.2549
CC1CC2(CNC2=O)O1,0.2504
CNC(=N)C(O)C#N,0.2267
CNC(=O)C12CN(C1)C2,0.2428
CCN1CC11CCOC1,0.313
OCC1CC(=O)C1C#N,0.2227
CC1OC2C3NC3(C)C12,0.3199
CC(C=O)C(O)C1CO1,0.2225
CC12CCC1CC(=N)O2,0.2833
CN1C2CC(CC12)C#N,0.2663
CCC(C)(CO)OC,0.3158
OC1COC2CC1CO2,0.315
OC1COC11CC2OC12,0.307
Cc1c(c(ccn1)F)O,0.219
NC(=O)OC1C2COC12,0.291
CC(O)C(C)C1COC1,0.3011
O=C1C=C2NC3C2C13,0.155
OC1CC1OC1CC1O,0.296
CN1C2(C)CCC12C#N,0.2718
CC1CC2=C(N1)OC=N2,0.2081
CC1CCNC(=O)O1,0.3071
N#CC#CC12CCC1O2,0.2106
CN(C=O)c1ccn[nH]1,0.2222
C12C3C1C1C2C31,0.3092
FC1=CC(=N)OC=C1,0.1721
NC1=CNC(=N)C(F)=C1,0.1477
CCC1(CC1C=O)OC,0.2247
CC1CCC(C1)OC=O,0.286
CNc1cnoc1N,0.2226
CC(C)(CO)OC=N,0.2848
CC1C2C3CC1C=CC23,0.2456
CN=C(C(=O)CC#N)N,0.1862
CN(C)c1c(cco1)N,0.217
C1C2C3CC(CCO3)N12,0.3052
CC(N)(C#C)C(N)C#N,0.2746
C#Cc1ccc(o1)C#C,0.1697
C1NC2C1N1N=CC=C21,0.2457
CC(=O)NCC=O,0.2198
CCC(C)(O)C(C)OC,0.3171
CCC1(C)C2C3CC1N23,0.3116
OC12CC3(O)C1CC23,0.3208
C1CN1CCN2CC2,0.3159
Cc1c2c(c[nH]1)NCC2,0.2163
CC(C(O)C=O)C1CN1,0.2014
CNC(=O)NCCOC,0.3046
CCC1C(CCO)N1C,0.2882
O=C1CC2NC2(C1)C#C,0.2251
OCC1CC2CCCC12,0.3371
COCC1(O)CCC1C,0.3273
CC1C(C)(C)C1(C)C#N,0.3088
O=CC1OC1CC1CC1,0.2192
CC1(C)CC2(O)CC1C2,0.332
OC1CC2(O)CC2C1=O,0.211
O=C1C2C3C2C2C3CC12,0.221
COC1CC(C)(C1)C#C,0.3005
CCOc1cc(on1)C,0.2475
OC12CC(C1)C2C1CC1,0.3353
CCC(CC#CC)C#N,0.2894
CN1CCC=CC1=O,0.2026
CC12CC3(C)C(O)C1N23,0.3123
O=C1CC23CCCC12O3,0.2226
CC12CC3(O)C1OC23C,0.2962
O=CNC12CN3CC1C23,0.2482
OCC1COC1CC#C,0.2929
COC1(C)C(O)CC1=O,0.1993
CCC1(C)OC1(C)CO,0.3339
N=CN1C(C#C)C1C#N,0.2464
N#CCC1=NCC2CN12,0.2392
OCC12C=CC3CC1N23,0.2206
c1nc(no1)NC2CC2,0.2217
COC12CC1OC2=NC,0.2655
CC(=NO)C(=N)NC=O,0.2055
CCC12CC(CO)C1N2,0.3188
CC(O)C(C)CC#N,0.324
OC1C2CN3C4C3C2C14,0.2983
OC1C=CC2(NC12)C=O,0.2125
C#CC1CCCCO1,0.2872
CN1C2CC3C2C3C1=O,0.2544
C1CCC2(CC1)COC2,0.3121
C1c2c([nH]nc2O)CO1,0.2483
CC(C)C(O)C1CCO1,0.3203
Cc1c(cncn1)C#C,0.1986
O=CC12CCC1OC=N2,0.2097
CCCn1cc(cn1)O,0.2314
CCCCO,0.3428
CC1NCC2(CN2)C1=O,0.1929
O=CC1CC1OC1CC1,0.2239
CC(C)(C)CNCC#N,0.2688
COc1cc(n[nH]1)OC,0.2597
[NH3+]CC1=CC(O)=C([O-])O1,0.1688
OC1C(=O)C2CC12C=O,0.1912
CC(C)(O)C(C)(O)C#N,0.3202
CC1CC2C3C1CC23C,0.3354
O=C1CC2C(CC12)C#N,0.2171
O=COC1CCC11CN1,0.2555
C1CC23CC(CCC2)C13,0.2986
O=CC1CC11OC2CC12,0.2235
CC1OC2(C)C(C#N)C12,0.2816
CC1C2C3CC3C2C1=O,0.2075
CC1CC2CC3OC1C23,0.3129
NC1=CC(=N)N=C(O)O1,0.2111
O=CC12CN(C1)CCO2,0.18
OC1C2C1C1C2NC1=O,0.2601
c1[nH]c2c(n1)[nH]c(n2)N,0.2037
CC1=CCC2OC1C=C2,0.2281
OCC12C3C1C1C3CC21,0.3008
Cc1conc(c1=O)F,0.1914
CCCc1cnncn1,0.1662
Cc1c(c[nH]n1)NC=O,0.2217
CC(O)CC1CCCC1,0.3311
CC(=O)N1C2CC1C2,0.2473
CCC1COCC1CO,0.3154
CC1OC11CC(C)C1C,0.3233
CC1CCC(=O)C(C)O1,0.209
CCC1OCOC1CO,0.3298
c1c2n(nc1N)CCC2,0.2312
CCC1C(O)C(O)C1O,0.2819
CC12CC(C1O)C2O,0.3262
C#CCN1CC12CCC2,0.2693
CCN1CC(C)CC1=O,0.2697
C(CN=CNC=O)CO,0.2298
CCCC1C2CC1C2C,0.3784
CC1=CCC2(CC12)C=O,0.2176
CC1CC2(NC12)C(N)=O,0.2445
CC1(O)C2CCC12O,0.2799
CCC1CC([NH2+]1)C([O-])=O,0.2636
OC1COCC2OC12,0.3107
CNC(C#C)C(O)C#N,0.2762
N#CC1CC2=CCOC12,0.2356
CC1OC1C(C)(O)C#C,0.2962
CCC(OC)C(=O)OC,0.2618
NC(CCC1CO1)C#N,0.2974
CC12CC(C1)OCCO2,0.3139
CC12CN1C(C2)C#C,0.2711
OC1CN2C3CC1CC23,0.2864
CC(=O)C#CC#N,0.1856
CC1N=C(N)OC1C#C,0.2494
COC1C2C3CC1CC23,0.3335
N=C1NC(=O)OC11CC1,0.2565
CC(C)C1CC(=O)C1O,0.2235
CCCC1C2C3CC2N13,0.3144
CC1C2OC2(C#C)C1C,0.2635
O=C1C2C=CC11OCC21,0.2162
C#CC1C2CCC1CC2,0.3069
CC12NC1CC2=NO,0.2395
C#Cc1c([nH]nc1O)N,0.2226
CC1OCC(CC#N)O1,0.305
O=C1OCC=CC2CC12,0.2321
CC1(O)CC(=O)C=C1,0.1912
COCC12CN1CC2C,0.3132
C#CC1(CC1)N2CC2,0.2818
OC12CC3NC1C23C#N,0.2445
c1cc([nH]c1O)OC=O,0.1924
C1OC2C3OC3C=CC12,0.2336
OC12CC1C=CCC=C2,0.2316
CCOC(=N)OCC=O,0.2258
C#Cc1c(nc[nH]1)C#N,0.1907
CC1(C)OC(=N)C11CO1,0.2702
CC12CN3CC3C1(C)N2,0.2939
CN1C2C(O)C2(C)C1=O,0.2445
CCC1(CN1C)C1CC1,0.3109
CCN1C=NC(C)C1=N,0.2205
OC1(C#N)C2C3NC3C12,0.2611
C1COC(O1)(CO)CO,0.3053
CC1C(CO)NC1C#N,0.2637
C1COCC=C1CO,0.2618
CC12C3OC1C3NC2=O,0.2396
CC(=O)C1CC(O1)C#C,0.2191
OCC1CCC(=O)C1,0.2229
O=CNC(CC#C)C#N,0.2728
C#CC12CC3C(C1)C3O2,0.2725
CC1(O)CC1CC1CO1,0.3231
CC1CC1N1CC1C,0.3103
OCC(O)C1=CNC=N1,0.2459
C1CN=C(OC1)C(=O)N,0.2146
CC1(C)N=C(N)C2OC12,0.2458
CC12CN(C1)CC2C#N,0.2707
CC1CC(C1)C(O)C#C,0.2955
CN1C(=O)NC2CC12C,0.2791
CC(C)N=C(C(=O)N)N,0.216
CCC1(CC1O)C#C,0.2897
O=C1NC2CC(C2)C1=O,0.18
N=C1OCC2CC=CC12,0.259
OCCC1OCC1CO,0.3115
CCC1=NC2(CC2)CO1,0.2503
COC1C(C=O)C1C#C,0.2187
OC1C2C3OCC3C12O,0.2823
CCCC(C)(O)C1CO1,0.3419
CC12OC1C(=O)C=C2N,0.186
CC(CCO)C(=O)CO,0.2384
N#CC1OC2C3CN3C12,0.2396
O=CC(=O)C(C#C)C#N,0.1527
COC(=O)C(CO)C#C,0.2633
c1c(oc(=O)c(n1)N)F,0.1576
CN=C1C(C)N=CN1C,0.2149
CC#CC1CN1CC=O,0.2104
CN(CC=O)C1CC1O,0.1873
C#CCC1(CC#N)CO1,0.2879
Cc1cncnc(=O)n1,0.1514
c1c(con1)CC=O,0.2164
CC1=NCC(=O)N1C=O,0.214
C1CN1c2[nH]nc(n2)O,0.2433
C1CC11CC2C3OC1C23,0.3043
CCCC(=O)OC1CC1,0.2833
CC1NC(=O)C1(C)C,0.2792
OC1=NC=COC1=N,0.169
Cc1cc(oc1N)O,0.2285
CC1CC2OC2C1,0.3455
Cn1cc(cn1)CC#C,0.2536
CCNC(=O)C(=N)OC,0.2185
CC1COC(=O)OC1C,0.3168
N=CN1CCOCC1=O,0.2282
OC1CC1N1C=NN=C1,0.26
FC(F)(F)C1COCO1,0.3518
CC(C)(C=O)C#CC#N,0.2076
CC12CC3CC1(CO2)O3,0.3044
CC1OC2C1C21CCC1,0.3078
CN1CC1CC(O)C=O,0.1868
CC(C)(CC#C)CC#C,0.2944
O=CC1=NC2CC2N1,0.1627
CC1=CCC2(O)CCC12,0.2581
O=COC12CC(C1)C2=O,0.2436
CC1C2CC1C1OCC21,0.3283
ON=C1CNC2COC12,0.2227
CC12CC(C#C)C1(C)N2,0.2735
C1CC2=CCOCCC12,0.2528
CC1OC11CC2C1N2C,0.3039
C1C(=O)C(=O)C(=N1)N,0.1182
OC1C2CC(=O)C1C2=O,0.2032
OCC1CN1CC1CN1,0.2903
O=C1C2CC1OC(=O)O2,0.2009
C1CC11C2CC3C2CC13,0.3578
CC1OC2C=CC(=O)C12,0.1868
CC1=CCC(O)C11CO1,0.2471
CCOCCC(C)C=O,0.2272
c1[nH]nc(n1)CNC=O,0.2351
CC1=C(CCCC1)C#N,0.22
N=C1OC=C(O1)C1CO1,0.2207
CCC#CC(O)CC=O,0.2196
OC1COCCC=CC1,0.2596
CC1C2(C)COCC12O,0.3157
CCC12CN1C1CC21O,0.2813
N#CC12CC1NC2,0.252
CCOC(CC)CC=O,0.2208
CCC1C2CC1C2=O,0.2513
N=C1OC=C(O1)C1CC1,0.2311
NC(=O)C(O)C#C,0.2669
c1cc(nc(c1)F)N,0.203
N=COC1=NC=CN=C1,0.1958
NC1=CN=C(OC=N)O1,0.2229
COc1c(cco1)C#N,0.2162
CC12CC1C1(CC21)C#C,0.2417
c1c(c2c(o1)C=CC2)N,0.1701
CCOc1cnc(o1)C,0.2306
CCC1(O)CC2CCC12,0.3179
COC12CC(CC1)C2O,0.3165
OC1CC=C2CCC2C1,0.256
Cc1cc(oc1O)NC,0.2159
CCCC(C)NC(C)=O,0.2772
CC#CC(O)C1CC1C,0.2863
O=CC1(C#N)C2CNC12,0.2064
O=CCC1C2C3CC2N13,0.2154
N=COC1(CC#C)CC1,0.2771
OC12CC(CCC1)C2=O,0.2208
CC1N=C(C#N)N2CC12,0.2032
Cc1nc2[nH]cnn2n1,0.2367
c1c(ncn1CC#N)O,0.213
C#CCC1CCCO1,0.298
C1OC1C1NC2COC12,0.2952
Cc1c(cnc(=O)o1)N,0.1507
CCOCC(C)C=O,0.2303
CN=C(c1conn1)N,0.189
OCC1=CC2CC2OC1,0.2369
Cc1c(c(=O)cco1)F,0.2011
CC1C2OC(C=O)C12,0.2192
CCC12CC1C1CN21,0.2896
C1CC12CC3(C2)CO3,0.3287
CN1CC1C1CN1,0.2986
Cn1cnc(n1)CCO,0.2636
CC1CC2CCC2=C1C,0.2407
CC1=CCC(=O)CCC1,0.2119
CC1OC1C1COC1=N,0.2854
C1C2OC3C4CCC13C24,0.3236
C1CCC(C1)NCC#N,0.2652
Cc1cc(oc1C)OC,0.2254
CCC12CC1OC2,0.3027
CCCC(C)CCO,0.3419
CC1CC2(COC12)C#C,0.278
CC(C)C1COC(=O)C1,0.2785
c1nc(c(o1)N)N2CC2,0.2125
Cn1ccc(=O)cn1,0.185
CC12CC3CC1(C#C)N23,0.2603
CC12CC3C(O)(C1)C23O,0.2887
C#CC1CC2C=CCC12,0.2602
CC1COC11COC1=N,0.2631
C1C23CC4OC4C12CO3,0.2789
CCC12C3CC1C(O)C23,0.3124
CCC1=CC2NC2(C)C1,0.2397
O=CCC1CN1,0.2221
CC12OC1CC2C#C,0.2904
CC1=CC(=O)C2NC2C1,0.1878
CC1CCOCC(=O)N1,0.2548
O=C1CC23CCC12CC3,0.213
CCC1(CO)CC2NC12,0.2904
CCC(O)C1OCC=C1,0.2458
C1C2C3C(C4CCN34)N12,0.2735
c1nc(on1)CO,0.2519
C1CC2(CC2)CC=C1,0.2689
C1C23CCC12CCC3,0.3041
C(C(=O)N)N(C=N)C=O,0.2078
CC1CC2N=C(N)OC12,0.2749
OCCC12NC1CC=C2,0.2456
CC1(C)NC(=O)C1CO,0.2784
CC(C#N)N1CCN=C1,0.2396
CCC1(CC(O)C1)C#C,0.3014
OC12CCC1C2NC=O,0.2653
c1cc(n2c1CC2)N,0.2292
CCC12CC1(C)C1CC21,0.3342
OC12CC3C(=O)C1C23O,0.2407
C(c1c(onn1)N)O,0.2084
COC(CCO)CC#N,0.287
O=C1C=C2C3C4C(C13)N24,0.1428
OC1CC2OC(=O)C12,0.2707
c1(nc(nc(n1)O)O)N,0.2536
CC1(O)C2OC(=N)C12N,0.2409
OC1C2NC1C21COC1,0.3112
CNc1cnnn1C,0.2302
CC(O)C(CO)C#N,0.2949
O=C1C2CC1C1CC2O1,0.2391
CC1C2C(C)C1C2(C)O,0.3263
CC1CC2C3C4C3N2C14,0.3081
c1c(c(=O)nc([nH]1)O)N,0.1905
OCC1(CC1C#N)C=O,0.2207
CCC1C(O)C1O,0.2792
C1C(=O)CC12CN=CO2,0.2131
C#CC12CN3C1C=CC23,0.208
CC(C)C(O)C(N)C#N,0.2776
O=C1NC2CC3C(O1)C23,0.3039
OC1CCN(CC=O)C1,0.1991
CC(O)(C#C)C#CC=O,0.2029
CC12CCC=C1C=CC2,0.1947
COC12CC1NC2=O,0.2401
C(CO)C#CCOC=O,0.2694
C1CC23C4CCC2C4N13,0.2831
C1CCN(C1)C(=O)N,0.2904
CN=C1C(=O)CCN1C,0.1578
NC1=C(OC=N)ON=C1,0.2002
CCC1CC2OCCC12,0.3143
CCCCC1OC1CC,0.3489
CCC1COC(CO)=N1,0.2733
CCC(=O)OC(C)CO,0.2847
C#CCC(=O)CCC#N,0.2313
N=C1NC2CNC2C1=O,0.1725
COC(C)(C#C)C1CN1,0.2693
Cc1nccc(n1)C#C,0.1906
CCC1(O)CC=CC1C,0.2665
CC#CC1(O)CC2CC12,0.2823
CCC#CC(CO)C=O,0.2168
OC1COCC1C1CO1,0.3259
O=CCC12CC1C1OC21,0.2076
CC1CC2(CN2)C(=O)O1,0.2579
CC1OCC2(C)CC12C,0.3278
NC(=O)C(O)COC=O,0.2625
Cc1c(onn1)C(C)C,0.2257
C1C2NC2C2=C1N=NO2,0.2067
CC12CC(C1)(C=O)C2=O,0.2088
CCC1C2NC2C11CC1,0.3044
N#CC1CN2CCN=C12,0.2383
OC1C2OCC12NC=O,0.2491
[NH3+]C1C2CC(C12)C([O-])=O,0.1287
CC1NC(C)C1(N)C#N,0.2644
CC(C)C1CC=C(C)C1,0.2598
CCOC1C2NC1C=C2,0.2212
CC(=O)N1C2COCC12,0.2566
CCC12CC1CCC2O,0.3222
NC(C#N)C1=NC=CN1,0.2395
O=CC12CC1(CC2)C#N,0.2155
CCC1=CNC=NC1=N,0.1916
OCC1=CCCC1O,0.2606
CN1CC2(O)C1CC2=O,0.1935
C1CC1OCCO,0.3413
CC1C(C#C)N1C(C)=O,0.2493
CCC(CC)(C=O)C#N,0.2226
COC1=CN=CC(=N)O1,0.156
c1[nH]nc(n1)NCC=O,0.2001
CN(C)c1cc(no1)O,0.2288
COC(C)CCC(C)C,0.3331
C1NC11CCC11CCO1,0.2969
CCC12C3OC1CC23C,0.3006
CCC#CC(CC)CO,0.3
C#CCc1cncnn1,0.1643
OC1(CC2OC12)C#C,0.2726
CCCC#CC1(C)CN1,0.2712
C#CCOCC#CC#C,0.2192
C1OC23CC4CC2CC134,0.2888
CN1C2C1C1C3CC1C23,0.3084
Cc1c[nH]nc1CC#C,0.2568
CCOc1cc([nH]n1)C,0.2422
OC12C3CC1(CC2=O)O3,0.2023
CC#CCC1CCC1=O,0.2131
Cc1c2c(co1)nc[nH]2,0.1829
COC1CCC(C)(C)C1,0.3236
CCCC(=O)C1OC1C,0.2215
CC1(O)CC1COC=N,0.2825
OC1CNC2=C1C=NN2,0.2355
O=CC12C3C4OC1C4N23,0.2182
O=CCC12CC(C1)C2=O,0.2207
CC(C)C1CC2CC12,0.3332
C1CC(C1)CC2CC2,0.3586
c1c[nH]c2c1C(=O)CO2,0.1951
CC1C2OC3C(O)C2C13,0.2993
OCC(O)(C#C)C1CN1,0.2661
CCC(C)N=CNC=O,0.2287
COC1C(O)C(C)C1=O,0.2042
OC12CC(OC1)C2C#N,0.2831
CC(C#C)C(C#C)C#N,0.2807
CNc1ncon1,0.2215
CC1=CC2(OC2C1)C#N,0.2329
OC12C3C1C1(O)CC3C21,0.2973
OC12CCC3(O)C1OC23,0.3064
N=C1OCC2=C1NC=C2,0.2074
N=C1CN2N=NC=C2O1,0.222
COC(=O)N1CCC1,0.2908
CC(=O)N1CC(C1)(C)O,0.267
OCC12CC(C1)C2C#C,0.2969
O=CC1CCOC1C=O,0.205
CCC(C)N(C=O)C=O,0.2134
OCCC1NC1CC=O,0.2213
CCC12OC=NC1C2C,0.2551
CC1(OC1C#N)C#C,0.2645
C1OC23CCC4C2NC134,0.2733
CC(C#CC#C)C(C)=O,0.2116
[O-]C(=O)C1CCC11C[NH2+]1,0.2783
CC1=CCCC2(CO2)C1,0.262
O=C1CC2C3NC3C2O1,0.2716
CCC1(NC1C#N)C#N,0.2719
C1NC11COC2CC1C2,0.3123
CC1(CC=CC1=NO)C,0.194
OC1(CC2OC2C1)C=O,0.224
CN=C1OC(C)=CC=C1,0.1628
CC(C)C(C)C(C)C#N,0.3447
CC1CC1C1=CCOC1,0.2375
CC1C2CC3(C)C2OC13,0.3147
CCOC1(CC1)C#C,0.28
CC1CC(=O)CC2NC12,0.2251
CCC(=O)C1(CC1)OC,0.2238
O=CC1C2OC2C1C#N,0.2147
C1N2CC3CC12COC3,0.3097
CN1CC(=O)CC(=O)C1,0.1981
ON=C1CC2(CCO2)C1,0.2464
CC12C3C(C#N)C1CN23,0.2817
O=C1CC2(CCOC2)N1,0.2786
C(=O)c1c(n[nH]n1)C=O,0.1832
CC(C)(COC=O)OC,0.2701
C1CC1(C=O)C(=O)CO,0.2272
CC1=CCCOCC1O,0.2492
c1[nH]c(=O)n(n1)CC#N,0.2373
CC1N=C2OC3C1C23O,0.1558
CC1(C)OC(=N)C(=O)O1,0.223
C1C2C3C1C1N=C3OC21,0.1506
CC1OC11CC(=O)C=C1,0.1881
CCCc1conc1O,0.2533
CC12C3C4C1N2C(=O)N34,0.2283
CC12OC3C4C1N4CC23,0.3069
COC1CC2OCC=C12,0.2339
CC1CC11COC(C)=N1,0.25
C1CC23CC4OC12CC34,0.3094
O=CNCC1(CN1)C#C,0.2597
CC1CC2=C(NC=N2)O1,0.2273
CC(C)N1CC1C#C,0.2576
c1c(ncn1CC#N)N,0.2012
N=C1OC2CC2C1C#C,0.2734
OCCCC1C2CC1C2,0.3428
CC12C3C4CC1OC2C34,0.3098
O=C1CC2CC12C1CC1,0.2306
N=C1NC(=O)COC1=O,0.2129
CC1C[NH2+]C(C1)C([O-])=O,0.2642
OC(CC#C)CC#N,0.2877
CC12CC1CC21CO1,0.3367
CC1N=COCC11CC1,0.273
COC1C2C3C(C)C2C13,0.3365
C(CC(F)(F)F)C=O,0.2302
CC12CCC11CC2CC1,0.3074
CC1N=C2OC3C1C23C,0.1611
COC1OCCC1C=O,0.2262
CC1CC11CC=CCO1,0.2651
CC1CC11N(C)CC1=O,0.1959
NC(=O)C1(O)C2CCC12,0.2573
C1C2CC1COCC2,0.3254
CCC1=CC2CCC2C1,0.2555
OC12CC3C1C3(C2)C=O,0.2193
N#CC12OC1C1OC21,0.2557
CC(O)C1=CN(C)N=C1,0.2517
C#CC1OC11COC1,0.2654
C#CCN(C=O)C(=N)N,0.2399
c1c(coc1CO)CO,0.2322
O=C1CCCN2CC12,0.2137
OC12CC(COC1)C=C2,0.2484
NC(CC(N)=O)C#N,0.2578
CC1(C)COCC1(C)O,0.3007
C1OC2CC3C4CN3C124,0.2916
CC1(C)NC11CC2OC12,0.312
CC1CCCCNC1=O,0.2653
COCCn1nccn1,0.2571
CCc1c(cco1)C#C,0.2111
CC1CC2(C)C(O)C12O,0.2962
CCCC(CO)C1CO1,0.3309
COC1=NC2CCC2N1,0.2708
CN1C2CC3(O)CC3C12,0.2799
[NH3+]CC1NC1CC([O-])=O,0.2749
CC1CCC2(C)COC12,0.3196
O=CC1OCC1CC#N,0.2102
OCC1C(=O)COC1=O,0.2115
C1N2CC3OCCCC123,0.3171
O1C2C3C4C=CC13C24,0.2178
OC1C2C(O)CC12C#C,0.2557
O=CC1COC11CCC1,0.2147
CC1(CC1O)OC(N)=O,0.3087
CC1C2CC1N(C2)C=O,0.2693
CCc1cc(n[nH]1)C=O,0.2006
CC(C)C1CC(C)C1O,0.3072
CCC1(C)CCC1CO,0.3354
CCC12CC(O)C1O2,0.3248
C#Cc1ccn2c1CC2,0.2206
CC12CC3(C)C1C2C3=O,0.2433
CC1=CNC(=O)C1=O,0.1473
CC1=CC2COCC2C1,0.2592
FC1=CC=CC(=N)O1,0.1708
C1C(CC1=O)OC=O,0.2208
COc1nnc(o1)OC,0.2608
O=C1C2C=CC1C=C2,0.2435
CC1(O)C2C3CC2(C)C13,0.3276
CC(OCC=O)C(N)=O,0.2089
COCC(C#C)C(N)=O,0.2635
O=C1C2OC1C(=C2)C#C,0.1974
CC1C2CC(C)C1O2,0.3209
CC12CN1CCC2(C)C,0.2974
CN(C)C(=O)C1COC1,0.264
CC(C)C12CC3C(C1)C23,0.3208
N#CCC1NCC1C#N,0.2641
CC1CCC11NC1C#C,0.2746
C1NC11COC2COC12,0.3054
N=C1OC2CC3CC1C23,0.2778
c1nc2c(o1)OCC=C2,0.1792
CC1(C)C2CN2C11CC1,0.3127
CC1(CO)CC2CC12O,0.3187
CN1CCC11COC1=O,0.2257
CC1C(CN1C=O)C#C,0.2653
CC1=CCC2=CCCC12,0.251
O=C1C2CC1OC=NC2,0.206
CCOC(=N)N(C)C=O,0.2456
O=C1CC(CC2CO2)O1,0.281
CN=c1c(cocn1)N,0.1796
CCC1CC(=O)CO1,0.2196
CC12CC3CC(OC13)O2,0.3407
C#CC(=O)c1nnon1,0.1884
OC(C1CC1)C(F)(F)F,0.3554
CC(C)C1N=CNC1=N,0.226
CCC1=C(C)C(C)CC1,0.2512
C(=O)C(=O)C(F)(F)F,0.1524
C1C(CN1CC=O)O,0.208
CC1OC1(C=O)C=O,0.1956
CC1(C#C)C2NC2C1O,0.2876
OCCC1=COC(=N)O1,0.2351
CC(O)C(C)(C)CC=O,0.2242
C1CC2C3OC4C1N2C34,0.2743
CC#CC12NC1C1NC21,0.2275
C(OCC1CN1)C1CN1,0.3153
OC1CC=CCOC1=N,0.2566
CC1CNCC(=O)O1,0.2407
CC(=O)[C-]1[NH2+]CCC1=O,0.1962
Cc1cc(nc(c1)F)C,0.2244
CC1C2OC2CNC1=O,0.2745
COC1CC(O)C1=O,0.2011
CC(=O)NCC(=O)C#C,0.1719
N=COC=O,0.2636
CC1CC2CC1CC2C,0.3591
CCC12CC(CC1)C2O,0.3139
COC(C)C1OC2CC12,0.3092
c1(c([nH]nn1)O)N,0.2388
CC(=O)C1(C)CC(=O)N1,0.2192
CC1(O)CCC1(O)C#N,0.2859
C1CC23OC2CN=C3N1,0.2439
OC12C[NH2+]C1C2C([O-])=O,0.2618
CN1CCOC(=O)C1=O,0.2105
c1c(=NO)c(n[nH]n1)N,0.157
CC1CC(=O)NC(=O)C1,0.234
OCC1(O)CC2NC12,0.2905
C1C2COC3CN1C23,0.286
CCC1(C)CC2CC2O1,0.3118
COC1CC2OC12C#N,0.259
C(C(=O)OCC(=O)N)N,0.2428
c1c(c(n[nH]1)N)CO,0.2394
CCC1C(OC)C1(C)C,0.3107
CC12OC1CC2C=O,0.2147
CC1CC2N3CC2(O)C13,0.3107
COc1cocc1C=O,0.1832
C1C2C3CN3C3(CC3)C12,0.2928
CC1=NC2(C)CC2O1,0.2609
C#CCC1C2C3CN2C13,0.286
CC1(O)CN2CC2C1=O,0.2119
CC1C=CCC1(C)C#C,0.2614
COC(=O)C1CC1,0.2847
OC1C2CCC=CC12O,0.2341
CC1COC1(CO)CO,0.3005
N#CC#CC1CC2CN12,0.2052
CC1CC2=CON=C2N1,0.2241
CC1CN1C1=COC=C1,0.2184
C#CCc1nc(on1)N,0.2483
NC(=O)N1C2CC2C1=N,0.2495
CC1C2C3CCN=C3N12,0.233
CC1(C(N1)(CO)CO)C,0.3132
C1C(CO1)C#CC=O,0.1992
O=C1CN=CNC1C#N,0.1978
C1C2OC3=NCCN3C12,0.2614
CCc1ccc(o1)OC,0.223
CC12CCC3C4C1C2N34,0.2797
COCC1(CC1)COC,0.3345
c1nc2n(n1)CCNC2,0.2575
CCC1(C)C2N1CC2=O,0.2159
C(C#N)C(=O)N,0.2792
c1c2c(nc(o2)N)no1,0.2216
c1cnc2ccnn2c1,0.172
OCCC1=CCOC1=N,0.2151
CC1(CO1)C#CC1CO1,0.2677
C(=O)c1c([nH]c(=O)[nH]1)N,0.1634
CN1C2CCC12CC=O,0.2165
CC1CC(=O)C(C=O)=C1,0.1618
c1cnc(c(n1)O)F,0.2001
COCC(O)C#CC#N,0.2267
O=C1CNC2CC2C1,0.2127
COC1(CC1C)C1CC1,0.33
CC1OC=NC1C1CO1,0.2671
CCC1COC2CC12,0.3096
COCC1CN(C)C1=O,0.2768
CC(C)Oc1ncno1,0.2561
COC12CC3C(C1)C23,0.3182
CC(C)(C)n1cnnn1,0.2682
OC(C=O)C1OCC1=O,0.2101
CC1C2N3C(C)C2(C)C13,0.3135
COC1(C)C2OC2C1O,0.312
CC12CC3C4C(C13)N24,0.3054
N=C1OC2CC1NCC2,0.2534
C1CC11C2C3C2N2C3C12,0.2982
CC#CC12OC1CC=C2,0.231
CC1(CN1)C1=CC=NO1,0.2351
CCN=C1CC2CC2O1,0.2646
c1c[nH]c2c1nn[nH]2,0.2143
CC12CN1C=CC2=NO,0.1784
CC12CC1C(O)C1NC21,0.299
CC1NC1C1=CC=CO1,0.2248
CNC(=O)c1ccon1,0.2136
CC12C3CC1(C3)OC2=O,0.2485
C1OC1C1CC1C1CO1,0.3375
CC1(C)C2OC(C#N)C12,0.2553
CCC1=CC(=O)C(O)C1,0.1922
OCC1CCC(C1)C=O,0.2295
O=CNC1COCC=C1,0.2487
CC1C=CC2CC12C#C,0.2415
C1CNC=C(C1=O)C=O,0.1729
N=C1CC(CO1)NC=O,0.2713
NCC(N)(C#N)C1CN1,0.2626
COCC1CC=CC1C,0.2606
CC1(CO1)C1=CNC=C1,0.2469
CC1C(O)C2=CC=NN12,0.2611
CC1OC11CCC(=O)C1,0.2205
CC1N=C(NC1=O)C#C,0.1993
Cc1cnc(oc1=O)N,0.1851
OC12C3CC1(NC23)C#C,0.2521
CN1CC2C3C4C1C2N34,0.2795
CC12CC(N1)C=C2C#N,0.1945
CC12OCC(O1)C1OC21,0.3411
NC1CCOC1C#N,0.2669
N=C(C#C)N1CC1C#C,0.216
CC12OC3C(CC1=O)C23,0.214
C1C(=O)OCC(=N1)N,0.2469
C1C=CN(C1=O)C(=O)N,0.217
C1CC=CCCC=C1,0.2589
Cc1cc(c(nc1)O)O,0.2002
CC12C(O)C3C1OC23,0.3008
OCC1C(O)CC2CN12,0.2798
OC1CC2C3CC1OC23,0.3105
OC12C3CC1C(=O)C2N3,0.1999
CC12CC(O)(C1O)C2=O,0.2355
CC1C2CN3C2C13C,0.3225
C1CC11OC2CC3C2C13,0.305
CC12NC1C1NC21CO,0.25
CC(CC(O)C#N)C#N,0.3128
COC1C2NC2C1=O,0.1981
[NH3+]CC1=CC(=O)O[CH-]1,0.2285
NC1=CNC=NC1=N,0.1841
Cc1cn(c(n1)C#C)C,0.1981
CC1=C(COC1)C1CN1,0.241
NC(=O)C1CN=CO1,0.2595
C1C2C=CC11NC1C=C2,0.2123
COC1C(C)NC1=O,0.2567
ON=C1C=C2CN3C2C13,0.1425
CC(=O)C(C)(C)C,0.229
C1C2CN1C1C3CC21O3,0.2868
CN1CCC11CC1C#N,0.2429
C#CC12CC(C1)(O2)C#C,0.2438
CCOC1C2CCC12,0.3239
OCC1CC2CC2C1O,0.3226
CN1CC1C(O)CC=O,0.211
C1CC(=NCC=O)OC1,0.2248
N,0.3399
NC1=NOC(=N)N1,0.2449
CC1C2C3C2N1C3CO,0.318
N=C1CC(N1)(C#N)C#N,0.2432
CCC(C#N)C(C)C#C,0.3024
C1c2c(nno2)NC=N1,0.1799
OCC12CCC=CC1O2,0.2392
CN1C2C1C(=O)OC2=N,0.2249
CC1CCC1OCC=O,0.2285
CC1CC(O)(C#N)C1O,0.2829
CC1NC11COC1C#N,0.2582
Cn1cc(c(n1)N)C#N,0.2076
CC1=CC=C(F)C(=N)N1,0.1632
c1cc(=O)oc(c1)F,0.1791
COC1(CO)CC(O)C1,0.328
CN1CCOCC1C#C,0.263
CN=C1C=C(O)NN=N1,0.1566
CC1NC1C1NC1C=O,0.2207
CC1C2C3OC2(C)C13O,0.2877
OCC12NC1CC2=NO,0.2372
CN(C1CC1)C(=N)C#N,0.2012
CC1CC(=O)C(=C1)C#C,0.1859
CC(O)C12CC=CC1N2,0.2344
CC(C)C1C2C3OC2C13,0.3016
OC1C=CCC2CCC12,0.2588
CC1(OC1CCO)C=O,0.2199
C#CC1=C2CCC2OC1,0.1933
CC(N1CC1)C(=O)C=O,0.1483
CC1(COC1)N(C)C=O,0.2656
C1OC2C1C1N=COC21,0.2545
C#Cc1cn(cn1)C=O,0.1747
OC(C#N)C1NC2CC12,0.268
OC12C3CC11C=CC2N31,0.2166
N=C1CC(C=O)C(=O)O1,0.2258
CC1COC=NC11CC1,0.2569
CC(C)C1OCCO1,0.3415
CC12CC1CN=COC2,0.2583
C1C2CN3CC4C(C13)N24,0.3047
C1OC11CC=C2COC12,0.2401
CC1(CCC1CO)C#N,0.3078
O=C1OCCC1CC#C,0.2656
N=CNC(=O)C1CO1,0.2294
CCC1(O)C(O)CC1O,0.3159
N=COC(=O)CCC#C,0.242
CC1(COCC=C1)C=O,0.2083
c1[nH]c(c(n1)N)C#N,0.1932
CC(C)C12CN3CC1C23,0.2976
CC(OC=O)C1CN1,0.2511
CC(C)c1conc1O,0.2542
CC(C)OC1CC1,0.3236
CC(CN1CC1)C1CO1,0.3206
CC(C)N=c1[nH]cno1,0.2209
Cc1cnc(nc1)CO,0.2079
CC1C(=O)OCC=C1C,0.2557
CC1(CC=O)CC(=O)O1,0.2247
c1cnn2c1NCC2,0.2385
O=C1C2C3CCC1N23,0.2256
CCc1cn(nn1)C,0.2493
CC1CC(C)=CC1C,0.2585
C#CC1(C(=O)CO1)C#C,0.2092
COC(=O)CCCCO,0.2825
CC1(CO)COC1=O,0.2768
OC1C2CCC2C11CN1,0.2977
N=C1OCC2=C1ON=N2,0.1933
CC(=NO)COC=NC,0.2443
NC(=O)C1CC(=O)O1,0.2576
C1C2N1CC21CC=CC1,0.2528
C1NC11COC11CCC1,0.2945
c1cnccncoc1,0.1721
CCCN1C2C3OC2C13,0.2858
CC1C2OC1C2CC=O,0.2176
C#CC(=O)c1nc[nH]n1,0.1929
Cc1c(oc(=O)[nH]1)C#C,0.1909
CC1(C)CN=C(N1)C#N,0.1996
C1N2CC11OC=NCC21,0.2634
c1nc(nc(=O)o1)F,0.2181
CC1OC1C([NH3+])C([O-])=O,0.2664
O=C1C=CC(=O)C1C#C,0.1468
c1c2c(oc(=O)o2)on1,0.2194
O=CC1COCC1C#N,0.2248
C1OCC11C=CC2OC12,0.2379
O=C1NCCCC2OC12,0.2534
C1CC1(CO)C(=O)C=O,0.1621
CC1(CO)NC(=O)C=C1,0.2135
CCC1CC2(CO)CC12,0.3246
CC1=CC(O)CCCC1,0.2506
CC(C)Cc1cnc[nH]1,0.2476
CCC1OCC(CO)O1,0.3413
CC(C)C1(CC1)CC#C,0.3111
CC1C2CC(O)C2C1=O,0.215
c1conc-2ncnc12,0.1638
O1C2C3C1C21N=COC31,0.24
CNC(=O)C1CC1C,0.2753
NC1(CC=CC1O)C#N,0.2627
CNC1=NCCNC1=O,0.1929
C1C(=O)C(=C(C1=O)N)N,0.1485
OC1(CCCC1=O)C#N,0.2164
C1CC(=NO)CCOC1,0.2533
OC12CC1C(=O)CCC2,0.2232
ON=C1C2C3C2C2C3C12,0.2414
CC(CC#N)N(C)C=O,0.2717
CC1C2CN=C(C=O)N12,0.1732
OC1C2OCC(=O)C12,0.2225
OCC1OC2COCC12,0.3166
C1CC1(CO)COC=O,0.2628
CC1C2CC3CC3(C)C12,0.3319
C1OC1C1OCC11CN1,0.2986
CC1(OC=O)C2CCC12,0.2711
CC1=CNC(=N)C(F)=C1,0.1615
COc1cc([nH]n1)C#C,0.2021
CC1OCC(C#N)=C1C,0.2077
O=CC1C2C3C2C2C3C12,0.2201
CC#CC1COC(=O)C1,0.2655
CC1(CC1C=O)NC=O,0.2254
O=C1CCC1C1CN1,0.2112
O=C1CC2(CN2)CC=C1,0.1849
OC(C#N)(C#N)C1CO1,0.2606
OC1(CC1)C(=O)OC=N,0.2301
O=C1CC(CC=C1)C#C,0.1879
CN1C=CC(=N)C(F)=C1,0.1827
Cc1cn[nH]c1OC=O,0.2279
CC1C2C1C1=CCCC21,0.2395
CC1C2C3C2C1(C)C3C,0.3285
N#CCC1(CO1)C1CC1,0.3107
CCN=C1OCC2CN12,0.2737
C1NC23COC4C2OC134,0.2651
C1CC(=O)C=C1C(=O)N,0.1716
CC(C([O-])=O)C1(C)C[NH2+]1,0.2735
CC12CC1CC(O)C2,0.3269
C1OC2=NCC3C1N23,0.2278
N=COCC1CCCO1,0.286
NC(=O)CC(CO)C=O,0.2011
OC1CC2(CO2)C2NC12,0.31
C1CC1C2CC3(C2)CC3,0.3435
CC1CN(C(N)=O)C1=O,0.2475
CC12CC=C3CC1C23O,0.1733
CC1(C)OCC2COC12,0.3235
CN=c1[nH]c(co1)CO,0.2161
COC=NCC1CCC1,0.2664
N=C1OC2CC12CC#N,0.2775
CC1(C)C(CO)OC1=O,0.2787
CC1CC(=N)OCC=C1,0.2608
CC1C(O)C=CC2CN12,0.224
CC12C=CC3OC1C23O,0.2223
COc1c(cc(o1)N)O,0.2162
OC12C3CC1C1C3OC21,0.2992
C#Cc1cn(nn1)C=O,0.1797
CCC1C(C)CCC1O,0.3129
Cn1c2c(cn1)CCN2,0.2282
CC1OC2(C)CCOC12,0.3256
CC12CC3OC1CCC23,0.3146
O=C1C2CCC(=O)C1N2,0.1977
NC(=O)NC(=N)C1CO1,0.2514
CC(O)C1NC1C#N,0.2897
CC(O)C1=CON=C1,0.2457
C1OC11C2C3C=CC1N23,0.2096
CC1CN(C1C)C(C)=O,0.2634
CCC1=CCOCC=C1,0.2064
OC1CC2C3CCC12O3,0.2906
CC12C3CC1C(O)CN23,0.3023
C1C2CN3CC2OCC13,0.3123
CCCOc1cc[nH]n1,0.2453
C(C=O)OC=NCC#N,0.2198
OC1C(O)C1C1CCC1,0.2818
C[NH2+]CC1(CC1)C([O-])=O,0.2788
c1cnc(cc1O)CO,0.239
c1c(cnc(n1)F)CO,0.2132
CC(C#C)C1OCC=C1,0.2476
C#CC(=O)C(=O)N1CC1,0.1601
CC1NC(=O)OC1=N,0.2714
CC1(CO)CNC(=O)O1,0.3128
O=C1CC2CC3OC1C23,0.2027
Cc1cc(nn1C)NC,0.2174
COC1C2C3OC1C23C,0.3032
c1c[nH]c(c1OC=O)O,0.2006
CC(OCC(C)=O)C=O,0.2199
C#CC12C3CC1C=CC23,0.2277
CCC(C)(C)OC(=O)C,0.2783
CCC12COC(C1)C=C2,0.2463
CCC(C)C1CC1OC,0.3135
c1c2c(n[nH]1)COC2,0.2436
CC1C=CC2C3CC2C13,0.2476
c1c(ncn1CCO)O,0.228
COCC(O)C1OC1C,0.3345
C1CC1C#CCN2CC2,0.2709
O=CC12NC3C=CC1C23,0.1874
CC1=NCC(O1)C1CC1,0.2712
OC(CC=O)C1COC1,0.2255
CC(CC=O)C#C,0.224
COC(C#N)C(=O)C#C,0.2062
COC1=CC(=N)C=NN1,0.1694
CC1=CC2(C)C3CN2C13,0.2112
C1C2C3OCC1C23,0.3208
CC(=O)C1CC=C(C)C1,0.2227
C1CC1CC(=NO)CO,0.2508
CC1C2CC(=NO)C12C,0.2435
N=C1OC(=O)C=CC1=O,0.1585
O=C1N2CCC2C11CO1,0.2213
COCC(=O)NCCO,0.2642
CCC1(C)CC1(C)C,0.33
c1nnc2n1nco2,0.2253
CC(C)n1nnnn1,0.2737
CC1=C(NN=C1)C1CO1,0.2405
O=CC1(CC2CO2)CN1,0.2182
CN1CCNC(=O)C1=N,0.199
C1CC1(CC=O)C=O,0.2178
OCCC12NC1C1NC21,0.2673
C1C=CC2OC1C1OC21,0.2536
O=C(C#N)C1OC1C#C,0.1858
N=C1CN=C2CN=CN12,0.207
OC1C=CC(=O)C11CC1,0.1901
C#CC1(CCO1)C#N,0.2588
c1c(nnnn1)CC=O,0.1625
CC(C)C1(CN1)C#C,0.2854
C1C2CC3CC12OCC3,0.3116
c1[nH]c(c(n1)N)C(=O)N,0.1803
CC(=O)Oc1cnno1,0.2312
CCCN1CCC(=O)C1,0.193
Cc1nc(on1)COC,0.249
C1C2OCC3C4CC23C14,0.2443
O=CC1(CN2CC2)CN1,0.2102
CCC1=CCC=CCC1,0.2516
CC1NC1C1(C)CCO1,0.3053
NC(C#N)C(=O)NC=N,0.2306
CC(O)CC1OC2CC12,0.3183
CN(C)c1[nH]c(=O)[nH]n1,0.2424
CN1C=CNC(=N)C1=O,0.1743
OC(CCC#C)C#C,0.2849
CC1OCC1N1CC1,0.3183
CCN=C(C)NC=O,0.2339
OC12CC1NC(=O)CC2,0.2589
OC12C3CC(OC13)C2=O,0.2028
CC(=O)C1(CC1)N2CC2,0.2216
CC(CO)C1C2CCC12,0.3274
O=C1CCC2(CN12)C#C,0.2392
NC1=C(CC2CC12)C=O,0.1814
OC1(CCOC1)C#C,0.2778
FC1=NC=NOC1=N,0.1771
CC1=CC(=O)NC=NC1,0.2076
NC(=O)C12CN1C=NC2,0.2402
CN(CC#N)C(=O)N,0.2776
CCn1ccnc1C#N,0.2086
C1CC11C2CC3C2OC13,0.3171
OC1CCC11NC1C#N,0.2696
OC1(CC1)C1NCC1=O,0.2072
Cc1cc(n(n1)C)CO,0.2443
c1c([nH]nn1)CCCO,0.2525
CC12CC3(CO3)C1(C)O2,0.3253
CC1OCC2CC1C2=O,0.223
C1CC2OC=NCC12,0.2771
CC1C2CC(C2)C1(C)O,0.3239
NC(CC#N)C#N,0.2767
CC1OC2(CC2)C1(C)C,0.3017
CN1C2CC(=CC12)C#N,0.1902
c1c2c(c[nH]1)OCCN2,0.231
C1CC2C=CCOCC12,0.2462
OC1COC1=NC1CC1,0.2517
CC1OC1C(=O)CO,0.227
OCC(NC=O)C1CO1,0.2753
C1OC1C12CC1C1NC21,0.2762
CC1OC2(CC2O)C1=O,0.2091
COC(C)C1(CO1)C#C,0.2805
CN(C=N)C(=O)CC=O,0.223
COC(C)C(=O)C#CC,0.1897
CCC12CCOCC1N2,0.3128
CC1=CC(=O)CC1C#C,0.1928
CN1C(=O)C=CC1=O,0.1761
CC12CC(N)C1(N2)C#N,0.263
CC1(COCC=C1)C#N,0.2571
O=CN1C=NCC1C#C,0.2247
CC12NC1C1=CCCC21,0.2347
N=C1C=COC(=C1)C#C,0.1744
CC1N(C)CC(=O)C1=O,0.1182
OC12CC1C1NC2C1=O,0.2396
CN1C=CC2=C1ON=N2,0.1313
N#CC12CCC1O2,0.2755
FC(F)(F)CC1CN1,0.3273
N=C1OC(CC=C1)C=O,0.2131
CC1CC(O)C(O1)C#N,0.2893
C#CCCn1nnnn1,0.2381
CCC(C)CC(C)OC,0.3275
CC(C)c1cnoc1,0.2463
Cc1cc(=O)c(c[nH]1)N,0.1797
CC1CCNC(=O)CC1,0.2705
CC1(O)CC2NC(=O)C12,0.271
CC12CCN3C4C3C1C24,0.2805
CCC(=O)OCC(C)C,0.2861
CN(C)C1CCOC1=O,0.2336
OC12C3CC1(CC23)C#N,0.2736
COC(=O)C(N)CO,0.2419
CC(O)C1(CO1)C(C)O,0.329
C#CC1C=CC2CC1O2,0.2366
CC(C#N)C(=NO)C#C,0.2073
OC1COC1CC1CO1,0.3065
CC1CC2=C(N1)OC=C2,0.2125
CC1(O)C2CCC2C1=O,0.2034
CC12CC3OC1C23C,0.301
CC(=O)C12CC(C1)CC2,0.2265
CC1C2C3C2C2C3N12,0.2981
CCC#CCC1(CC1)O,0.2895
CC1C2CN1CC(=O)N2,0.2389
CC1CC11CC2(CO2)C1,0.3289
Cc1cnc(cn1)C=O,0.1688
Cc1nc2n(n1)cco2,0.2326
COCc1ncc(o1)N,0.2135
C1CC1(C#N)OC(=O)N,0.2972
CC1C2CN(C)C(=O)C12,0.2639
COC12CC1(C)C(=O)C2,0.2311
CCC1CN1CC=O,0.2162
N=C1OCCC1C#C,0.274
N=COCCC#CC#N,0.2319
CCC#CC1CC=CC1,0.2639
CC1C2(O)C3CC2C13O,0.2993
COC(CO)COC=N,0.2748
COCC1COC(=O)N1,0.3124
CCC(C)C#CC#CC,0.2273
CC1(CC1)OC(=N)C#N,0.2332
CC12CC(O1)C(=O)C2,0.2138
CC1=CCC(CO)C1,0.2601
O=C1N2CCC2C11CN1,0.2265
OC1CC(C#N)C11CN1,0.2861
COC(=O)CC1(CC1)O,0.267
CC1CCOCC1CO,0.3124
NC(=O)C1CC1N1CC1,0.2654
CC1=C(COC(=O)C1)C,0.2507
OC1C2NC2C2NC12,0.283
CN=C1NC(CO1)C#C,0.2482
CN=c1c(=O)occo1,0.1841
CC1OC1COCC#N,0.2776
CCC1=CCCCC1=O,0.1913
CCC12CC(C1)C(C)=C2,0.2361
CCC12OC=NC1C2O,0.2531
CC1CC(C#N)C11CC1,0.3114
CCC(C)C(C)(C)OC,0.3237
CC12CC3N=COC1C23,0.2603
CN1CC1(C#N)C1CC1,0.2668
C#CC(CC#N)C#N,0.2932
OC(C#CC#C)C1CO1,0.2216
CC1CC=CC2(CC2)O1,0.2443
COc1c([nH]nn1)O,0.2166
CC(=O)C12CC(=O)C1O2,0.2007
CNc1c(con1)C#N,0.1992
CC(C)C(C)(C)C(C)O,0.3283
CC12CC(COC1=O)O2,0.2471
Cc1c(nnn1C)CO,0.2432
NC1=CC(=N)OC1=O,0.1711
CC(CO)C1(CC1)C#N,0.3033
CC#CC1(C)CN1,0.2721
OCC12CC3C(OC1)C23,0.2899
CC1CC2(CO)C(O)C12,0.2991
C(C1CN1)N1C=NC=N1,0.2684
CCC1=NC(C)CCO1,0.2677
OCC(=O)C1NCC1O,0.1999
C1CC(O1)C1=CON=N1,0.2235
CCOC1(C)CC1(C)C,0.3238
C1CN1CC(=O)C#N,0.1764
C(C(F)(F)F)OC(=O)N,0.3284
C#Cc1c(cc(o1)N)N,0.1811
Cn1c(ccn1)N2CC2,0.2414
CC1OC2CCC2O1,0.3227
CC(C=O)C(C)C#C,0.2254
CCN(C=O)C(=O)C#C,0.2057
COCC1OC2CC12O,0.2963
NC(=O)OC(=N)CCO,0.2616
C#CC12CC3C4C(C14)C23,0.2774
NC1=CON=C(N)C1=N,0.1571
C1CC23OCOC2C3O1,0.3053
C1CC2C1N2C1COC1,0.3198
C#CCC(C#N)C1CC1,0.3037
C1CN1c2nnon2,0.1995
CCC1OC2CC1C2O,0.2985
CC(C)CC(CO)C#N,0.3085
CC(OC=O)C(N)C#N,0.2728
OC12CC(C3NC13)C2=O,0.2301
CC1(O)CC(=N)NC1=O,0.2447
C1C(=O)NC(=N1)CC#N,0.2342
OC1CNC2=C1N=CO2,0.2146
CC12CCC11OC2C=C1,0.2204
NC(=O)C1C2OC1C2O,0.2593
NC(=O)N1N=NOC1=N,0.1999
CN1C=CC(=O)OC1=N,0.189
CCCC1=CCOC1,0.2483
c1c(c(c([nH]1)N)O)C=O,0.1744
CC1=CCC(O)(C1)C=O,0.2141
O=COC1CCC1C=O,0.2255
CC1(O)C2COC12C#C,0.2385
CC#CC(N)(CO)C#N,0.2632
CC1C2OCC1(O)C2O,0.2874
CC1C2NC2C(O)C1C,0.3032
CC1OC2CNC2C1=O,0.1972
CC1C2OCC1(O)C2=O,0.202
CC1COC2C3CC2N13,0.3019
C1C2NC11C=CCOC21,0.2336
CC1C2N1C1C(O)C21C,0.2773
c1(=O)n(nno1)C(=O)N,0.2253
COC1CCC1,0.3316
[O-]C(=O)C[NH+]1CCCC1,0.2644
CC1=C(C(=O)NC1)CO,0.2261
CN1Cc2cn[nH]c2C1,0.2328
CNc1cc(ccn1)F,0.2019
OCC1CC1(CO)CO,0.3035
C#Cc1ccc([nH]1)O,0.1932
CCC#CC1=CCOC1,0.2041
CC1=CCc2n1ccn2,0.203
O=C1NC=CCC2CN12,0.2251
C#CC1CC2OC12C#C,0.2601
COC12C3CN(C13)C2=O,0.2301
CC1(COC1)CCC#N,0.2895
C1CC(=C2CC=CC2)C1,0.2362
C#CCc1cc(no1)O,0.2444
CC12CN1CC1CC21O,0.2915
COC(C)C1(CO)CN1,0.3104
OC1C(CC#N)CC1=O,0.2205
NC1=NOC=C1C1CO1,0.2344
CCC1C[NH2+]C1C([O-])=O,0.2624
C1C2C3CC1N=COC23,0.2581
CCC12CC3CC1CC23,0.3481
OC1(CC1)C1NC1C=O,0.2209
CCC1(CC)OCC1C,0.3098
CC1CCOC2CC12C,0.3193
c1[nH]nc(n1)C#CC=O,0.1868
CC1=CC(=NO)C(O)C1,0.1922
N#CC12CCOCC1N2,0.2866
N=C1OC(CC1=O)C#C,0.1884
COCC1CC1C(C)O,0.3146
CC1C2CC1CC(=O)C2,0.2189
OC1C=C(CC1=O)C=O,0.189
C1CC(C1)C1C2CCC12,0.3312
NC(=N)N1C2CC2C1=O,0.223
OCCCC1(CO1)C#C,0.2867
Cc1nc(cn1C)C#C,0.2174
N#CC12COC1C1OC21,0.2676
CCC(=O)C(C)(C)OC,0.2302
Cn1ccc(=O)c(c1)N,0.1785
CC1CC(=O)C11CC1,0.2184
CC1=CCC2CC1(O)C2,0.2489
C1C2OC3=C(C=CO3)C12,0.2206
C1C2C3CC(C3)N12,0.3322
CN=c1ccocc1O,0.1808
C1OC2CCOCC2=C1,0.2381
OC1(CC2CC1C2)C=O,0.2257
CC12NC1(CC2O)C#N,0.261
CCC(=O)CC(O)C#C,0.2284
CC1CC2(C)C3CC2C13,0.3723
O=C1C2CC2C11CN1,0.2268
COC1C(C=O)C1(C)O,0.2207
c1conc1OC=O,0.2495
N=C1OC2C3CC12C=C3,0.2245
O=CC1OC23CC(C2)C13,0.2146
CCC1OCC(O1)C#C,0.2873
CC12CC3CC1CC3O2,0.3333
CC1C2C3CC2C1(O)C3,0.3212
CCC1OC1C1OC1C,0.3362
OC12CC1(O)C1OC1C2,0.2892
C1CCC(C1)OCCO,0.3298
CC12C3C(CCN13)C2=O,0.2201
CC1C2CC1C21CO1,0.3512
NC1=NCC2CC2C1=O,0.1798
OC1CC1C#CCC#C,0.2722
C1C2CCC11CCOC21,0.3278
c1c(c(c(cn1)F)N)O,0.2141
N#CC1CNC11COC1,0.2671
CC#CC1CC1NC=O,0.2661
OCCC(O)CC#C,0.3029
OCC1CCC2CC1O2,0.3128
Cn1nccn1,0.2577
CCOC1CN=C(N)O1,0.2831
OC1C2C3CC2(C=O)C13,0.2182
C(C1CC1)C1C2CCC12,0.336
CC(CO)C1OC1C#N,0.2702
CN1C2C(O)C2OC1=O,0.2881
O=C1C2C3CC1(C#C)N23,0.2257
C1CC11C2CC1O2,0.3214
OC1C2N=CNC2C1=O,0.1865
C#CC12CC(C1)C1CC21,0.2931
CC1CC2(O)CC2C1C,0.3262
CC(=O)CC1OC2CC12,0.2291
CCCCCC,0.3957
O=C1CCOC2CC2N1,0.2693
CC(=O)C#CCCC#C,0.2075
CC(C)(O)C1CC1C#N,0.2918
OC12C3C4C1C4(C=O)C23,0.2138
C1CC2(CC2)NCC1=O,0.1992
OCCCC(O)C#C,0.297
C#CCC1CN1C1CC1,0.2808
CC1OC2=NCC3C1N23,0.2303
O=C1CC23CCN2C1C3,0.1946
OCC1CN2N=CN=C12,0.269
CC(C)C1CCC11CC1,0.3446
OC1C2COC(O2)C1O,0.3285
c1cn2c(n1)CC=CC2,0.2246
CCC1C2C(O)CC12C,0.314
CNC12CC1(NC2)C#N,0.2341
C1CC23C4C5C4C2C5N13,0.2949
CC1C(C)C(C)(O)C1C,0.3081
CC1CC(O1)C1COC1,0.3222
CCN(C=N)C(=O)N,0.2513
CC1N=CN(C=O)C1C,0.2214
C(c1c(onn1)C=O)O,0.1813
C1CN1C1COCC=C1,0.2537
COC12CN3C1CC23,0.3287
OCC12CC1(O)C=CC2,0.2476
OC1CCC2(CC2)C1=O,0.2222
C#CC12CCC1C2C#N,0.2602
CC1CC(C)=CC1(C)C,0.2591
O=C1NCC2(CN2)C=C1,0.2066
COC1CC11CCCO1,0.3165
CC1CC11CC(C1)C#C,0.3014
CC(O)C1=CC(C)=CO1,0.2346
CC12CC(CC#N)C1N2,0.2977
O=C1C2COCC1O2,0.2289
CC1=CC2CCC2C1=O,0.1929
COCC1C(C)OC1C,0.3171
CC1CC(C)(C)CC1=O,0.2213
C1OC2CCC=CC1O2,0.2489
CNC1C2OC(C)=NC12,0.2243
c1c(nno1)C#CC=O,0.1847
CC12COC(CC1O)O2,0.3137
OC12C3OC1CCOC23,0.2821
C1C2OC3C=CCN1C23,0.2147
CC(C=O)C1CO1,0.2261
CC(CO)OC1CCC1,0.3243
CCC1CNC(=O)N1C,0.2938
NC1=[NH+]C(=N)C=C([O-])N1,0.1583
c1nc(=O)c(=O)[nH]nn1,0.1623
CNC1(CC1C#N)C#N,0.2357
CCCNc1ccc[nH]1,0.2389
CC1(COC(N)=O)CN1,0.3052
CC(=N)OC1CC(=O)C1,0.2209
Cc1coc(c1N)NC,0.2189
CC(=O)c1cnncn1,0.1411
CC#CC(NC=O)C=O,0.2122
CC1N2CC(O)C12CO,0.2939
OC12CC1C1OCOC21,0.3226
CC1(CC1)C#CC=O,0.2043
C1CC1(C(CO)CO)O,0.3056
CC(O)C1C2CN2C1C,0.2921
OC1CC2C3N2CC3=C1,0.2131
OCC(=O)C1CO1,0.2272
CC12CN3CC(CO1)C23,0.2848
C1C2NC1C1=NOC=C21,0.2351
CNC(=O)c1cc[nH]n1,0.2263
ON=C1C=CCC1O,0.194
Cc1c[nH]nc1CO,0.2554
CCCC(=O)CC1CN1,0.2261
c1c(c(no1)N)CC=O,0.1817
O=C1C2CC3C4C1C2N34,0.2101
C(C=O)c1nc([nH]n1)N,0.2113
C1C2C3OC4COC13C24,0.3093
O=CC1CCC(=O)CN1,0.1837
O=C1CC2N=COC2O1,0.2649
O=CC1CC2(NC12)C#N,0.207
NC1=CC(N)=CC(=N)O1,0.1736
CCCC1CC2CC2O1,0.3211
c1c[nH]c2c1onc2,0.2065
C#CC1=CC(NC1)C#N,0.2014
CC1C(O)C11CCOC1,0.3105
Cc1cc(nn1C)C#C,0.2219
CC1C2CC3(COC13)O2,0.3144
OCC1CCCC2OC12,0.3351
CC1CC2(CC12)C(N)=O,0.266
CC1OCCC(=O)C1O,0.2124
C1C=CC2C3OC=NC123,0.2354
CNc1c[nH]cc1C=O,0.1675
C1OCC2C3NC3C2=C1,0.2388
OC12CC(C1C=O)C2=O,0.2096
N=C1CC2(CCC=C2)O1,0.2542
Cc1c(nn[nH]1)CC#N,0.2491
COC(C1CC1)C(N)=O,0.262
CCC1=C(C)CC2NC12,0.2401
C1OC2C1C21CC=CC1,0.256
Cc1c(nco1)N(=O)=O,0.1929
CC1(CCC1)C2(CC2)C,0.3347
CC(O)CC(=O)C(N)=O,0.1774
N#CCC12CC1COC2,0.2929
CC1=C(O)C(=N)ON=N1,0.1697
OCCC1CNC(=O)O1,0.3137
CC(C)C1C2N1CC2=O,0.2179
CCC1CCN=C(C)O1,0.2718
C12C3C1N1C4C1C3C24,0.3079
CC(O)C1CC(O)C1,0.324
CC#CC1(CC1)O,0.2712
N#CC1NCC11CO1,0.2676
C1CC(C1)CC#CC=O,0.2052
OCC1C2CCC3C2N13,0.306
OCC1C=CC2CN12,0.2312
CC(O)CC1OCC1O,0.2952
CC(C=O)C1=CN=CN1,0.1748
CC1CNC(=O)N1C,0.2948
CC1C2COC1C21CC1,0.3249
CCc1ccn[nH]1,0.2573
CC1C2CC3CCC1C23,0.3356
CCC12CC1(C)N=CO2,0.2594
CC(O)C1(CO)CO1,0.3338
O=C1NC2CNC2=C1,0.212
OCC12CC(O1)C21CO1,0.317
CC12C(O)C1C1CC21,0.2756
OCC(=O)CCOC=N,0.2356
C1CC1OC1C2CC1O2,0.3165
OC1CCCC=CC=C1,0.2035
CC12CC(C1)C(=O)C=C2,0.1861
N=C1OCC2N1CC2=O,0.2044
CC1(O)C(C#C)C1C#N,0.2729
OCC1N2CC1(C2)C=O,0.1932
C#CC#CCC=O,0.2075
Cc1ccn(c(=O)c1)C,0.1813
N=C1NC=NC(C=O)=C1,0.1476
CC1(C)C2CC2(O)C1=O,0.2279
CC1(O)C(OC1=N)C#C,0.2735
CCN1CC1(C)COC,0.3055
CC1N2CC(O)C12C#C,0.2457
OC1C2CC3C2OCC13,0.3134
CC12CCCC1(O)C2O,0.2828
CCC(=NO)C#CC#C,0.1759
c1c(c(co1)N)C=O,0.1689
CC1OC2CC(=NO)C12,0.2424
N=C1OC=CC=C1C#C,0.1489
C1C2OC1C1OCOC21,0.3224
CC12NC1C(=O)C=C2,0.1758
CC1CC1C1(C)CN1C,0.2987
OC(C#CC#N)C1CC1,0.2357
CC#CC12OC1CC2O,0.2586
CC1C2CCN1CC2=O,0.2025
CCOC(C)CC(C)=O,0.2316
O=CC12CC(N1)C1NC21,0.1983
c1c2c(ncn1)OCO2,0.2061
CCN=COC(C)C,0.2734
COC(C)CC(C)CO,0.3263
CC1C2CN2C1CC=O,0.216
C1C2C3C1N1CC=C3C21,0.1551
CNC(=O)N1CC(C1)O,0.2946
CC1(C)CC2C(C=O)C12,0.2173
C1CN1CCNC=O,0.2706
CC1=CNCCOC1=O,0.1944
CC#CC1(C)CCC=C1,0.2569
CC1C(C=O)N2CC12C,0.2098
CCC(O)C1CC(=N)O1,0.2902
COC1CC1C1OC1C,0.3231
CN=C1NN=C(F)C=N1,0.1309
CC1N=COCC11CO1,0.2726
O1C=C2C=CC=C2N=N1,0.1525
CC1CC2N1CC2=O,0.1997
CC1CC1C1=NNC=C1,0.251
CC1CC1C1CC1O,0.3203
CC12CC3OC1OCC23,0.3329
OC1CC2C3COC2C13,0.3055
O=CCN1C2C3OC3C12,0.2098
CC12CC1OC(=N)C2O,0.2689
OC12C3CC(C13)C2C#N,0.2848
CC1CCC1(O)C#N,0.3072
OC1COC1C1CO1,0.3184
CCOc1ccco1,0.2298
C1COC(=N1)CNC=O,0.2612
COC1(C)CC1(C)C#C,0.29
CC12NC(=O)C1(O)C2O,0.2402
CC1C=CCC2CC12C,0.2639
O=CNCC1OC1C#N,0.2535
N=C1OC(=O)CC2OC12,0.2514
C1OC2CC3OCCC123,0.3099
CN=C(N)C(O)C#N,0.2436
CN1CC1(CCO)C#C,0.2722
O=CN1C=NC2CC12,0.2133
CC1(CC1)CCOC=O,0.2857
Cn1cnn2c1ncc2,0.216
CC1OC(C=O)C=C1C,0.2021
c1cc2n(c(=O)c1)CC2,0.1819
CCNCC1(CN1)C#N,0.2632
CC1(C)CC2CC12C#N,0.2867
FC1=CC(=O)OC(=N)O1,0.2225
CCN1CC1CC(C)C,0.3031
C1COC(=N1)CN2CC2,0.2568
COC1CC=CC2CC12,0.2464
CNC1=COC(=N)O1,0.2362
CC1(CCCOC1=O)C,0.2697
O=COCC1CC2OC12,0.2758
Cc1cc(=O)oc(c1)F,0.1826
C1CC=CN(C1)C(=O)N,0.2201
CC1CC2C=CCOC12,0.2599
CC1=NC(=N)C=C(O)O1,0.1962
COCCC(O)C#C,0.2834
CC1(O)C(O)C1(C)O,0.2896
OC1CC2C=CCC12O,0.2534
C1C23COCC12N=CO3,0.2564
CCC1C(CO)C1C#C,0.2876
CC12C(O)C3C1CC23O,0.315
COC12COC(CO1)C2,0.328
NC(C#N)(C#N)C1CO1,0.2782
CCC1(CO)OC1(C)C,0.3299
O=CC1CC2CN2C1,0.2048
CCC(=NO)C(O)CO,0.2393
CC1=C(C)C(C)(O)CC1,0.2559
CC1COC(=N)N1C=N,0.2382
C#CC12CCN1C2C#N,0.2452
Cc1c(noc1N)N,0.2354
CC1OCC1C(O)C#C,0.2677
C#CCC1C2C3CN3C12,0.2728
CC(C)(O)C(O)C1CN1,0.2876
Cc1c(nc(cn1)F)N,0.1878
COC1CCOC(=N)C1,0.275
N=C1ON=NC=C1C=O,0.1408
O=CC1(CC2CC12)C#C,0.2135
C1CC2OC(C=C2)C=C1,0.2406
CC1(NC1CC#N)C#N,0.2852
CC1CC2CC(C2)C1,0.3519
CC12C3C4C5C3C1C5C24,0.3215
CCC1CC(C)OC1=N,0.2837
CC1OCC(=O)C=C1C,0.1799
c1nnn(n1)C2COC2,0.2315
C#CC12NC1CC1OC21,0.2583
CC(=O)N1CC(C1)(C)C,0.2684
CC1(C)CC(C1)C1CO1,0.342
C1CN(C1=O)CCC#N,0.2779
CCC(C)C1NCC1=O,0.2172
COC12C3CC1OC2C3,0.3097
CC1OC(=O)C2OCC12,0.2433
CCC1CN2CC(C2)O1,0.2922
C#CC1CCOC1C#N,0.2914
CCNC(=N)C(O)C#N,0.2261
C1CC2OCOCC12,0.3371
Cn1c(c(nn1)O)C#N,0.2015
C1OC2C3C2C2OC3C12,0.3144
CCC1CC1(O)CC,0.3205
C#CC(=O)c1ccc[nH]1,0.1657
C1CC1CN(C=N)C=O,0.2269
OC1(CC1)C12CCC1O2,0.3161
C1OC11C2C3C4C2C1N34,0.2998
CC1=NOC(=N)N1C=O,0.2014
CC1(CC(C1)CC#N)C,0.3317
CC#CC1(C)OC1CO,0.2773
ON=C1CC(C1)OC=O,0.2469
c1nc(on1)OC(=N)N,0.2482
CC1(CCC(=N)O1)C#C,0.2835
O=C1NC(CO1)C1CO1,0.3111
CC1N=C(N)C(=O)C1=O,0.117
C1CN1C12CC1COC2,0.3051
N#CCC1C2CCC12,0.3109
C1C2N1CC21CCO1,0.3028
CC1OC11CCNC1=O,0.2505
O=CC1CC1CC#C,0.2272
CC1C(O)CC1(C)O,0.3205
CC12OCC1(C#C)C2O,0.2539
CC1OC=NC1CC#C,0.2649
CC1=CCOC(=NC)C1,0.2478
c1c(=O)nc(on1)CN,0.1794
CCC1CCCC1(C)C,0.3616
Cc1ccncc1C#N,0.2116
C1CN=C(C1=O)NC=N,0.1764
O=COC1C2NC1C2=O,0.2431
CC1=C(O)OC(=N)C=C1,0.1636
CC1CC1CC(O)CO,0.3273
CNc1ccc(cn1)N,0.1688
CC12CC(C)(C1)C(=O)C2,0.2278
CC(=O)N1CCC12CC2,0.2504
CCC(O)C1CC1C=O,0.2233
O=CC12C3CN1CC2O3,0.1858
CC1C(C)C1C1CCO1,0.3184
CC#CCC1(C)CC1C,0.303
C#Cc1ccccc1O,0.1901
OC12CC1C=C(C2)C#C,0.1985
O=CC1CC2C1N2C=O,0.2124
C#Cc1coc(n1)CN,0.2147
CC1=C(CCC1)C,0.2545
CC(=O)C1=C(CCC1)N,0.1807
CN1C(COC1=O)C#C,0.2751
CC(=O)C1(O)C2CC1N2,0.204
CN=C1C=CCCCO1,0.2049
CC12CC(O)C1N2C=O,0.2402
CC12COC11CCC1O2,0.2872
CC1CNC2=NON=C12,0.2068
CC1(COC1)C(=O)C#C,0.1879
N=C1OCC2(CO2)C1=O,0.1747
CCC1(O)C2NC(=O)C12,0.2469
OC1CC1C1CC1C#C,0.2886
Cc1c(ocn1)C(=O)C,0.1963
CC(=O)NC(=O)C,0.2232
OC1C2NC1C(C=O)=C2,0.1768
C#CC12CC3CN1CC23,0.2606
Cc1[nH]c(=O)cc(n1)N,0.1914
CCC1=CCC2C(C)C12,0.2441
CC1C(C)C(=O)NC1=O,0.2376
CC(C)OC1C2COC12,0.3009
COc1c(nno1)N,0.2116
CC#CCN1C2CCC12,0.2869
[O-]C1=C2C[NH2+]CC2=CO1,0.1267
C1c2c(nno2)NC1=O,0.182
CC#CC(C)(C)NC=O,0.2746
[NH3+]CCC1NC1C([O-])=O,0.263
CC12CC3(OC1C23)C#C,0.249
OC12CC1C1NC(=O)C21,0.2585
C#CC12CCC3C1OC23,0.2719
CC12CN3CCC(O1)C23,0.2793
CC1CC2C(C#N)N12,0.2616
OC12CC1C1CCC1=C2,0.2366
CC12CC1COCCO2,0.3182
O=C1COC(=O)C2OC12,0.212
c1c(c2n(n1)CCC2)O,0.2334
C#CCc1c[nH]c(n1)O,0.2545
OC1C23CCOC12CN3,0.2738
CC1(C=CCC1=O)C#N,0.2189
COC(=O)C(N)C#CC,0.2499
C#CC1(CN1C=O)C#C,0.2421
CCOC1C2C3CC3C12,0.2802
CCC12CCCC1C2C,0.3277
OCC1CC2N1CC2=O,0.2007
CC12CCC1(CO)C2O,0.2948
OC1CC2=C(C1)N=CN2,0.2399
OCC12CN1C1CC21,0.2901
c1cc([nH]c1)OC=O,0.2083
CC1=NC(C)(CO1)C=O,0.2131
CN1Cc2c(non2)C1,0.1887
CC12CC1C(=O)C=C2N,0.1961
OC1COCC=CC1,0.2637
CC1C2CC1C=CCO2,0.248
c1c(nc2n1nn[nH]2)N,0.1778
COC12CN3C1C2C3C,0.2984
CN1CC2CNC(=O)C12,0.2414
CC#CC1N2CC2C1=O,0.2086
OC1CCOC11CC1,0.293
CC1OCC23CC(O2)C13,0.3119
CCC12CC(=NO)C1O2,0.2468
CCc1ccoc1C#C,0.1956
CC(C#N)C#CC1CN1,0.2562
O=C1OC=NCC11CN1,0.2331
CCN1CC1CNC=O,0.2557
OC12COC1C(=O)C=C2,0.1748
Cc1cc2n(c1O)CC2,0.2267
CC1CC2C3C4C1C2N34,0.3143
NC1CC(=N)OC1=O,0.2406
COC1C(C)C(O)C1O,0.2973
CC12CC1N1CC21C=O,0.1924
NC1=CNC(=N)C([O-])=[NH+]1,0.1628
CC12C3COC1OCC23,0.3306
C#CC1C2CC3(CC3)C12,0.2897
C1CC(=O)N2C1=NCC2,0.2367
NC12CN=C3NC1C23O,0.1918
CC1NC1C#CC1CC1,0.2714
COc1nc(no1)C=O,0.194
OC1=CC(=N)N=CO1,0.1941
CC1=CC(=O)C2CC1O2,0.1747
O=COC1CC(C1)C=O,0.2294
CC12OC3CCC1C23O,0.2901
CC12CN1CC2(C)C=O,0.2073
COCCC1(COC1)O,0.3088
N=C1NC(C=O)=CC1=O,0.1266
CC(C)c1c([nH]nn1)N,0.2297
CC1C2OC=NC12,0.2559
COC1(C)C(O)C1C=O,0.2214
CCCC(C)C1(O)CC1,0.3024
OC1CC2CC2OC1=O,0.2729
OCC1C2CC1C2C=O,0.2174
COCCOCC=O,0.2294
C1CC1C12CN3CC1C23,0.307
CC1C(NC1C=O)C=O,0.1996
CC1(C#C)C2C3CC3N12,0.2497
Cc1c(occ1C#C)C,0.2098
OCC12CN1CC(=O)C2,0.2071
CC1(CO)C2OC=NC12,0.2532
CC1COC11COC1C,0.316
OC1CCC(=O)NC1,0.2673
Cc1coc(n1)N2CC2,0.2313
CC(C)C12C3C4C3N1C24,0.279
[NH3+]C12CN(C1)C2C([O-])=O,0.264
CCC1CC1(C)CC,0.3403
NC(=O)C1OCC2NC12,0.2737
CCC1CC1(C)COC,0.3346
CC1(CN1)C(=N)NC=O,0.2277
Cc1ccc(o1)N,0.2186
CC1OC2C(O)C12C,0.2985
CCCC1OCC1OC,0.319
CCC12CCC1(C)CO2,0.3091
CN1C2C3CC1C(=O)C23,0.2036
CN(C)c1c(nc[nH]1)O,0.2268
CC1(C)C2COC12C,0.309
CCCOCCCO,0.3278
Cc1c(con1)NC=O,0.2192
OC1C2NC11COCC21,0.319
OC12C3CC1OC23C=O,0.2177
CC1OC(C)C1(C)C#C,0.2911
NC(=O)NC1C2CCC12,0.2904
COC1C2COCC12,0.307
CC1=CCOCC1(C)C,0.2609
OC1CCC(OC1)C#N,0.2818
C(C1OC2CC12)N1CC1,0.3079
OCC1C(O)CCC1=O,0.2214
CC(C=O)C(O)CC#N,0.2214
CNC(=NC)C(=O)NC,0.2059
CC12CC(C1)C=C2C#C,0.1908
Cn1cc([nH]c1=O)C=O,0.1611
CC1=CC2OC1C2C=O,0.1982
O=CNC(C#N)C1CN1,0.2591
O=C1CNC11CC2NC12,0.2026
C1C2OCC3C=CC1C23,0.2581
COCCC#CC(C)O,0.2922
CCOC(C)C(O)C#C,0.2977
Cc1c(ccnc1O)O,0.2237
COC1C(C)CC1C,0.3169
CC1(C)C2CC1C2,0.3748
[O-]C(=O)C1CCN1C=[NH2+],0.2482
CCC1(OC1C)C1CN1,0.3165
Cc1cnc(c(=O)o1)C,0.1703
OC1(C#N)C2C3CC3C12,0.2471
C1CC(C1)(C(F)(F)F)N,0.3373
NC12COC1CNC2=O,0.2647
Cc1c([nH]c(n1)C)C#C,0.2005
CC1CC1C1CC1(C)O,0.319
c1cnn(c1N)CC#N,0.2257
CC1C(C)C11C2CC1C2,0.3335
CCNc1ccco1,0.2187
CC1OC2C(=O)OC12C,0.2465
CC(C)CC(=O)CO,0.2404
c1coc(c1N)CO,0.2093
CC(C)CC1OC1CO,0.3404
CC(O)CC(C#C)C#C,0.2947
OC12C3C1C1=CC2OC31,0.1863
OC1C=CC(C#N)C1O,0.2455
OC12CC1(O)C1CN1C2,0.2863
CCOC(=N)C1(C)CN1,0.2684
CCNC(=O)C#CC=O,0.1891
Cc1cn(cc1O)C,0.2325
CC(C)OCCCO,0.3259
CC(CCCO)CC#C,0.3137
CC(CCO)OCC#C,0.283
NC(=O)CC([NH3+])C([O-])=O,0.2539
OC1C23CCC12CCC3,0.2897
FC1=C(F)C(=N)ON=C1,0.1696
NC(CO)C1=NON=N1,0.1938
CC(C)CCC1OC1C,0.3403
CC12COC1CC1CN21,0.3061
CC1(O)C=CCNC1=O,0.253
O=C1OCC2C(C#C)C12,0.2619
COCc1cnccn1,0.1973
c1nc([nH]n1)NC2CC2,0.2511
CCCN=CNC=O,0.232
CC#CCC#CC1CN1,0.2661
CC1(C)C2OCCOC12,0.3052
Cc1cc([nH]c1)CO,0.2344
OC1C2NC1C(=O)C2O,0.2041
O=CC1C2C3CCC1C23,0.2185
OC1CCC2(CN2)C1O,0.307
C1C2OC11CCCC21,0.3064
OC1C2C3OC3C12C#N,0.252
NC1=C(C#C)C(=N)OC1,0.1882
CCOCCC(C)CC,0.3306
OC1CC(=O)C(=O)C1O,0.139
CC(C)C1(O)CC1(C)O,0.2828
OC1C2COC2C1C=O,0.2158
CC(C)C1CC(C1)C=O,0.2263
C1CC(=NO)C=CNC1,0.1786
CC12CC(C=O)C1CO2,0.2155
NC1=NNC(=N)NC1=O,0.1641
CC1C2C3OC2(C=O)C13,0.2082
CN1CCC2OC(=N)C12,0.2461
CC#CC1CCN1C=O,0.2635
CN=COC(C)C1CO1,0.2755
CCC1N=C(C)OC1C,0.2676
CC(CCC#N)C1CC1,0.3253
C(COC(=O)N)C=O,0.228
CCOC(=O)CC#C,0.2683
C1OCC2OC3C(O1)C23,0.3101
C#CC1CC=CCO1,0.2641
CNC(C=O)C(O)C#N,0.2086
CC1=Cc2conc2C1,0.2018
COC1CCCC1C,0.3226
C1OCC2OC2C2OC12,0.3031
[NH3+]C1CC1C(O)C([O-])=O,0.2672
CC(C)OC(=O)N(C)C,0.2998
CC1(O)CC2CC2C1,0.3324
C1C=C(C(=O)C1=O)C=O,0.133
c1c(nncn1)CO,0.1656
c1c(cnoc1=O)C#N,0.1664
CC1C2C3C1C2C3=NO,0.2608
OC12C3CC1(NC23)C=O,0.1974
O=C1CC23CC2(CC3)N1,0.2579
CC(CO)CC(C)C=O,0.227
O=CC12CCC1=CCC2,0.204
C1C(CO1)NCC(=O)N,0.247
O=CC#CC12CC1CO2,0.1832
Cc1cc(oc1N)CO,0.2104
O=CC1(CC1C#C)C#N,0.2133
O=C1CN2C3CC2C3O1,0.2342
N#CCC1(CO1)C#N,0.301
CCOCCC(O)C=O,0.2156
CCOCCCC1CC1,0.3391
CNC1CC1(C#N)C#N,0.2353
Cc1c(c(=O)onn1)N,0.1683
CC1=CC2COC1(C)O2,0.2464
CC1C2COC12CC#C,0.2823
O=C1CCOC1C#C,0.2125
CC(O)C(CO)CC=O,0.2287
CC1C(O)C=CC11CC1,0.2459
CC(CO)OC=N,0.2822
CC1(CCN1)C(F)(F)F,0.3063
CC(O)COCC(C)=O,0.213
O=C1CCC(=C1)C1CO1,0.1872
CC12OC1C(O)C2=NO,0.2365
C1CC2OCCC12,0.3202
COC1C2CC(O2)C1C,0.3186
C1C2(CO1)C=CC(=O)N2,0.2122
CC1=CCC23CC12CO3,0.2387
OC1CC2OC1C(=N)O2,0.2827
CC(O)C1=C(N)C=CO1,0.2093
CC12OCC3(C)OC1C23,0.2924
OC1CCN2CC12C=O,0.2085
C1C=CC2OCCCC12,0.2521
CC12CC1CC2CO,0.3214
NC1=C2CCN2C(=O)O1,0.2167
C1C=Cc2c(n[nH]n2)O1,0.1842
CC1CC2C(CO1)N2C,0.297
CC1OC1(C)C1(C)CO1,0.3338
CCC1CC2CC(C)C12,0.3272
N=C1NN=NC=C1C#N,0.1483
Cc1cccc(c1)OC,0.2205
CC1C2CCC(=O)OC12,0.2686
Cc1c[nH]c(n1)CCO,0.245
CC1C2OC(OC12)C=O,0.2006
C#CCC#CC1CC1,0.2752
OC1CC23OCC2CC13,0.2906
OC12C3C4C(C1N34)C2=O,0.2165
C1C2(CN1)C(=O)OCO2,0.236
CC#CCOC(=O)NC,0.2841
CCC1CCC2OC2C1,0.3387
NC1C(O)C(=O)OC1=N,0.2274
CC1OC(CO)C=C1C,0.246
CC(CC1CC1)C#C,0.3141
OCC1CC2NC1C2=O,0.231
COC1CC(O)C1CO,0.3094
COC1COC2CC12,0.3107
COC1(C)C(C)C1C=O,0.2216
C1C2OC1C1=C2OC=C1,0.2162
OC12CC3(C#C)C1NC23,0.2666
N=C1OC2CC2C2CC12,0.2686
CC#CC1OC2CCC12,0.2642
c1c2n(c(=O)[nH]1)CCC2,0.2264
CN1C(CC#N)C1C#N,0.259
CC(C)C1(COC1)C=O,0.2223
C(C1CO1)C1=COC=C1,0.2421
CC1OC2C=CC1C2=O,0.2159
CC1CC2C3CC3(C)C12,0.3285
CC12C3C4N1C4(C)C23,0.2824
NC(C#C)C1=NCCO1,0.2651
CC1(C)CC(=O)C1O,0.2231
CC1NC1C1=CN=NO1,0.2189
O=C1CC23CC12OCC3,0.2192
COC12C3C4C3C1OC24,0.3079
C1COCC12COC2,0.308
OC1CC(OC=N)C1O,0.2513
CCCc1c([nH]nn1)N,0.2303
CC1CC=C(C)C1(C)C,0.2598
N#CC#CC1(CN1)C#N,0.214
C#CCC1(CC#N)CN1,0.2844
COCC1COC=N1,0.2617
CC(O)CC1NC1C#C,0.2709
CC12C3CC4C3N1C24C,0.3061
CC1CC2N3CC3C12C,0.2938
CC#CCC1CCOC1,0.2956
CCC(O)CC1CC1O,0.3233
C1COC2=NCCC2=C1,0.2046
C1CN1C1CC2OC2C1,0.3089
CC1(O)CNCC1=O,0.1933
C#CC1C2OCC12C#N,0.2568
CC1C2(O)CN(C)C12C,0.268
CN=C1ON=COC1=N,0.2072
CC1CCC(CC#C)C1,0.3149
CC12CC1C(O)C2=O,0.2136
C#CCC12OC1C1OC21,0.285
OC1CC2(CC2)CC1=O,0.2229
OC12C3C4C1C2(C=O)N34,0.1781
CC1(C)CCC1OC=O,0.2856
OC1CC2CC3CC12O3,0.3001
N#CCN1CC2OC2C1,0.2576
O=C1OC2C3OCC1C23,0.2521
CC1CC(=O)OC1(C)C,0.2775
CC(C)C(=N)NC=O,0.2296
CN1C2C3OC3(C)C12,0.2925
C1C23COC12CC=CC3,0.2479
OC(CC(F)(F)F)C=O,0.2358
O=C1C=CC=CC2OC12,0.1648
CC1NC1(C=O)C#C,0.2172
CC1CN(C1)C=O,0.2664
CC1N(C)CCC1=O,0.1913
NC(=O)C(O)CC1CC1,0.2713
FC(F)(F)C12CC1CO2,0.3121
CCC1=C(C)CCC1C,0.251
O=C1CC2OCCOC12,0.2053
CC1OC(=O)CC1O,0.2742
CC12OC1(CC2=O)C=O,0.1926
CC1=CC2CC(CC1)O2,0.2379
NC12CC1(CO)OC2=N,0.2596
C#Cc1c(cncn1)O,0.1816
CN=COC(=O)C#C,0.2065
O=CN1C2C3CC=C1C23,0.1473
CC(NC(=N)C#N)C#C,0.21
CCC(CC)(COC)O,0.3256
OC1C2CC=CCOC12,0.2525
CNC1=CC(=N)C=NO1,0.1628
CC1(O)C2CC(O)C12C,0.3054
CC(C)C1NC1C1CN1,0.302
CC(C)C1COC(C)=N1,0.269
OCC12CN1C(C2)C#N,0.2709
C1OC1C1=CCC2CC12,0.2335
CC1CC(CO)(O1)C#C,0.2785
CC12CC1OC(O2)C=O,0.2
ON=C1C2CC(O2)C1O,0.2374
COC1CC2C(O)C12,0.3102
N#CC1C2CC1N2C,0.2576
C[NH2+]C(CC([O-])=O)C=O,0.2049
CC1CC(C)(N1)C#N,0.2712
C1CC23COCC12O3,0.3144
C1CNC(=O)C=CN1,0.2038
CC12CC(C1)C(=O)N2,0.2598
CC1=CC2C3CN2C13,0.2121
Cc1c(nc([nH]1)CO)N,0.2121
CN1CCC1C(=O)CO,0.2048
CC12CCC1O2,0.3397
COC(=O)C1NCC1C,0.243
OCC1=CC(=N)OC=C1,0.1708
CC1C2CC1C(=O)C2,0.2277
Cn1c(ncn1)NC=O,0.2292
CC(O)C1CCN1C=O,0.2631
OCCC(CC#N)C#N,0.2971
CC1C2C3C1CC23O,0.3204
CC12C3C1C1(C)OC3C21,0.3283
CC1CC2C(O1)C2C#N,0.2766
CC1N2CC1(O)C=CC2,0.2214
OCC12CC1OC=N2,0.2554
CC1OC(=N)CC1=NO,0.245
OC1CC2(CC2)N2CC12,0.2971
CC1C2COC1C2C,0.3292
COCC1CC(C1)C#N,0.2953
N=C1CC2(CN2)CCO1,0.2691
CCc1c(cc([nH]1)O)O,0.23
CC12CC3C4C3C1(C)C24,0.3024
O=C1NC=CC11CCO1,0.1947
CC(C(C)=O)C1(O)CC1,0.2201
CC12CC3(CO)CC1C23,0.3061
CCC(C=O)(C=O)OC,0.1886
C1C=CC2OC=NCC12,0.2507
CC1C(CO)C2(C)CN12,0.2926
COC1C2(C)CC1(C)O2,0.3103
OC12CC1CC(=O)OC2,0.2754
CC(C)C1(C)CC1O,0.3302
CN=COC1C2COC12,0.2708
CC(C)C(C)CO,0.3403
CC1C=CC2=C1C=NO2,0.186
O=C1OC2CC3OC1C23,0.2443
CC12CCC3N1CC23O,0.3111
C1OC2C3OC1OC23,0.2952
C#CC1CC11CC2CC12,0.2803
CC1OCC2C(O)C2O1,0.3077
NC12CN=C3OC1C23O,0.1175
O=C1NN=C2C3CC3N12,0.2203
c1cn[nH]c1N,0.244
NC(C#N)C(C#C)C#N,0.2791
CC1C2C3C2C(=O)N13,0.2449
CC(CO)CNCC#N,0.2695
OC1CC1C1=CON=N1,0.2182
O=CNC1CC1N1CC1,0.268
CN1C2CC3C2C(=O)C13,0.2048
C1COCCOC1,0.3276
c1c[nH]c2c1occ2,0.2038
CC1CC2(C)OCC2O1,0.3251
CCOc1cocc1C,0.2366
C#Cc1[nH]c(cn1)CO,0.198
CC1CCCOCC1O,0.3073
CC1OCC2(CO2)CO1,0.3278
C1CC23CC(C4NC24)C13,0.3032
CC(=O)N1C=CCC1=O,0.2121
CC1CC11C2OC1C=C2,0.2291
CCC1(CCOC1)C#N,0.3059
CC1(CO)CC(=N)O1,0.2867
Cc1[nH]c2cocc2n1,0.1906
NC(=O)C(=O)C1CCO1,0.1692
OCC12C3C1N1C3CC21,0.2785
O=C1CNC2COC2C1,0.2139
OC12CC(C1)C2,0.3397
Cc1c2c(n[nH]1)COC2,0.2429
NC1C2OCOC12C#N,0.2478
CCOc1nccn1C,0.2452
c1c(nc(c(n1)F)F)N,0.1787
CCCC(CC)OC,0.3272
CC12CC(O)C1OC2=O,0.2738
CC1(CC#C)CC2NC12,0.2827
COC12CC1(O)C(C)C2,0.2973
CCC(=NO)CCC=O,0.2204
CC1NC2CNC2C1=O,0.1892
CC(O)C(C)(O)C#N,0.3028
Cn1c(=O)oc(n1)N,0.2473
OCC1NC11COC1=O,0.2614
CC1(C)CC(C)(O1)C#C,0.2829
CCCOC(C)C(C)=O,0.229
Cc1c2c([nH]n1)C=CC2,0.1917
CC1CC1(C=O)C=O,0.2089
CC(CO)C1(C)CC1,0.3378
CC1(N)C(OC1=N)C#N,0.2539
CC1C2C(C)C1(O)C2C,0.322
NC(C#N)C(O)C#N,0.2912
CCC1CC2(CO)NC12,0.2869
C1C2C3C=C4C=CC13C24,0.1198
COC(CN1CC1)C#N,0.2644
c1c(=O)[nH]c(=O)oc1O,0.2278
COC1CNCC(=N)O1,0.2553
CN1C2COCC12C=O,0.2039
CC1=CCCCC(=O)C1,0.212
CC(=O)C(C#N)C1CN1,0.2218
CC1C2CC1C(C2)C=O,0.2241
CCOCC1=CCOC1,0.2505
OC12CC1N1CC2(O)C1,0.2718
C1OC23C4OC2C4C3=C1,0.2532
OC12C3C4C3C1(C#C)C24,0.2483
CC1C2OC1C2(C)CO,0.3067
CC1COC2(COC2)C1,0.3131
C1CC1Oc2nnon2,0.2134
OC1CN2CCOCC12,0.2808
CC12CC1OC(=N)CC2,0.267
CC#CC1COCC1C,0.296
NC(=O)CC(O)C=O,0.1944
O=CC1=CC2C3CN2C13,0.1603
CN1CC(O)CC(=O)C1,0.2043
CC1C2OC2(CO)C1O,0.3028
OCCC1CCC2CC12,0.3422
COCC(COC)O,0.331
c1nc(n(n1)C2CC2)O,0.2585
O=CC12CC3OC1C2O3,0.2236
CC12COC3C=CC1C23,0.2331
CCn1ncc(n1)C#C,0.2199
N=COC1=NNC(=N)N1,0.1955
Cn1cnc(=O)c(n1)F,0.1961
CNC(C)C1(CN1)C#N,0.2612
OC12CC1C(=O)C2C#C,0.2194
CC1=NC(=N)C(F)=NO1,0.2027
CCC12CC1CC=C2,0.2479
CC1CCC2(O)COC12,0.3084
OC1C2CCC(C=O)C12,0.2298
COCCN1C2CCC12,0.3219
CCC(C#N)C1(C)CN1,0.2776
C1CC2C3C4C3N2C14,0.3032
C1C2NC2C2=C1C=CO2,0.2232
OC1C2CC1(N2)C#N,0.268
CN1C(=O)CC12CCC2,0.2768
CC1CN=C(O1)C(C)=O,0.1973
OC12CC(C1)C21CCC1,0.3355
CC1C(C)C1C(=O)C#C,0.2013
c1c2c(on1)CCCO2,0.2143
CC1(CN=CO1)C#C,0.2703
CC1=NC=C(N1)C1CO1,0.2321
C1C2OC3CCOCC123,0.3049
c1cncc2c1[nH]cn2,0.2107
CC1C2N1C(=O)C=C2C,0.2005
c1c[nH]cc1C#CCO,0.2135
CC1=C(C)CC(C1)C=O,0.2133
CCN1CC=C(C1)C#N,0.1774
CC1(C)C2(C)CC1(O)C2,0.3297
CC12OC(C)(C1O)C2=O,0.2248
C1CN(C=C1CO)C=O,0.2065
OCC1OCC(O)C1=O,0.2125
OC1COCC(=C1)C#C,0.2112
C1CC1(CO)N2CC2,0.2917
CCC1N(C)CC1=O,0.1989
N=C1NN=CC=C1C#C,0.1404
OC1CC1COCC#N,0.2809
COCc1ncncn1,0.2145
Cc1cc(cc(n1)F)F,0.2336
CCN1CC1C1CN1,0.2986
CC12CC1CC(C)(C)O2,0.3054
CCC(C)C(=O)CC#C,0.2212
C#CC1(CC1)CCC#N,0.2884
NC1CCOC1=O,0.2533
OC1C2NC1C1OC21,0.312
CC12C3N4CC1C4C23C,0.2887
CC1CC2C1N2CCO,0.3267
CCC1(O)COC(=N)C1,0.2864
Cc1c[nH]c(c1C)C=O,0.1816
c1nc(no1)N2CC2,0.2279
Cc1c(cc([nH]1)C#C)N,0.1819
CC(=O)NC(=O)N(C)C,0.2409
CC12CCC34CN(C13)C24,0.3047
CC12C3C1C1C(O)C3N21,0.2948
CC#CC(C)OC(N)=O,0.288
C#CC12CC1COCO2,0.2701
OC1C2CC2(C=O)C1O,0.2169
CNc1c([nH]c(n1)N)O,0.2327
OC1C2CC(O2)C1C#C,0.2895
O=CC1CN1C(=O)C=O,0.1681
CC(O)C(=NO)C#C,0.2054
N=CN1CC1(C#C)C#C,0.2363
Cc1ccccnc1=O,0.1709
CC1CC2(OC12)C#C,0.2633
CC1OC11CCC1C#C,0.2902
CC1CC2(C)C(O)C12,0.3121
OC1CC2(CC12O)C#N,0.2646
C1C=Cc2n1nnc2N,0.1668
CC(O)(CO)COC=N,0.2789
c1coc(c1CO)CO,0.2274
CNc1[nH]c(cn1)C=O,0.1692
OCC12NC1C1OC21,0.2762
CC1CC11CC(C)C1C,0.3345
CC(C=O)C1CC2CC12,0.2236
NC(=O)C1(CC#C)CO1,0.2625
C1C2CC3CCC3=CC12,0.2455
CC12NC1CN1CC21,0.2923
CC(O)CNC(=N)C#N,0.2106
OCC12CC(CC1)C2=O,0.2283
CCC1CC(=O)CC=C1,0.2249
CCC1C2CC1(O2)C=O,0.2083
CC1N=COC2CNC12,0.2589
C1C2(CC13CO3)COC2,0.3097
C1OCC1C1OCC=C1,0.2458
OC1C2CN2C11CCC1,0.2995
CC12C3CC(O)C1CN23,0.2914
CC12NC1C1OCC21,0.292
C1C2C3OC4C3CC4N12,0.271
CCC(CO)CC(C)O,0.3172
NC12CC(O)C1C2C#N,0.2757
c1coc(c1C#N)CN,0.2172
CNc1noc(=O)n1C,0.2577
CC(CO)C1OCC1C,0.3086
CCOCC1NC1CC,0.3241
NC1=NC(=O)NC(=N)O1,0.2421
N#CCC1=CC2OC2C1,0.2401
CN1C2C3OC2(C#C)C13,0.2319
OC12CC1CC21CCC1,0.3011
CCCCCC(C)C,0.382
CC1(C)CCC1C#N,0.3256
CC(OC(N)=O)C=O,0.2288
CCC(=O)CCC=O,0.2281
CC1CC1OCCC#N,0.2926
CCN(C)C(=O)C#N,0.2195
OC12CC1OCC=CC2,0.2557
CN(C)c1cc[nH]c1,0.2235
CN1C2CC3CC3(C)C12,0.3017
CC12CC3COC1C2O3,0.3021
Cc1ncnn1C=O,0.2187
CC1=C(C)C(O)CCC1,0.2496
COc1ccc(cn1)O,0.1875
O=C1NC2CC(=O)OC12,0.2609
OC12CC1N1CC1C2,0.2994
CN(C)c1ccc[nH]1,0.23
CC1C(NC1=O)C(N)=O,0.2593
CCC(OCCO)C=O,0.2148
CC1CN2C(CC#N)C12,0.2751
C#CC1CC2NC2CO1,0.2849
CC12COC(C#N)C1N2,0.2764
CCCC(O)C#CC#C,0.2238
CC1(C)C(O)C1C(N)=O,0.2458
C(C=O)C#CC(F)(F)F,0.2265
C1COCCC1O,0.3279
CC#CC12CNC1CO2,0.2475
CC1OC1(C)C(C)=NO,0.2551
OC1C2C3CN2C13C#C,0.2528
CC(O)C1CC1(C)C,0.3299
Cc1c(cc([nH]1)O)NC,0.2175
CC(=O)C1(C)OC2CC12,0.2184
COC1CCCOC1,0.3222
ON=C1C2OC2C1C=O,0.2141
O=CC12CC(C1)N1CC21,0.2088
OC1=NNC(=N)NC1=N,0.1793
c1c2n(nn1)CCNC2,0.2505
O=CC1C2CCCCN12,0.1934
O=C1CCC2OC2CN1,0.2669
CCC12CC3C1N2C3=O,0.2505
c1c(ocn1)NC(=O)N,0.2358
CC(C)C1COCC1C,0.3083
N#CC1=NC2CC(C2)O1,0.2211
COCC(C)(O)C(C)=O,0.2276
COc1nc(no1)C#N,0.2232
OC1CC2CC(=O)C1O2,0.2144
CC1(C)CC1OC=O,0.2724
CC1OC(C)C1(C)C#N,0.2885
CCCCC(=N)NC=O,0.2317
CCCC#CC#CC#C,0.1858
C1CC2(C1)OC1CC2C1,0.3225
CCC1C2OC2C1C#N,0.2952
CCC1(C#C)C(C)C1C,0.2889
c1c(nnc(n1)CO)F,0.1684
C1c2c(nn[nH]2)CN1,0.2311
CC12CC3C1CC23C#N,0.3118
CC1C2NC2C1CC=O,0.2152
CC1CCC2OC12C=O,0.22
O=CN1CC2=CCCC12,0.2368
O=C1CCOC(O1)C#N,0.2672
COC(C)C#CCO,0.2775
CCC1NC1(CO)C#N,0.2842
CC12C3C4OC1C2(O)C34,0.2905
C1CC(=O)N(C1)C(=N)N,0.2202
C1C2OC1C1=NOC=C21,0.2449
Cc1cc2c(o1)[nH]cn2,0.2166
CC12CC1OC(C=O)=N2,0.1807
CC(OC(=O)C#C)C#C,0.2288
CC1C2OC1C(C)C2C,0.3198
OC1CCC(=C1)C1CO1,0.2428
C1C(CC(=O)C1=O)C=O,0.1428
c1coc(c1N)NC=N,0.1963
CC#CC#CCCCO,0.2273
C#CCNc1ccoc1,0.2235
CC(C)C1CC1(N)C#N,0.2768
OC(C#C)C1(O)CC1,0.2737
C(COCC=O)O,0.2287
CC1CC2CCC1(C)O2,0.3219
CCN1CCCOC1=O,0.2945
CN1C2COC3CC3C12,0.2965
CCOC(=N)C(O)C=O,0.2205
OCC(C#N)N1CCC1,0.2712
ON=C1CC2C(O)C12O,0.23
CCC1CCCC=C1C,0.2586
CCC12OC1CC21CO1,0.3251
CCC1=CNC(=O)CC1,0.2096
CC(C#C)N(C)C=O,0.2697
CC1=CC(=CCCC1)C,0.189
OCC12CC1(O)C1CC21,0.2979
CC(O)C(C)OC=N,0.2812
CC1C2C3(CC3)CC12C,0.3275
OC(CC1(O)CC1)C=O,0.2176
OC1=CN=C(N1)C1CN1,0.2265
CC1(NCC1=O)C#C,0.2089
C#Cc1cc(on1)C#C,0.1984
C1N2CCC3OCCC123,0.3182
OC12C3CC1N3C2C#C,0.272
OCC12N(C)C3C1OC23,0.2752
CC1C2C1N(C)C2C#N,0.2365
OC(C#N)C1OC1C#N,0.2908
CC1OC1CNC(N)=O,0.3031
N=C(OC=O)C#CC#N,0.1945
CC(=O)c1cnnn1C,0.2015
Cn1cc(nc1)CC=O,0.209
COC(C)C#CC(C)=O,0.2077
CCC12CC(O1)C(C)=C2,0.2341
CNC1(C=O)C(O)C1O,0.1935
CCc1cc([nH]c1O)O,0.2187
O=CCC1(CO1)C1CC1,0.2227
CC12OCC(C1O)C2O,0.2949
CC1=NN2C3CC3C2=N1,0.2332
OCC12CC1(OC2)C#N,0.2483
COCC1(CCN1)C#N,0.2691
CC12CN1CC2C=O,0.2076
CCC12COC1C(=N)N2,0.2495
NCC[NH2+]CC([O-])=O,0.2676
CC1C2C(CN12)OC=O,0.2465
CC1=CC2CN2C(=O)N1,0.21
Cn1c(nc(n1)C#N)N,0.2168
c1(c(nc([nH]1)N)O)O,0.2167
N=C1ON=CN1CC#C,0.2281
OCC12CN1CCOC2,0.2918
N=C1CC2COC2CO1,0.277
CC1=CC2C(O)C2(C)C1,0.2339
CC(CO)N1C=CN=C1,0.2536
CNC(=N)C(=O)C1CO1,0.1662
CC1OC(=O)C1NC=O,0.266
COC1CC1CCC=O,0.2279
CC1C2C=CC(C#N)C12,0.2436
C#CCOC1OCC=C1,0.2577
COCCc1cnno1,0.2307
C1C2CC1C1=C2NC=C1,0.2254
OCC(O)C#CCC#C,0.275
OCC1OC1C1COC1,0.3246
N=C1NN=NN1C=O,0.1871
OC1COC(C1)C1CC1,0.3213
CC1CC(CC(N)=O)O1,0.2676
CCC12CC(C)C1C2C,0.3217
O=C1OC2CCCCC12,0.2809
c1c(cncn1)NC=N,0.1962
O=C1NC2C3CC12CC3,0.2551
CC1C2CC1(O2)C(N)=O,0.2674
CC1C2C1C1=NC=CN21,0.2252
COC(C)CCC(C)=O,0.235
C#CC1C2C3NC3CN12,0.2517
CCCCC(C)(O)C#C,0.3005
CN(C)c1c[nH]c(=O)o1,0.2312
CC1(C(=O)NCCO1)C,0.2639
CC1=C(CN)NC(=N)O1,0.2167
CC12CC(C1)CC2(C)O,0.3265
CC12C(O)C1C1CCC21,0.2936
CC1C=CC2(CN2)C1O,0.2371
C#CC12CC3CCC1C23,0.2737
CC1(CC1CO)C1CO1,0.334
CCC1OC1C#CCO,0.2656
c1c(c([nH]n1)CC#N)N,0.2139
CCCC(O)C1CO1,0.3486
CC12C=CC3CCC1N23,0.2197
CC12NC3C(=O)C1C23C,0.2278
OC12CC1C=CC2C=O,0.2083
N=C1NN=CC(C=O)=N1,0.1207
OC(C#C)C1OC2CC12,0.284
CCCN=C1CC(C)O1,0.2775
CC1NC(=O)C2(C)OC12,0.2534
Cc1c([nH]cn1)C#N,0.2143
CC[NH+]=CNCC([O-])=O,0.2409
c1c2c(cn[nH]2)[nH]n1,0.2132
c1c(cc(cc1N)O)N,0.2214
C1CC(C1)(CC=O)C#N,0.2224
NC(C#N)C1=CC=CN1,0.2246
CCOC(=N)CN1CC1,0.2859
OC1(CC1(O)C#N)C#N,0.2817
C#CC1C2CCC=CC12,0.2434
C1C=CC23C4NC2C4N13,0.2144
OC1C2CCOC1CO2,0.3221
CC(O)(CO)C1(O)CC1,0.3047
CCC(CC=O)OC,0.2214
CC(O)C1OCCC1C,0.3107
O=CC12NC1CNC2=O,0.2002
CCC(OC)C(N)C#N,0.2717
CC(C)C1(OC1C)C=O,0.2168
C1C2C3C(N12)C31CCC1,0.3117
CC(O)C1(O)CN2CC12,0.2834
O=CN1C2C3CC3C12,0.2349
COCCC=O,0.2285
CC#CC1COC=NC1,0.2635
CC#CCCOC=NC,0.2723
CCC1C(O)C(C)C1=O,0.2135
OCC1C2C(O)CC12O,0.308
CC1(CC1O)NCC#N,0.261
C(C#N)OCC(=O)N,0.261
C#CCC(CC#C)CO,0.2831
OCC1CC2=CN=NN12,0.2599
OCC#CC(O)C=O,0.2193
CC(C)OC(=O)CNC,0.2405
CC(COC=N)CC#N,0.2845
CC(C)C1(C)CCOC1,0.3174
CN1C2CC1(C)C2C=O,0.1966
COCC12CC1CC2,0.3295
N=C1NC=C(C#N)C1=O,0.1484
C#CC1(C#N)C2CC1O2,0.2626
OC1COC11CC2NC12,0.2975
C1OC11C=CC2CC12,0.2402
CC(C)C(O)C(C)=NO,0.2543
CC1CC2CC12CC#C,0.2992
CCN=C1OCOC1C,0.274
CC(=O)n1c(ncn1)N,0.193
CN1C2C1C1OCOC21,0.2923
NC(=O)C12CC(O)C1N2,0.2577
CCc1cnoc1C#N,0.2102
N=C1OC=C(O1)N1CC1,0.2336
Cc1c[nH]c(=O)cc1N,0.1837
O=CC1N=C2NC3C1C23,0.1663
COc1cc[nH]c1C=O,0.1779
O=CC1CN=COC1=O,0.2264
CC1OC2C(O1)C2C#N,0.2776
OCC(OC=O)C1CN1,0.252
COC1=C(C)OC(=N)O1,0.241
CCC1C=CCCC1O,0.2627
CCN(C)c1ccoc1,0.2077
CC1C2C3C1C2(C)C3=O,0.2466
CC12CC3OC(CC1)C23,0.3148
CC1(CN1)C12CCC1N2,0.322
CCC(C)CC1CO1,0.3442
CC(=O)N(C)CCOC,0.269
CC1(OCCN=CO1)C,0.2568
C#CC1CO1,0.2839
C1OC(=O)C(=O)C(=O)O1,0.1482
CC#CC(CC#N)C#N,0.2805
CC1CC2(CCO)CC12,0.3251
CC#CCOC=O,0.2694
O=C1NC2CC12C1CC1,0.2508
OC1C(CC#N)C1C#N,0.3023
O=C1NC2CC1OC2=O,0.2414
N=C1NCCCNC1=O,0.1984
N=C1NC(=O)N2CC12,0.2471
CC1(C)C2CC2(O)C1O,0.2998
CC(=O)c1cnccn1,0.1665
CC12CC3(O)CC1C23,0.3115
CC1C2CC1(C=C2)C#N,0.242
CCCC(=O)OC(C)=N,0.268
CC(C)(C)C(=O)N1CC1,0.2456
CCn1c(c(nn1)N)C,0.2144
O=C1COC2C3NC1C23,0.2025
N#CC1=CC2CC(C1)O2,0.2047
NC1=CC=NC=NC1=N,0.1542
CC1OC2C3CC3(C)C12,0.3178
NCC(NC1CC1)C#N,0.2602
CC1NC2=NCCOC12,0.2516
CC#CC(C[NH3+])C([O-])=O,0.2706
CCC(=O)C(=O)CCO,0.1581
O=CCC12CCCC1N2,0.2192
OCC(O)CC#CC#N,0.235
CC(C)N=C(C#N)N,0.2221
CC1N2CC3(C)C2C13C,0.2941
[NH3+]C1(CC(O)C1)C([O-])=O,0.2642
Cc1c(c([nH]c1C)O)C,0.2262
OC12CCCC1C1OC21,0.3184
COC(C)C1CCO1,0.3227
CC12COC1CC1CC21,0.3248
C#CC1(C=CCO1)C#C,0.2523
OC12CC1N1C=CN=C21,0.2189
COC1C(C)C2OCC12,0.3007
OC1(C#C)C2CN2C1=N,0.2328
O=CCCOCC1CO1,0.2284
CCCC1CC2OC12,0.3369
CC(C)CCN1CC1C,0.3043
C1CCC2OC2C1,0.3433
CCC(O)C1OC1C#N,0.2757
CC12CC1C1CCOC21,0.3133
N=C1CCCN1C=O,0.2252
COC1CCC1OC=N,0.2815
CC1(OCC=C1)C1CO1,0.2494
C1NC1C1=CC=NC=C1,0.2273
OC1CC2C1C(O)C2=O,0.223
Cc1c(c(cn1C)O)O,0.2254
Cc1c[nH]cc1C=O,0.1934
Cc1cnc(=O)oc1,0.1782
CCC1CC(C#C)C1C,0.3033
CC1CC1(C#C)C1CC1,0.2917
CC1(C)C2CC=CC12,0.2436
CC12CCC1(C)C2O,0.3024
C#CC1C2CNC12C#N,0.2387
CC12C3C4N3C1C24C#N,0.2355
C1CCNC(=O)C1,0.2681
OCC1CC2OCCC12,0.3153
CC1OC11C2NC1C2=O,0.247
OC1C=CC2CC2C1O,0.234
C1COc2c(non2)N1,0.2127
CCCCC1OCCO1,0.3434
CC12CC(CCO)(C1)C2,0.3433
CC(C)CCOC1CC1,0.3244
CC1C(C)C(C)(C)C1=O,0.2168
C1CC2OC(O1)C1OC21,0.3078
CCC(=O)OC=NCC,0.2407
CCC1(C)NC(=O)C=C1,0.2147
CN(CC#N)CC1CO1,0.2594
C(CC(=O)N)C(=O)C#N,0.1809
CC1(CC2OC12)C(N)=O,0.2725
CCC(NC(C)=O)C#C,0.2702
Cc1cc(oc1NC)C,0.212
CCCC1N=CNC1=N,0.2273
CC1=NOC(O)=NC1=N,0.203
CCCc1nc(co1)O,0.2214
CC1=CC(O)C2OC12,0.2388
C#CC1CC2CC2CO1,0.2861
C(C=O)C#CC(=O)C=O,0.1545
OC1CC=CCOC1=O,0.2574
CCC(=O)C(O)CC#C,0.235
CCOC1C=CC2NC12,0.234
C1C(O1)(C=O)C=O,0.1954
CNc1cn(nn1)C,0.208
CCC#CCCO,0.2994
CC12C3NC11CCN2C31,0.2784
CCC12CN1CC2(C)O,0.2894
CCC1CC11COC1C,0.3173
O=COC1C2C3CN2C13,0.2521
O=CNCC1CCOC1,0.2786
CCOCC#CCO,0.2811
CC12CC1(O)COC=N2,0.247
COCC12CC1C(O)C2,0.3235
CC1(CCO)CNC1=O,0.2797
CC(=O)CC1(C)CO1,0.2274
CC([NH3+])C1=NOC(=N)[N-]1,0.2258
CC1=CC2OCC1C2O,0.2343
CCC1OCC=CC1O,0.2515
CC1C(C)C(C=O)C1O,0.2202
OC1C2COC11COC21,0.2808
C1OC2C3C4CCC12C34,0.3157
C#CCCn1ccnc1,0.2471
c1nc2n(n1)C(=O)CC2,0.2294
C#CCC1C2CC3C2N13,0.2969
CC1OC1CC1(O)CC1,0.3308
C1C2OC1C1=COC=C21,0.246
NC(C#N)C1OC1C#N,0.2631
CC1(CCC=C1CO)C,0.2597
CC1NC11CC2NC12,0.303
CCC1N2CC1(O)C2,0.3104
O=CCCC1CO1,0.2291
OC12CC(C1)OC(=N)C2,0.2751
CC12CC(C1)(C2)OC=N,0.279
CC1CN2CC3C2CN13,0.2776
COC(C)(C)C1CN1C,0.2942
CN1C=COC1=N,0.2172
O=C1CC2CC3OC3C12,0.2213
CC(=O)C1(C)CC(=O)O1,0.2262
c1conc1N,0.2357
OC1C2CC3C2COC13,0.3071
CC1C2OC2C2(C)CC12,0.3312
Cc1cnoc1CC#C,0.2384
CC1(C)C2CC(=O)N12,0.2346
OC12CC3C(C=CC1)C23,0.2487
CC12COCC1N1CC21,0.31
CC1C(O)CC1N1CC1,0.3144
CN1C2C3(O)CC1C23C,0.274
CC#CC1NCCC1=O,0.1987
CCC1(CC1)C2COC2,0.325
CC1C(O)C2NC2C1O,0.3
OC1C2OC(=N)C1C=C2,0.2364
CN(C)c1[nH]c(cn1)O,0.231
OCC1COCC1=O,0.2152
OC1C2CC1(C2)C1CO1,0.3223
CCC(=O)C1(CO1)C#C,0.2228
CC1OCC=CC2NC12,0.2479
OC1C(=N)NCC1=O,0.2098
NC1(C#C)C2OC(=O)C12,0.2245
OC1C(NC=O)C1C=O,0.215
CCCc1ccno1,0.2444
CC(=O)n1cc(nn1)N,0.1674
CCC(C)C(C)OC,0.3323
OC1C(CCC1=O)C#C,0.2199
c1cocc1OC(=O)N,0.2356
CC1COC(C)(C)C1,0.3176
CC1=C(N)C(=N)N=CO1,0.1794
CC1C2C3OCC3(C)N12,0.2998
C(C#N)C(=O)NC=N,0.23
CC(C)C(=O)C(=O)C#N,0.1463
CNC1CC2NC12C#N,0.2375
CC12CC(C1)(O2)C1CN1,0.3242
OCC12COC1C1OC21,0.2959
CC1(C)CCOC(=N)C1,0.2773
OC1CNC11CNC1=O,0.2488
CC1(C)NC(=O)C2NC12,0.2546
NC1=CC(=O)C2CC1C2,0.1973
OCC1=CC2CC2C1=O,0.1919
CC1CC2OCOC2C1,0.3214
CN(C)c1c(cc[nH]1)O,0.2307
CC12C3C1C1(C)N2C31C,0.2831
COc1c(c(co1)N)N,0.2226
CC#CCC1OC1C,0.3022
CCN=C1NN=NC=N1,0.1484
CC1C2CCC3OC1C23,0.3131
c1c(nc(nc1N)F)N,0.2315
CC1(CO1)C1CN1,0.3313
CC1CCOCOC1,0.332
CC(C)(C)OCCC=O,0.2275
C1CC2NCCOC2=N1,0.2547
O=C1NC2CC1C=CC2,0.2351
CC12OC(=N)C1(N)C2O,0.259
CC(C)(CC[NH3+])C([O-])=O,0.0966
CNc1ccc2n1CC2,0.2174
N#CCC1=NC2CC2O1,0.2507
O=C1C=CC2OC1C=C2,0.1637
CC1COCC2(C)CC12,0.3221
C1C(CO1)(C=O)C=O,0.1998
CC12NC1C1(C)NC21C,0.2643
C#CC1CC1C#CC#N,0.2198
OC1C2OC3CC2C13O,0.3001
CC1C2CC2C11CC1O,0.317
COc1noc(=O)o1,0.283
c1[nH]c2c(n1)C(=O)OC2,0.2344
OC1CC=CC(C1)C=O,0.2104
CC1C=CC2NC12,0.245
N=C1CCC=CCCO1,0.2536
OC(CC(=O)C=O)C=O,0.1533
CC#CC(C)C1CN1C,0.2779
C#CC12CCN3C1CC23,0.2707
Cn1c(=O)n(cn1)C=O,0.1927
c1c(nc(cn1)F)CO,0.2065
CN(C=N)C(=O)C1CC1,0.2313
OC1(C#C)C2CC=CC12,0.2312
N#CC1C2CCC12,0.3186
CN1CC1(C#N)C#N,0.2544
COC(C#C)C1COC1,0.28
CC(COCC=O)C#N,0.2296
CC1C2N(C)C1C21CN1,0.2867
CC(O)(CCC=O)C#N,0.2295
C#CC1C2CN2C1C#C,0.2602
CC1CCC11CC1C#C,0.285
OCC12CCC1(N2)C#N,0.2752
CC12CC=CC1(O)CO2,0.2491
OC1CC1CC#N,0.3174
CC12C3C(O)C(C1O)N23,0.301
CCC1=CCNC(=O)C1,0.2541
C1OC1C12CCCC1N2,0.3164
c1c(=O)[nH]c(c(n1)N)N,0.1543
CC(=O)N(C)C(=N)C#N,0.2109
C1CC2C3COCC23C1,0.3345
CC(C#C)C1CC(C)C1,0.3121
N=C1OC2CC3OCC123,0.2703
CC1CC=C(CO1)C=O,0.1937
CCCC(CC)CC,0.3854
CCC(O)C1CC(=O)N1,0.277
COC(C)C(O)C(N)=O,0.279
C1CC23NC2COCC13,0.3183
CCCOC1(CC1)CC,0.3285
CC1(C)N2CC(C2)C1=O,0.2047
C(CC(C=O)C=O)C=O,0.1939
CC(C#N)C#N,0.3304
OCCC12CCC1N2,0.3254
C#CCCn1cnnn1,0.2632
CC12CCN3CC3C1N2,0.2927
FC(F)(F)C1COC=N1,0.2724
O=C1CC(C#N)C11CN1,0.2143
OC1CC=CC2CC12O,0.2451
OCC1C2CC1C(=O)N2,0.2577
COC1(CC1C)C1CO1,0.3336
CC1C23CCC12OCO3,0.2948
OC1C2C3C2N2CC3C12,0.2892
CC1(C)C2CC3C2OC13,0.3171
OC1CC1N=C1CCO1,0.2419
c1cc(c(=O)[nH]c1)CO,0.1805
CC(C)C(C)(C)COC,0.3279
CCC12CC1(CC2)C#N,0.2803
O=C1COC2C3CN3C12,0.2006
N=C1OC23CCC12CC3,0.2753
C1COC(=O)C(=O)N1,0.2097
Cc1c(con1)C(=O)N,0.2273
CC(CC1CC1)N1CC1,0.3095
N#CC12C=CC3C1NC23,0.2258
CC(O)C#CCOC=N,0.2776
CN1C2CC(C)(C)C12C,0.3023
CCC1(C)CC1C,0.3426
CC1C2CC(C)C(C)C12,0.324
OC12CC(=O)C3C1CC23,0.221
CC12C3NC1(C)C(=O)C23,0.2217
CC12CC1(O)CC1OC21,0.3242
Cc1c(nc(=O)[nH]n1)N,0.1846
CC(C)CC(O)C1CC1,0.3327
CCC1CCCCCC1,0.3713
CC12C3C4N1C2C34O,0.2726
CC#Cc1cnn(c1)C,0.2199
CC(C)NC(=O)OC=N,0.2703
CC12CC1(C#C)C(=O)N2,0.2449
CNCC(C#N)(C#N)N,0.227
O=CNC1CNC1C=O,0.2029
CC1=CCC2(C1)CC2,0.2603
COC1CCC11NC1C,0.3071
OC1C2N(C=O)C1C2=O,0.2306
C1C2OC3=NCCC3C12,0.2637
CC(=N)OCC1CCO1,0.2885
C#CC1OC2(CC12)C#C,0.233
N=C1OC2C3OC2C3O1,0.2906
N=CN1CC1(C=O)C=O,0.1913
C1CC11C2C3CC2C13,0.3613
N1C=CC2=C1ON=N2,0.1337
C(CO)NC(=N)C(=O)N,0.2147
N#CC1NCCC11CO1,0.2715
NC1C(CCO)OC1=O,0.2495
CC(=O)C1(CCO)CO1,0.2223
OCC12OC1CC21CN1,0.2894
CCC1(C)C2NC1C2=O,0.2515
CC1OC1(C#C)C(N)=N,0.2511
c1cnn2c1CC=C2,0.204
O=C1CN2C3CC12CC3,0.211
O=C1OCC11CC2NC12,0.2462
C1C2C3C4C5OC5C13N24,0.2905
CC1NCC(C)(O)C1=O,0.1959
CCCC1(COC1)CC,0.3134
COC1(CO)CCCO1,0.3181
COC12CCC1CC2O,0.2934
Cc1[nH]cc(n1)NC=N,0.2137
C#CC1CN2CC=CC12,0.2336
CC1CC11COCC1=O,0.2183
OC1CC2CC1C(=O)C2,0.2223
CC1CC2CC1C2C#N,0.33
OC1CC2(O)C3CC2C13,0.3237
C1CC23C1C1C2C=CC31,0.2231
c1c(oc(=O)[nH]1)C=O,0.1786
OCCOC1C(O)C1O,0.2808
c1coc(c1O)NC=N,0.2242
OCC12C=CCC1C2O,0.2306
CCOCC1CC2OC12,0.3378
CC12C=CC3C4C1C2N34,0.2351
CC1(C#N)C2OC1C2=O,0.2425
CC(=O)n1c(=O)[nH]nn1,0.2117
C(#N)c1[nH]c(c(n1)N)O,0.1897
OC(CCC#N)C1CO1,0.313
CCCC(CC#C)C#N,0.3049
CC1C2CC1CC(C)C2,0.3506
O=C1CC2C1N2C1CC1,0.2109
C1OCC2OC1C=C2,0.2381
O=C1CC(N=CO1)C#C,0.2388
C1CN1CC(=O)N,0.2756
c1coc(cc1=O)N,0.2017
CC(COCC=O)C=O,0.2274
O=C1C2CC1(O2)C#N,0.2404
CC1=C(N)C2CN2C1=O,0.1958
OC1C2C1C1C=CCC21,0.2542
Cc1c(oc(=O)cn1)C,0.1636
OCC1C2C3CC1N23,0.31
COC1(C)CC(C)C1,0.3245
CC1C2C1C(CO)C2O,0.2999
CNc1cc(nn1C)N,0.2317
CCc1coc(n1)C#C,0.1975
O=CC1(CO1)C1CN1,0.2089
C[NH+]1C2CC2C1C([O-])=O,0.2078
CCCC(O)C(=O)C=O,0.1569
COc1c([nH]cn1)C=O,0.1792
CC(=O)NC(=N)N1CC1,0.2334
CCOCC(C=O)C#N,0.2186
CC1C2CCC1(O2)C#N,0.2708
COC1C2N3C1CC23C,0.321
c1c(onc1N)CC#N,0.2279
NC1=CC(F)=CC(=N)O1,0.1732
N=C1NCC2=C1N=NN2,0.2216
C1NC11CN2C=NC=C12,0.2474
c1cccc(=O)cc1,0.1552
CC1CCCCC(=O)O1,0.2627
CC1=NCC(=NC)N1,0.2234
O=C1OC2CCC2C=C1,0.2162
c1c[nH]c(=O)c(c1N)N,0.1716
CC12NC1CC1C(O)C21,0.2828
CC(C)C1(O)C2CCC12,0.3087
c1c(=O)c(c[nH]c1F)N,0.1863
OC1C2CCC12C1CC1,0.306
COC1CC(=O)OC1=N,0.2507
CC12CC1COC(=N)O2,0.288
O=CC1=NC2CCC2N1,0.1561
CC1(CC(=O)O1)C#N,0.2832
C1CNC=C(C=C1)C=O,0.1719
OC1(CC2NC2C1)C=O,0.2164
OC12CC1OCC1CC21,0.2887
CC1CC(=N)N1C=O,0.23
CC1NCCNCC1=O,0.1991
COCC1(CO1)C#CC,0.2778
C1OC1C1=CN=NN=N1,0.1666
C1OC11C=CCC2CC12,0.2471
CC1CN2C1=NC=C2O,0.2397
C1CC2(C1)CCN2C=O,0.2624
C1CN1CC(F)(F)F,0.3306
CCOC(C#N)C1CC1,0.3023
Cn1ncc(n1)C(=O)N,0.2245
Cn1cc(nn1)N(=O)=O,0.2097
CNC(=O)N(C)C=O,0.2518
CC1=CNCCCC1=O,0.1795
CC1(CC1)N2CC(=O)C2,0.1953
CCOC1=NC2CC1C2,0.2628
C1C2OC=NCC3C2N13,0.2625
CC(CC#N)OC=N,0.2818
C1C2CC3=C(ON=C3)C12,0.2266
c1cnc(cn1)C#N,0.1901
CC(C)C(C#N)C1CC1,0.3337
CCCC(O)CNC=O,0.2821
OCC(C#N)C1CO1,0.3041
c1c2c([nH]n1)OCO2,0.2238
O=C(CC1CN1)C1CN1,0.216
CC12CCCC1(CO)O2,0.3345
CCN=C1OCC1C=O,0.2178
CC1C(C)C(C#C)C1C,0.3026
C1CC1CCOC=O,0.2864
O=C1C2C3C4C3C1OC24,0.2096
OC12CCC1C1CC2C1,0.3338
CC1=C(C)C(=O)N2CC12,0.2025
CC1C(C)C1(C=O)C#N,0.2235
CCC1N2CC2C1=O,0.2189
CN1C2(C)COCC12C,0.3009
CCC1OC2C3CN3C12,0.2801
C1CC1C12CC1OC=N2,0.2547
COCC1CC(O)CO1,0.3137
NC1=NC=NOC1=N,0.1791
CC1(C(=O)CCCO1)C,0.2108
CC12CC(C)(O)C1N2,0.311
Cc1cc(oc1OC)C,0.2239
OCCCC(C=O)C#C,0.2201
CCc1[nH]nc(n1)C#C,0.228
OCC1C(C#N)N1C=O,0.2503
NC1=NC2C3NC2C3O1,0.2644
OCC(O)COCC=O,0.227
CC(C#C)C#CCC=O,0.2203
CC1CC1C1CN1C=O,0.2531
O=CC1C2OC1C2C#N,0.2099
CC#CC12CC(C1)C2C,0.2905
CC(=NO)C12CN(C1)C2,0.2322
OC1CC=CC11COC1,0.249
OC(CC#C)C(F)(F)F,0.3119
OC1CC2CC2(O)C1O,0.305
CC1=C(CC(O)C1)C=O,0.1917
NC1=CON=C1C1CO1,0.2025
CC1CCCCC1(C)O,0.3275
CC1(CO1)C1OC1C#N,0.2772
N=C1OCC(=O)C1C#C,0.2098
OCC1=NC2CC3C2N13,0.245
CC1COC1C1CN1C,0.2966
Cn1cc(oc1=O)C#C,0.1867
CC1OC(=N)C(O)C1=O,0.2096
NC(=[NH2+])CC1=N[N-]N=N1,0.2719
CCOC(C#N)C(C)C,0.3028
CC1(O)CC(O)C2CC12,0.3176
CC12OCC(O1)C1NC21,0.3136
c1c(noc1N)C(=N)N,0.2044
CC12C3C(C3C1=O)C2O,0.2401
CNc1cc(no1)C=O,0.1635
OCC1OCC1(O)CO,0.2921
CN1CC1(C)C#CC=O,0.1866
COC(C)(C=O)C(C)=O,0.2131
CC1CCC(=O)C1(C)O,0.2192
CCC1OC=NCC1C,0.2712
O=C1NC23CN4C2CC134,0.2167
C1C(COCO1)CC#N,0.3018
CCC1C(=O)C2NC12C,0.2141
CC1=CCCC2C(O)C12,0.2399
CC1C=CCC2CC1C2,0.2685
CCCCC(C)(C)OC,0.3249
OC1CC23CCC2C1C3,0.3045
CC1C2COC3CN1C23,0.2887
COCCC1COC=N1,0.2694
CCn1cc(nc1)C#N,0.2301
CCC1CC2OC1C=C2,0.2551
C#CCC#CCCC#N,0.2814
CC1CC2CCC(O)C12,0.3194
OC1CC(=O)OC11CC1,0.2764
CCCc1c(non1)C,0.2548
c1[nH]c2c(n1)ocn2,0.2069
C#CC12CC3C(CO1)C23,0.2744
OCC12OC3CC1C23O,0.3001
CC1C2C=CCC=CC12,0.253
CCC1OC2CC12CC,0.3028
NC(=O)C1COCC1O,0.2708
OCC1=CC(OC1)C#N,0.2549
OC12CCC=C1COC2,0.2419
c1(n[nH]nn1)OC(=N)N,0.2285
NC(=O)C1CC(O)C1,0.2537
CN1CC11COC=NC1,0.2544
OCC(C#C)C#N,0.29
CC1CC(C1)C(N)C#N,0.2953
CC1N2C3CC2C13C,0.3161
CC1CC=CC(N1)C#N,0.2405
[NH3+]C(CO)CC([O-])=O,0.2775
OC1CC2(CC3OC23)C1,0.3202
C1C(CN1)(CO)C#N,0.2661
COC1CCC1(O)C#C,0.2695
OCC1C2CN2CC1=O,0.2006
CC1CC(O)CC(=O)N1,0.2666
CC1(O)C2CC1N2C=O,0.2503
C1C2OC22CC1C=CC2,0.2592
CCC(=[NH2+])NCC([O-])=O,0.252
OC1CN2C1CC2=O,0.2378
CC1CCCC2OC12,0.3392
C1CN(C12COC2)C=O,0.2628
CC(C)CC(=O)C#C,0.2072
O=CC1C2CCOC12,0.2184
CC1(O)C(CC1=O)C#N,0.2061
C#CCN(C=O)C=O,0.2144
CCCC(O)CCC#N,0.3219
CC12CCC(C1)C(=O)N2,0.2651
c1nncn1C2CCC2,0.2648
c1c(c(=O)[nH]cn1)C#N,0.1769
CC1OCC1CN1CC1,0.3194
CC1(O)COC1(C)C,0.3046
CC1OC2C3CC1OC23,0.2959
C1C(CN1)(CC=O)C#N,0.2112
CN1CC(O)CNC1=O,0.2828
CC1(CCO)OCC1O,0.3081
CC1N=COC1C#C,0.2678
CN1CC(O)C1CO,0.294
CC12CC1(CO)CC2=O,0.2317
NC1=NNC(O)=CC1=N,0.1805
CCNc1n[nH]c(=O)o1,0.2526
OCCC12CC1N=CO2,0.2603
CC1CN1C(C)(C)C=O,0.1933
O=CCCC1CNC1=O,0.2284
CN1CC1CC=O,0.2076
OC1CNC(=O)C2NC12,0.2555
CC1=CC(=N)NN=C1C,0.1596
CC1=CC2CCC2(O)C1,0.2567
CC(C)C1(CC1)C(=O)N,0.2674
OC12C3CC(=O)C1OC23,0.2139
CCC(C)(C)C1CC1C,0.3338
CC12C3CN1C1C3OC21,0.2921
C#CC1C2CCC1C=C2,0.2515
CC12CC1(C)C(=O)CC2,0.2264
CC12NC3(C#N)C1NC23,0.2457
CC1C2C3C1CC23C#N,0.2891
C#CC1CC2CCC1C2,0.307
CN=C1NC(CO)CO1,0.2714
CNC(=O)OCCC=O,0.2276
C1CC2C3CCCC2C13,0.3589
CC1=Cc2cnnn2C1,0.1907
CC(C)(C)C(C=O)C#N,0.2204
CC(=O)c1c[nH]c(=O)o1,0.1798
C1NC1C1=CNN=N1,0.2429
OCC12CC1(NC2)C#N,0.2365
OC1CC2CNC(=O)C12,0.268
CC1(CC2CCC12)C#C,0.3046
CC(C)C1(C)CC(=O)O1,0.2835
CC(C)c1c(nn[nH]1)N,0.2166
OC1C2CC2(C#C)C1O,0.2699
CC#CC1(CCC1)O,0.2806
C1OC23CC(CC=C2)C13,0.2415
CN=COc1cnc[nH]1,0.2026
CC12CC1C(C)(CO)C2,0.3175
C1C2OC11CCC=CC21,0.2433
COc1c(c([nH]n1)N)O,0.2312
CC1(C)C([NH3+])C1C([O-])=O,0.2709
CCC1CCNC1=O,0.2709
CC1C2C3C1C(CO)N23,0.3168
N#CC1CC2OCC2O1,0.2831
C1CC12CN=COCO2,0.2584
CCC(O)C#CC,0.2892
CCc1c(nc(o1)N)N,0.215
CC1(CC1)c2cocn2,0.2344
C1C=CCNC(=O)N1,0.2313
C#CC(CC1CO1)C#N,0.2916
CC1C=CC2(C)CC1O2,0.2408
OCC1CCC(C1)C#N,0.3155
NC(=[NH2+])C1=C(O)N=N[N-]1,0.18
CC1=C(N)C(=N)NC1=O,0.1648
N=C1NN=CNC1=O,0.186
CCC1C(O)COC1=N,0.2838
CC1C2CC3(C)OC1C23,0.3141
CC(C)(CN1CC1)C#N,0.2906
Cn1c(=O)ncc(n1)N,0.145
CC(=O)C1CC2CC12,0.2224
CCC1C2C3C2C1C3C,0.3275
COCC(C)CCCO,0.3312
OCC12CC1C(=O)CN2,0.2195
CCC1=CCOC1,0.2483
CC1C(=O)OC1(C)C,0.2795
CC1(C=O)C2CC1CC2,0.2222
c1cc2c(con2)nc1,0.1637
CC(C)CC(=NO)CO,0.2526
CC1(O)CC2C3CC3C12,0.3103
c1c[nH]nc-2cncc12,0.1263
CC1CC2CC1(O)C=C2,0.2514
OCCC1CC=CC1O,0.2622
C#CCCC1CC(=O)C1,0.2231
CCN1CCCCC1=O,0.2659
CC(C)C1CCC1=NO,0.2492
CC12CCC1(NC2)C#N,0.2508
CC1C=CC2C(CO)C12,0.2421
O=CC12CC3C1CCC23,0.2157
NC12C3CC1C3OC2=O,0.2482
CC1=CC(CC=O)OC1,0.2178
COCC1C2COC12,0.3154
COC1C2OC3C2OC13,0.2919
CCCc1conc1C,0.248
O=C(C#C)C1(CN1)C#C,0.1822
C1CC12C(C3(O2)CC3)O,0.298
c1coc2c1CCOC2,0.2332
C1C2NC2C11CCOC1,0.3124
C1CC1C1NC1C1CO1,0.3167
FC1=NON=NC1=N,0.1821
C#CC1OC(C=C1)C#C,0.2559
N#CC1C2CN1C1CC21,0.2632
CC1CC(C)C=C1,0.2626
CC12C3C1C1OC2CC31,0.344
CN1CC2(CN2)CC1=O,0.2716
CCCC1C(O)C1(C)O,0.2949
CC12CC(=O)C1N2,0.2212
CNc1cc2n(c1)CC2,0.2181
CC12CC(C1)(OC2)C=O,0.2177
CC1(C)COC1(C)C#N,0.2862
CCC(C#N)C1NC1C,0.2997
c1c(ncc(n1)N)N,0.1612
CC12CC(C1)OCC2=O,0.228
CC(=O)C(C#N)(C#N)O,0.2241
COC1C2CC1C2C,0.3444
C1C2CC3=NON=C3C12,0.2352
N=COC1CCCO1,0.2882
OCC(NC=O)C=O,0.2227
OC12C3C1C1C3CC=C21,0.1611
O=C1NC2CCC3C2C13,0.2625
CC(CO)C(=O)C=O,0.1523
CC1(O)CN2CC12C=O,0.2062
CC1(COC1)N2CC2,0.3093
CC(C)C1(O)CCOC1,0.3191
OCC1CC1C(F)(F)F,0.3394
CC1N(CC#N)CC1=O,0.2184
COC12C3CC1OC23C,0.3124
CCCCC1(CC1)C#N,0.3199
CC1NC(=O)NC1CO,0.2992
C#CC12CCC1=CCO2,0.2361
N#CC12OC3C1NC23,0.2466
CC1CC1C1=CNN=N1,0.2389
CC1(O)CC(O)C2NC12,0.3115
CC#CC12CCC1O2,0.2597
OC12C3CC1(CC23)C=O,0.1927
ON=C1C2OC1C=C2,0.2231
CC12CC3CC(=O)C1N23,0.2219
CC12CC(O)C1CCO2,0.3018
CC1OC(=N)C(C)C1O,0.2828
Cn1c(nc(n1)N)CO,0.2147
C1OCC11CC2OC12,0.3169
CC1OCC(O)C1(C)O,0.3011
CC(C)(c1cocn1)O,0.2452
O=CC1(CC=CC1)C#C,0.2198
CC(=NO)CCNC=O,0.2495
OC12C3NC1C3NC2=O,0.2464
CCC1CC(=O)NC1=O,0.2373
CCC12C(C)C1NC2=O,0.25
CCC1CCOCCO1,0.3251
C1C2OC3=CN=CN3C12,0.2382
C1COC(=O)C=C1C#N,0.19
CN=C1N=NON=C1C,0.1651
OC12CC1N1CC(=O)C21,0.1974
CC(C)OCCNC=O,0.2829
OC1CC=CC2CC2C1,0.242
CC1CCC=CC1O,0.2625
N=C1OC=C(C=N1)C#C,0.1562
CC1COC=NC1,0.2727
COCC1(C)CC1C=O,0.2264
C[NH2+]CC(CC#N)=N[O-],0.1581
Cc1cn[nH]c1N2CC2,0.2353
CC1=CCCCC(O)C1,0.2523
C#CCC1CCC=CC1,0.2675
OCC1C2CC1C21CN1,0.3109
CN(C)c1cnncn1,0.1782
OC12CC(C=C1)C1NC21,0.2508
OCC1C(C#C)C1C#N,0.2686
OC1C2NC1(C=O)C=C2,0.2018
CC1CC11CC2C(O)C12,0.3042
N#CC12CC1C1CC21,0.2495
OC1CC2NC2C=C1,0.2486
OCC(NCC#N)C#N,0.2635
[NH3+]C(COC=O)C([O-])=O,0.2559
CC1C(O)C23CC(O2)C13,0.2957
[NH3+]C1COCC1C([O-])=O,0.2752
NC1=CC(=O)OC1C#C,0.2214
O=CC12CC1C1CN1C2,0.2064
CC#CC(C)N1CC1C,0.271
CC#CC1N=CN2CC12,0.244
C#CCOc1cnco1,0.2314
C1CC1C(=O)COC=O,0.2306
CC1C2CC1(C2)C#C,0.3002
C1CC12CN(C=C2)C=O,0.2007
OC1C2C3NC3(C=O)C12,0.2241
C1CN=C(OC1)C2CC2,0.2648
COC1(C)C2CCOC12,0.297
CC12C(O)CN1CC2=O,0.2014
OC1CCC(OC1)C#C,0.2833
CCC1C2CC2N1C=O,0.2618
CC(C)(CNC=O)O,0.2817
COC(=O)C(F)(F)F,0.2764
CC1OC1C(C=O)C=O,0.207
N#CC1CC2OC3C2C13,0.2832
CC12NC(C)(C=C1)C2O,0.2274
CC(O)C12CC1C1CN21,0.2887
CCC12CC(O1)C2C#C,0.2789
Cc1c(onn1)CC=O,0.2061
OCC1NC1(C=O)C#C,0.2073
CCC1C=CCOC=N1,0.2463
CC(CO)CC(F)(F)F,0.3427
N=C(C#C)N1CC1C#N,0.2209
OC1C2C3C4C3C2(O)C14,0.2846
CC(O)C1(C)CN=CO1,0.2736
N=C1OCC2CC2C1=O,0.1956
C1OCC11CC2NC12,0.3066
N#CCN1C2COCC12,0.2736
CC(CC#N)C(O)CO,0.2999
O=C1C(C#N)C2CCN12,0.2341
C#Cc1cncoc1=O,0.1655
COc1c(c(c[nH]1)N)O,0.2213
CC1C(O)C2C3OC3C12,0.3086
C1OCC23OC4C2NC134,0.2869
CC1C2C3CC1C23C#C,0.2613
CC#CC1CC2(C)OC12,0.2866
c1c[nH]c(cc1=O)C#N,0.1684
C1CC2COCC12,0.3287
CC12CC1OCC1NC21,0.3051
CC12CC(O)C3CC1N23,0.2958
c1cc(nc(c1)F)CO,0.2212
OCC12CC(CO)(C1)C2,0.3356
OCC(=O)C1COC1=O,0.23
CCC1(CCC1=O)C=O,0.1946
C1NC23COC12C1OC31,0.2616
CCC1(C)C2CC3C2N13,0.3201
CC(C)(C)CC(C)(C)C,0.353
CNc1c(cco1)C=O,0.1781
C1C2CC1COC2,0.3284
COC1(CC1O)C=O,0.2181
CC12CC1CC1(O)CC21,0.3181
CC(=NO)CC#CC#C,0.2263
CC(C)C12CC1CC2,0.3266
Cc1cc(cnc1O)N,0.1819
CC1C(C)(O)C11CCO1,0.2842
C#CC12C3C1C1C3CC21,0.2659
CC12CC1C(C2)OC=N,0.2747
C1C2C3C4OCOC13C24,0.3436
C1CC1C(C#N)(C#N)O,0.2875
OCC1C2CC1(O2)C=O,0.1929
O=C1CC2C3C2C2C3N12,0.2226
C#CC1CC2(OC12)C#N,0.2603
CC(CO)CC(C)CO,0.338
N#CCC12COCC1N2,0.2929
OC1C2CCCC1O2,0.3013
c1cn2c(n1)CCC2,0.2512
CC12COC1(C=O)C2O,0.2056
N=C1OC(=O)C2OCC12,0.2376
CC12COC1(C)C1CC21,0.3179
CC1CC11C2CC1C=C2,0.2359
OCCC1CCC1=NO,0.2494
CC(CC(O)C=O)=NO,0.1995
CC1C2NC=NC12C=O,0.2067
NC1(CC11CCC1)C#N,0.2957
C#CC1COC1,0.2907
CC1N(C)CCNC1=O,0.2531
CC1NCCN(C)C1=O,0.2578
COCCC(C)OC,0.3275
CC1=NOC(=N)C(O)=N1,0.1773
CC1C(O)C1(O)C1CC1,0.2808
CC1C2C3CCC1C23C,0.3227
C1OC1C12CC1OCO2,0.3099
CN1C=CC(O)CC1=O,0.2055
CCN=c1cn[nH]nc1,0.1732
CC1C(O)CC11COC1,0.3074
OCCNC(C#C)C#N,0.257
C#CC1(CC1)C#CC#N,0.214
CCC1CC(O)C2OC12,0.3285
CC1CC2N(C)C1C2=O,0.2244
O=CC#CC1CCOC1,0.2029
CCC(CCCO)C#C,0.3123
NC(=O)C1(CC#N)CO1,0.2623
CC12OCC1C1CC21O,0.306
c1cc(c(c(c1)F)O)F,0.2285
CCOC=NCCC=O,0.2234
c1ccc2c(c1)cn[nH]2,0.1934
N=COC(=O)NCC#N,0.2741
c1ccc2cocc2c1,0.1527
COC=NCC(C)OC,0.2707
NC1(COC1C#N)C#C,0.2557
COC1OCCC1=NO,0.2498
OC12CC=CC3C1OC23,0.2514
CC(=O)C1C2OC1C2O,0.2235
COC(CC#C)C(N)=O,0.2606
CC(=O)N1CCNC1=O,0.2543
CCC1C2OC(C)C12,0.318
c1c(oc(n1)N)N2CC2,0.2244
CCOC1(C)CCC1C,0.322
CC(=N)OCC#CC#N,0.2237
C1C2CC34CC(O3)C14O2,0.2961
CCC(C)(C)OCC#C,0.2929
OCCC1CC2CC1C2,0.3429
OC12C3CC1=CCOC23,0.2079
CC1(O)COCC(=O)C1,0.2131
CC1C(C=O)C1(O)CO,0.2216
CNc1c(ccn1C)O,0.2249
CC(O)C12CN3C1CC23,0.2868
OC1CC=CC2(CN2)C1,0.2383
c1c(cc(oc1=O)F)N,0.1908
CC1NC(C#N)C1=NO,0.236
CC12CN1C(CO)=NC2,0.25
N#CC12C3CC4C(C14)C23,0.2627
OC1C2NC1(C=O)C2=O,0.2107
CC1(CCC(=O)N1)C=O,0.2085
O=CC1CN=CN1C=O,0.2022
CC1CCC1CC#N,0.3381
c1c(c(ncn1)O)O,0.2108
CC1CC2(CC=O)OC12,0.22
CC1C2C3(C)CC3C12C,0.2829
CCC(C)(C#N)C(C)O,0.3291
CC1COC(=O)C(=N)O1,0.2195
CC1CCN(C)C(=O)C1,0.2661
CC(C)C12CC1(C)CC2,0.3148
OC1CCC=CC11CN1,0.2497
O=CC1C2NC2C11CC1,0.207
CC(=O)CC1OCC1O,0.2327
C1CC1(CCC(=O)N)O,0.2761
CC(C)C(C#N)C(N)=O,0.2697
OC1CCC2C1NC2=O,0.2779
CN(CCC#N)C(=O)N,0.2844
CC1(OCCC=C1)C=O,0.2052
C1CC1N=c2[nH]nn[nH]2,0.1927
CCO,0.3417
CC(C)n1nc(nn1)O,0.2357
c1c(nc(nc1F)O)O,0.2354
OCC(O)C1=NCCN1,0.24
CC1C2CC2(C=O)C1C,0.2199
C1C(CN1)(C#N)NC=O,0.2533
CC#CC1OC2CNC12,0.2537
N#CC1CNCC1C#N,0.2713
CC1(C)CC1(N)C#N,0.2772
c1coc(c1N)C2CC2,0.2073
CC1C2C(O)C1C2C=O,0.2208
CCNc1ncc(o1)C,0.2268
OCC1(O)CN2CCC12,0.2759
CC1OCC1(C)CC=O,0.2247
CCOc1ccon1,0.2494
C#CC1COC2CC2C1,0.2808
CC1CC(=O)C=CC1=O,0.1601
C1C2CCC3=C2C1CC3,0.212
OC1C2CC2CC1=O,0.2207
Cc1c2c(c[nH]1)nno2,0.1669
CCC(C)CC(N)=O,0.2782
CC1CC(O)C(C)C1C,0.3253
c1c[nH]c(c1N)C2CC2,0.2211
NC1C(O)C2OC12C#N,0.2554
CC12CC(=O)C1C2C=O,0.2128
NC1=NOC(F)=NC1=N,0.1988
C1C2C1C1C3CCC3C21,0.3008
c1cnc(nc1)O,0.2146
CC1NCC(=O)C1=O,0.1251
CC12NC1C(C)(O)C2=O,0.2048
CCC12CC1CC1CC21,0.3182
CCCCC1(O)CC1C,0.3258
Cc1nc([nH]n1)C(C)C,0.2655
CCC1CCC=CCC1,0.2581
OCC1=CC(=N)OC1=O,0.1949
OCC1CCCOC1=O,0.2545
CC1(CC1O)OC=N,0.2793
N=COC1CC2CC12,0.2808
NC1=NC2CC2C1=O,0.1734
CCN=c1nnonn1,0.1576
C1OC2OC1C=CC=C2,0.1858
CCC(OC=N)C(C)=O,0.2207
OC12COC1C2(O)C=O,0.1961
OC1C2OCC=CC12,0.2318
CCC12CC1C1(CC1)O2,0.3004
C(c1c(onn1)N)N,0.2071
CN=C1OCOCC1C,0.2645
OC1COCC2OCC12,0.3041
CCC1C=CCC1(C)C,0.2603
CC1OC2(CC12)C#C,0.249
O=C1C2OC2C11COC1,0.2087
O=C1CCC2CCN12,0.2577
OCC1NC1C#C,0.2776
COC12CCC1NC2=O,0.251
OCC1CCCC11CO1,0.3296
NCC[NH2+]CCC([O-])=O,0.2765
C1NC1C12CCCC1O2,0.3203
COC1C2C(=O)CC12O,0.23
Cn1ccc(c1)NC=O,0.2136
C1CC2OC3C(C1)OC23,0.3051
CN=c1ncnncn1,0.117
OCCC(=N)OC=O,0.2462
CCCOCCC(=O)C,0.2347
CC12NC1C(C=C2)C#C,0.2435
C(=N)Nc1[nH]nc(n1)N,0.1936
OC12CCC1CC21CC1,0.3161
CN1C(=O)CN=C1C=O,0.1691
CC12CN1CC(O)C2=O,0.2059
CCC1(CC2CN12)C#C,0.2748
CCCC(C)C(C)=NO,0.2579
CC(=O)C1NC(=N)C1O,0.2224
C1OC11CCCC2NC12,0.3133
CC1CCC2(CO2)C=C1,0.2495
C1C=CCN(C1=O)C=O,0.2101
C1C=C(CNC1=O)CO,0.2554
CC1CC2C(N2C)C1=O,0.205
OC1CCC2=CCOC12,0.2415
O=CC1OCC1C#N,0.2111
c1c(c(nc(n1)N)F)N,0.1757
CN1CC(O)C1(C)C#N,0.265
OC12CC(C1)C1NC21,0.3036
Cc1c(ncc(=O)o1)F,0.1534
C1C=CC(=O)N1CC#N,0.2199
CC(=O)C1(CC#C)CN1,0.2295
CC1OC2CC1CC=C2,0.2438
CCCC1COC=N1,0.2696
CC12CCN1CC2=O,0.204
C1OC11CCCC=C1,0.2515
OC1CC11CNC(=O)O1,0.3069
CC12CCC1NC(=O)C2,0.2762
CC(O)(CCO)C1CC1,0.3272
CC1(CC(C1)OC=O)C,0.2862
OCCC(O)(CO)C=O,0.2074
CC1(O)C2OC=NC12,0.2466
OC1(CC1C1CO1)C=O,0.2145
OCCC1(O)CC1C#C,0.2851
NC(C#N)C(N)C1CO1,0.2814
CC#CC(C)C1CC1C,0.3014
C1C2CC3=NON=C3N12,0.2199
CC1CC2(O)C(O)CC12,0.3171
CCCC(O)C#CC,0.2889
CC1CCOC(=O)CN1,0.2369
Cc1c([nH]nn1)CC#C,0.2476
CC12OC1CC1OC21,0.3241
CCC12C3CN1C2(C)C3,0.3143
CCC1CC2C(C)C2C1,0.3299
CCOC1C2NC(=O)C12,0.2504
CC1C2CC1(C)C1OC21,0.3329
O=CCOCC1CCO1,0.2159
O=C1C2OCC3CC2C13,0.2082
CN1CC23OC(C=C2)C13,0.2191
CNc1c(oc(n1)O)O,0.2169
OC(COC=N)C#N,0.2681
CC1N2CC2C=C1C=O,0.1693
CC12OC1C1C(O)C21O,0.2833
CC1C2C1C1CCCC21,0.3219
NC(=O)CC1COC1=O,0.2354
CNc1ncc(cn1)O,0.1688
O=CC12C3CN=C1OC23,0.1546
CC1(CN1)C1=CCCC1,0.2508
COC1C2COC(=O)C12,0.2738
CC#CCCCCO,0.3022
C1C(=O)N(C=N1)C(=O)N,0.2296
O=CC12CNC1C2C#N,0.1971
CC1C(C)C11CCCC1,0.3314
ON=C1CC(CC#C)C1,0.2478
CCC(OC=O)C#CC,0.2689
CC(C)C(C=O)N1CC1,0.2199
C1CC11CC2OC2C1,0.3508
CC(O)C1CC1(C)C#N,0.3099
CC1(CC2CN1C2)C#N,0.278
O=C1C2CCN2C11CC1,0.2014
CCC12COC(C)C1N2,0.3307
CC12CC3(O)CC1OC23,0.308
CC(C)C(=O)NCC#N,0.2703
COC(=O)C#CC1CO1,0.2305
CC1OC2CC3CC12C3,0.3287
C1CC2C1C1OC=NC21,0.2601
CCC1CC2(CN2)C1=O,0.2045
CCC1C(CC)C1C=O,0.2247
N=C1NC2CC2OC1=O,0.189
CC1CC(C=O)C2NC12,0.2169
OCC(O)(C#C)C1CC1,0.3014
CC(O)(CC1CC1)C#C,0.2974
O=C1CN2CC3NC1C23,0.1852
CC(C)(C=O)OCC=O,0.2233
Cc1c(c([nH]n1)N)CO,0.2383
C1C(=O)C(N1)(C=O)C=O,0.1915
c1c2n(c(=O)o1)CC2,0.2312
CC1OC(C1O)C(N)=O,0.267
Cn1ccc(c1)C=O,0.2029
CNC(CC1CC1)C#N,0.2735
CC1C2CC=C(CO)C12,0.2466
O=COC(C=O)C1CO1,0.2212
CC1OCOC1C(N)=O,0.2566
OC1(CCC1=O)C1CN1,0.2036
C1NC11CC2COC1O2,0.3182
C1CC2(C1)CN2CC=O,0.2177
OCCCC(O)C1CC1,0.3339
OCCC#CCC1CN1,0.2949
CCCOC1(CC1)C#N,0.2921
CC(C)NCC(=O)OC,0.2338
COC1CC(C)NC1=O,0.2504
CC1CC2C3CC(O3)C12,0.3246
CC1OC11CN2CC12,0.3134
C#CC(=O)C#CCCO,0.1887
c1cnoc(=O)c1N,0.1731
[O-]C(=O)C1CC2C[NH+]1C2,0.2294
O=C1CC=CC1C1CC1,0.217
Cc1[nH]c(c(n1)O)O,0.2146
C1C2CN1C1=C2N=NN1,0.2301
C1COC(=O)CN=CO1,0.242
CN=COCCCOC,0.2727
N#CC1C2CCC=CC12,0.2497
OCC1(CN1)C1CN1,0.2908
C1C23CC=CC12CCO3,0.238
O=CC(=O)C12CCC1O2,0.1539
O=CC12CC1CNC2=O,0.2166
c1c(c(cnc1O)N)F,0.1871
OC1CC2OC(C#C)C12,0.2612
CCC1CC(C1)C#N,0.3326
C1CC11C2CCC1O2,0.329
CC1=CC=CCC=C1,0.1859
CC12C3C(CN13)OC2=N,0.2555
CC1(CO)OC11CCC1,0.3256
CCCC(C)C(C)(C)O,0.3287
CC1(CCO)COC=N1,0.2695
CC1(O)C2CC2C1C#N,0.2935
COc1c(=O)occn1,0.174
CN1C2C3CC3C12,0.2774
C1CCCCC1,0.3783
C1CN1CC(=O)NC=O,0.217
COc1c(c([nH]n1)O)O,0.2436
CNc1cn[nH]c1N,0.2204
CC(O)C1C2OC(=O)C12,0.2732
CCOC1C2COC12C,0.2961
C1CC23COC2COC13,0.3188
C1C23CCC12CC=CC3,0.258
COC1COC1C#CC,0.2702
CC#CC(C)(C)C(C)O,0.3032
COC1CCC(=O)O1,0.2781
OC1=NOC=C1C1CO1,0.2449
C1C2COC3=C2N1N=C3,0.1761
CC(O)CC(O)C1CC1,0.3123
CCCC12NC1C1OC21,0.2749
CC(C)NC(=O)CCO,0.2778
C#Cc1c(=O)cnon1,0.1685
C1CC2C3C4C(C1)C2N34,0.3112
CCNC(=O)C(C)C,0.2771
CC(C)OC(=O)C#C,0.2374
CC1C2CC(O)C(C)C12,0.3171
OC1(CN2CC12)C1CC1,0.2902
c1c(c(nc(n1)N)O)O,0.1852
OC1COC2C3CC2C13,0.3176
CCC(CC)OC=NC,0.2747
CC12CC(O1)C2CCO,0.3115
N#CC1CCC2(CC2)C1,0.3192
CC1CC(C)C2CC2O1,0.3184
COC(=O)C1CC1CO,0.2679
CCCC1=CC(C)CC1,0.2571
CN(C)C(=O)CC#C,0.2687
O=C1C2COC2C2CN12,0.2345
CC1CN(C1)C(=O)OC,0.2915
[NH3+]CC(O)C1=N[N-]N=N1,0.2651
CC1CC2C3C(O)C2C13,0.3279
NC1=NC2CC2OC1=O,0.1827
C1OC2C3C4CC2C1N34,0.3341
CC(O)C#CCC1CN1,0.2833
COC(=O)CCC(=O)N,0.2665
NC(=O)N1C2CC2C1=O,0.2432
O=C1CC2CC1COC2,0.2208
c1c2c(on1)NCCN2,0.2091
CC(C)OC(=O)NC=N,0.2535
CCc1c(c([nH]n1)O)O,0.2459
O=C1C=C(C#N)C2OC12,0.1552
CC1CCOC(C)C1=O,0.2095
CC1(C#C)C2CCCC12,0.2927
O=C1OC2COC12C#N,0.2354
CN1CC(O)C(=O)C1=O,0.1707
c1c2c(nno2)no1,0.1734
CN1CCOC(C1)C#C,0.2572
COC1OC(=O)OC1=N,0.2697
C1C=Cc2c1c(on2)N,0.1902
CC(CO)CCO,0.337
C#CC(=O)NCC(=O)N,0.2335
CC1(CO1)C1NC1CO,0.3125
C1CC(C1)C(=O)CO,0.2342
N#CC1CC=CC2OC12,0.2417
CC1(CC(=O)C(=O)N1)C,0.172
CN1CC2(O)COCC12,0.2934
c1c(oc(=O)cn1)C=O,0.1524
CCCC1=C(CCC1)C,0.2521
C1CC1COCCCO,0.3274
c1cc(ccc1CO)N,0.2039
N=C1CN2CC2CCO1,0.2484
CNc1coc(=O)o1,0.2442
O=C1C2COCC1N2,0.2358
ON=C1C=CCC11CO1,0.189
C#CCC(=O)CCCO,0.2333
c1c2n(nn1)CCOC2,0.2508
CC1CC(O)C11CN1C,0.2933
CC1(CO)OCCC1O,0.3053
CCC1CC(=O)OC1=N,0.2628
O=C1CC2CC1C1CC21,0.2224
O=C1CC=CC1C#N,0.2223
CC1C2CC(OC12)C=O,0.2109
CC#CCC1(COC1)O,0.2842
OCC12OC1C1NC21,0.2683
C1CC2CCC=CC2O1,0.2536
CC1OC2C3CC12OC3,0.2841
N=C1OC2CCC1C=C2,0.242
CC#CC12C3C4C3C1C24,0.2447
CC12CC(O1)(C#C)C2O,0.2613
OCCN1C2CCC12,0.33
CC1C2OC1(C#N)C2N,0.2508
CCCC(=O)NC1CC1,0.2715
CC1CC=C(C1)C(N)=O,0.2187
CC1CC2CC1CCO2,0.3087
CC1=C(NN=C1)C1CN1,0.248
O=COC1CCC2OC12,0.2786
CCC12CCC1C(=N)O2,0.2832
FC1=NC(=N)C=NN1,0.1902
CC1C2CC(N12)C(C)=O,0.2206
CC1OC=NC1C1CC1,0.269
CC1=C(CO)CC(O)C1,0.2496
C#CC1CCC=C1,0.2632
CC(=O)NC(C=O)C#C,0.2104
CC1(C=O)C2NC1C2O,0.231
CC12COC1CN2C=O,0.2632
O=C1NCC1C1CC1,0.277
OC1=CC=CC=NC1=N,0.1421
Cc1cncc(c1C)F,0.2233
O=C1NC2C3CC3C2=C1,0.2077
OC1(CC1N1CC1)C=O,0.2192
C1NC11CC=CC2OC12,0.239
CC12C3CC1C1C(C3)N21,0.3062
CC1=NNC(=C1)C1CO1,0.247
CC1(OC2CC12O)C#N,0.2668
C#CC12CCC1COC2,0.2933
CC1CC1(OC=N)C#N,0.2795
CCC#Cc1cnoc1,0.2111
CC12COC3C1OC23C,0.3122
Cc1cccn1C(C)C,0.2394
CC#Cc1cc(co1)N,0.1817
OC1C2CC1C21CN1,0.3136
CCCC1(CC)CO1,0.3485
CCC12CC(C1)C2C#C,0.2961
CC1(CC2CO2)CCO1,0.315
C1C2C3C2C2C1OC32,0.3092
CC1(C)CC2N=COC12,0.2612
CC(C)CCC#C,0.3154
COC12CC1(C)OC2=O,0.2576
CCc1ncnc(n1)N,0.2216
OC1=CC(F)=NC(=N)N1,0.1851
CCC(C)N1N=NN=N1,0.2737
CC#CC1CCC(C)O1,0.2892
CC1=CC(=O)C2(C)CC12,0.189
OC1C2COCC1C2=O,0.2195
CC12NC1C1COC2C1,0.3019
C1CC1C12CC(C1)CC2,0.3474
OCC1(OC1C#N)C#C,0.2579
O=C1OC2CC2(O1)C#N,0.2848
CC1OCCCC1O,0.3227
CC12NCC1OC2C#C,0.2487
CC1COC(O1)C1CN1,0.3222
O=C1C=CC2CCC1O2,0.1753
c1c(cn(c1O)C=O)O,0.1727
CC12OC3C4C3C1CC24,0.3315
CC12CC1CCO2,0.3127
CCN1CC1C(C)C=O,0.2067
CCn1cc([nH]c1=O)N,0.2286
c1cnc(nc1F)N,0.208
O=C1OCC11COCO1,0.2565
CC#CC1COC1=N,0.2747
N#CCNC1CC2NC12,0.2644
CN1CC11CC2(O)CC12,0.3007
COC1=NC(CN1)C=O,0.2016
C(CC1CCO1)C1CO1,0.3308
C1C2CC1OCOCC2,0.3232
CC1OC2(C)CC12C#C,0.2603
CNC(=O)CC=O,0.2215
CC1(C)OC(C=O)C1O,0.2133
CCN(CC1CN1)C=O,0.2712
NC1=NC(=NN1)C1CO1,0.2382
CC1=CCC=C(CC1)C,0.2522
c1c(nno1)OC=O,0.2177
CC#CC1CCC1(C)C,0.2898
CC1=COC(=N)O1,0.2382
CCC(O)C1CC1,0.3356
CC1CC2C3CC=C1C23,0.2201
CC(=O)CNCC=O,0.2127
CC1C2OCOC12C#C,0.2652
CC1CC(C1O)C(N)=O,0.2742
CC1(C)C2CC1CCC2,0.3392
CCC1C2CC(O2)C1=O,0.2091
CC(O)(CO)C1CO1,0.3302
C#CCC1(COC1)C#N,0.2858
C#CC(CC=O)(C#C)O,0.2224
OC1CN2CC12,0.2971
N=C1ON=NC=C1,0.1636
NC1=NCC(=N)OCO1,0.2468
CC1(CC2NC12)C=O,0.2141
CC1CC2CC2(C)C1O,0.3199
C1CC23OCC2CC=C13,0.2363
CC1N2CC3(O)C2C13O,0.2653
CCC1C(CO)N1CC,0.2787
O=C(OCC1CO1)C#C,0.2352
CCCc1ccn(n1)C,0.257
CC1C(C)C1(C)OC=O,0.2732
C#CC(C#N)C1CCC1,0.2967
O=C1CC2C3CCC3N12,0.2361
CC(O)C1OC1C1CC1,0.3253
CN=c1ccnc(o1)F,0.1838
CC(O)C#CCC#C,0.2839
[O-]C(=O)CN1CCC1=[NH2+],0.2527
CC12CC1C(O2)C#N,0.2637
CC1C2CN(CC=O)C12,0.1936
CC1(NC1C#N)C1CN1,0.2711
O=C1C2C3C4C2CC1N34,0.2187
CC1(O)C2CC1N1CC21,0.2835
COC1OC2COC1C2,0.3338
CC1OC(C)C1(N)C#N,0.284
CC1=[NH+]CC(N1)C([O-])=O,0.2391
Cc1cncnc1CO,0.2063
COC12CC1OC(C)C2,0.3242
NC1=C(N)C(=O)N=NO1,0.1935
CCC1(C)C2CCC1O2,0.3217
OCCNC1COC1=N,0.2552
CC1=NC(O)=NC(=N)N1,0.1879
OC1CC2(O)CC1C=C2,0.2536
OC1C2C3CC3(O)C12O,0.2942
c1c(n2c([nH]1)nnn2)O,0.2147
CC(=N)OC1CC2CC12,0.2867
C(=O)c1c(noc1N)N,0.1872
CC1=CC2OC(C1)C2=O,0.2147
CC(=O)C1(CCO)CN1,0.2261
CC12CC1C1CC2CO1,0.3286
CC1CC2(CC12C)C#C,0.2661
O=C1C2CC3C2CCC13,0.2247
O=C1NCC2(CO2)C=C1,0.2027
CCC(C)(CCO)C=O,0.2235
OC1(CCNC1=O)C=O,0.1997
COC1CC1C=O,0.2247
OC1C2COC1C1OC21,0.327
OC1CCN2CC2C1O,0.2836
CCN1CC1,0.3249
C1COc2c(nn[nH]2)N1,0.215
CC12CC3C1C1(CC1)C23,0.3549
C#Cc1c(=O)nnon1,0.1534
c1coc2c1C=CCN2,0.1687
OCC1OC2CC(C2)O1,0.3121
O=C1CC2OC2CN1,0.2752
Cc1cc(c(o1)C)C#N,0.2105
CC1COC(=N)C(=O)O1,0.2199
C1CC1C#CC=O,0.2039
CC1(COC=N1)C,0.2727
CNC1=COC(=N)C=N1,0.1321
c1nc(c(c(=O)o1)F)N,0.1801
NC(=O)C1CCOCO1,0.2774
O=C1OC2CC3OCC123,0.262
CN1C2C3C1C2(C)C3=O,0.2186
Cc1c(onc1O)CO,0.2405
CC12CCC3C(C1O)N23,0.2943
CCOC(=N)CC=O,0.2229
C1C2C=CC11OCCC21,0.2333
C1C2CCC1C21COC1,0.3114
CC1=CC2CC2C=CC1,0.2286
OCC12C3CC1CCN23,0.3102
CC12OC(CC1O)C2O,0.3029
COC1(C)CC(C)C1C,0.3189
c1ncnc(n1)N=CN,0.1981
CN1CC2C1C(=O)N2C,0.2324
c1c(n[nH]n1)C#CCO,0.2175
NC1(COC=NC1)C#C,0.2725
O=C1CN2CCC(C2)O1,0.2364
CCC(C)(C)CC#CC,0.297
CC1CC=CCC(C)C1,0.2566
Cc1[nH]c2c(n1)OCC2,0.2095
COCC(=O)CC#N,0.2366
CCC1(N)CC1(O)C#N,0.2554
CC1C2OC3C2C(=O)C13,0.2197
O=C1CC2OC1C21CO1,0.2122
CC1OCC2=COC=C12,0.2365
C1CC1C2=NCCO2,0.2599
CC1=CN(C=O)C(=N)C1,0.1976
CC(C#CC#N)N1CC1,0.2164
CC1N2CC2C1(C)C=O,0.2082
CCC(N)C(F)(F)F,0.336
CNC1(C=O)C2CC1N2,0.1839
CC1NC1C1COC1=O,0.2692
C1CC1(C(=O)C(=O)N)O,0.1664
CC(O)CC(=O)C1CN1,0.2216
O=CN1C2CCC1CC2,0.2703
CC12C=CC3C1CC23,0.226
C1C(=O)CN1CC#N,0.2181
CC1(CC1(C)C#N)C#N,0.3004
CCOC1(CCC1)C#C,0.2888
c1c(onn1)OC2CC2,0.2196
OCC1C2CC=CC12,0.2454
CC1C23CCC12OCC3,0.291
CC1CC(=O)C(C)=C1C,0.1974
OC1C2C1C(O)C2O,0.3019
c1ccc2c(c1)CCN2,0.1972
OCC1C2C3CC3CN12,0.2862
CN1C(=O)CC1(C)C=O,0.2079
CC(C)n1cc(cn1)O,0.2352
C1CC2(COC=N2)C=C1,0.2533
NC12C(O)C1CC2C#N,0.2623
CC1(C)CC1C(O)CO,0.3145
OC12CC1C(=O)C21CC1,0.2286
O=C1OC23CC4C2C1C34,0.2633
CC1N(C=O)C1(C)C,0.255
OC1(CCC(=O)C1)C=O,0.2021
COC12C3CN4C(C13)C24,0.2999
CCC(=O)CC1COC1,0.2256
CN=c1cn[nH]nc1N,0.1596
OCC12CC1N=CO2,0.2581
CCc1nc(n(n1)C)O,0.2621
N=C1CCOC(=N)CO1,0.2662
OC1C(C=O)C2CC12O,0.2051
CC1(CO)N=COC1=O,0.2424
COC1OCCOC1C,0.3242
CC1=CCOCC1O,0.2568
CC1=CC2CC3C2C13C,0.236
CNC12C(N)C1OC2=O,0.2264
CC(C)C1CC2CCC12,0.3357
OC1CC11C2C3OC2C13,0.2994
CN=c1c(=O)onc[nH]1,0.185
Cc1ccccc1C,0.2372
OC1C=CC2CC1C2,0.2485
c1c[nH]c(cc1=O)N,0.203
c1cnoc1NCC#N,0.2255
CC1(CC#N)C2CC1C2,0.342
CCC1(OC1(C)C)C#C,0.2835
CC1C2C1C1C3OC1C23,0.3176
N#CC12CC3C(C1)N3C2,0.2905
CC12C3C1C1CC3C2C1,0.3425
C1CC23CC4CC2CC134,0.2993
c1c[nH]c(cc1=NO)O,0.1691
CCN1CC1(C)C=O,0.2164
CC12CC1CCC=C2,0.252
NC1C(O)COC1=O,0.2731
CC(=O)N1C2C3NC2C13,0.2504
CC1CCC1CC1CO1,0.3451
CCC(=O)COC(C)C,0.2329
Cc1c[nH]c2c1cc[nH]2,0.2254
CCOC=NCC(=O)C,0.2243
CC1=CCOC(C1)C=O,0.2152
OC1CN2CC12C1CC1,0.2949
CC1OC(=O)CC11CO1,0.2758
COC12CC(O)(C1)C2O,0.311
CC1C(CC=O)CC1=O,0.2168
CC12CCC(CC1)C2=O,0.2212
C#CC1COC(C1)C#C,0.2906
O=C1CCC2COC1C2,0.2121
COCCC(=O)C#C,0.1989
C1COC(=N1)CCC#N,0.2699
c1nc(nnn1)NC=N,0.1636
O=CC(=O)C1CCCO1,0.1438
CC(N)(C#N)C1CC1,0.2952
OCCCC1CC2CN12,0.3082
CC12CC1OC1CC21C,0.3083
CC12C3OC(C13)C2(C)C,0.3012
CCC1C2OC=NC12C,0.2553
C#CC12CC(C1)OC=N2,0.2528
CC1C2C3C4C1C2N34,0.3049
COC(CCC#N)C#N,0.3033
c1cnc([nH]1)NCC#N,0.2263
Cc1c(=NO)cc[nH]n1,0.1686
OC1CC2(CC12)NC=O,0.2706
CC1(CC1)N=COC,0.2508
CC1C2C3OC2C3C1O,0.2844
CN1CC2(O)C(C#C)C12,0.2436
CN=COC1CC1O,0.2565
CCC(CC#C)OC,0.2897
CC1NC2C(=O)OC12C,0.2414
C#CC1CC2OCC=C12,0.2334
CCC(C)C(C)O,0.3293
COC(C=O)C(C)(C)C,0.2105
CC1C2CC3(CC3)C12C,0.3231
CC1(COC1)C2COC2,0.3101
CC1CN2CC11OCC21,0.2573
C#CC12OC3COC1C23,0.2293
CC#CC1(CC#C)CO1,0.2766
CC(C)(C)OCCCO,0.3242
CCCC(O)CCO,0.3287
CCC12CN1CC2=NO,0.2343
C(C1CO1)C1CCCC1,0.3455
CC(C#C)C1OC2CC12,0.2868
NC1C2C(=O)OC12C#N,0.2273
CC(CO)NC(C)=O,0.2773
OC1C=CCC1N1CC1,0.26
OC12C3NC3C1OC2=O,0.2485
CC(C)C(C)(C)C#C,0.3185
Cc1c(onn1)NC,0.2032
CCC(O)C#CC#CC,0.2197
CCCC(=O)C(C)C=O,0.2002
CCC(=O)C1OC2CC12,0.2213
CC(=O)c1cc(co1)N,0.1654
NC(=O)C(CCO)C=O,0.2155
CC(=O)c1ccco1,0.1909
N=C1CC2=C(O1)N=CO2,0.2051
OCC(CC=O)N1CC1,0.2196
c1nc(no1)N,0.2309
OC1C2(O)C3OC3C12O,0.2759
CCC1OCC=C1CC,0.2445
CN(C)C(=N)C(=O)CO,0.1871
OC1C2COC12C#C,0.2422
CC(C=O)C(O)CO,0.2204
Cc1cc([nH]c1C)OC,0.2343
CC(O)CC(=O)CC#N,0.2217
CC1(CNC(=O)N1)C,0.3055
CC1C2C3C(C#N)N2C13,0.2636
CCNc1c[nH]c(n1)O,0.236
O=CCC12CC1N1CC21,0.2021
N=C1OC2C(CC=O)C12,0.2226
CC12CC(CC=C1)C2O,0.2467
c1c(cnc(c1O)N)O,0.1791
CC1C2CC(C2)CC1=O,0.2182
CC12CC1OC1COC21,0.3023
CC(=O)n1ccc(n1)O,0.2031
c1c([nH]c(=O)o1)N,0.2427
Cc1c(c(co1)N)C#C,0.1956
COC1C(O)C1C1CO1,0.2955
CNC(CC#C)C#N,0.2603
CC12CCC(O1)C(=O)O2,0.2677
CCN1C2CC3(CO3)C12,0.3125
c1cnc-2nn[nH]cc12,0.1669
CC1OC1(C#C)C#N,0.2602
CC1=CC2CC1C1CC21,0.2463
C1C2C1C1N=COC21,0.2667
OCC1C2C=CC(=O)C12,0.186
C1CC12CC(=O)OCO2,0.2705
CCCC1(CCC1)O,0.3251
CC1OCC2C(CO)C12,0.3186
CC1C2C3C1C2C3=O,0.2488
CNC1CC1(NC)C#N,0.2549
OCC1CC1COC=N,0.2825
CCCN1C2C3NC2C13,0.2834
CC1(CO1)C1(CC1)C=O,0.2259
CC1C=CC(C)C1C,0.259
O=C1CC(C#C)C11CN1,0.2104
O=CN1C2CNC(=O)C12,0.2331
CC1C(C2CCO2)N1C,0.2866
CC1COC2(CO)CC12,0.3182
OCC(=O)C1CC1C#C,0.224
O=C1OCC11OC1C#N,0.2513
C1NC11C2C3N2CC=C13,0.1618
c1cncc2c1ocn2,0.2145
CC1(CCC(=C1)CO)C,0.2593
O=CC1N2CC2C11CO1,0.2096
CCC1C2C3C=CC2C13,0.2259
O=C1COC11CCC=C1,0.2092
CC(C)COC(=N)C#N,0.2419
c1c(cnc(n1)F)O,0.1967
c1c(nc(nc1O)N)O,0.2271
CCCOC1COC1=N,0.2698
N#CC1CCC2CN12,0.2778
CCOC1C(O)CC1O,0.304
OCC1CC2(CC2)CO1,0.3276
Cc1cc(n(n1)C)C=O,0.1899
CCN=C1NCC(=O)N1,0.2275
COC1CN2N=CN=C12,0.2697
CNCC(=O)OC,0.2395
CC1CC2OC(=O)CC12,0.2784
c1c(onc1O)C=O,0.1896
OC12CC1CCC(=O)C2,0.2226
N=C1CCC(CO1)C=O,0.2244
CC#CC1COCC1O,0.2853
CC#CC1C2CC1C=C2,0.2298
Cc1cc([nH]c1N)O,0.2396
Cc1nc2n(n1)CC2,0.2693
CC1N(C)C2CC12C#N,0.2441
c1c(c(no1)O)C=O,0.1992
CC1(C#N)C2C3OC3C12,0.2661
C1C2OC1C1=C2NC=C1,0.2249
CCOC1OCCC=C1,0.2541
CNC(C#N)C#N,0.2562
NC1=NC2(CC2N1)C#N,0.2567
CCc1c(c(c[nH]1)C)N,0.225
O=CC1CC11CC(=O)N1,0.2195
c1c[nH]c(=O)c(=O)[nH]1,0.1796
OC1C2CNC2C1C#N,0.2748
CN1C2C3OC4C3C1C24,0.2802
NC=[NH+]C1=CN=C(O)[N-]1,0.1061
C(=O)Nc1[nH]nc(n1)N,0.1882
N#CC1CCC11COC1,0.2741
O=C1CNC(=O)C2CN12,0.2362
CC1=CCCC1=NO,0.1943
OC1C2CC(C2)C11CC1,0.3281
OC12CC3C4C1C2N34,0.287
CCC(O)CC(C)(C)C,0.3228
CC1CC(O)C(O)C1O,0.3172
CC1C2CN=COC12,0.2749
CC(C)(C#N)OCCO,0.2911
CC(C)(c1cc[nH]c1)O,0.2481
COC12CCN3CC1C23,0.3051
C1C=Cc2c1[nH]c(=O)[nH]2,0.1634
c1c(c([nH]n1)CC=O)O,0.1893
Cc1c(cc[nH]1)O,0.2278
CC1CCC1C1CC1O,0.3157
Cc1cc(no1)CO,0.2444
CC(O)CN=C(N)C=O,0.1757
OC1=CNC(=N1)C1CN1,0.2165
COc1nc(=O)cno1,0.1892
C1C23CN=COC12CN3,0.2534
C#CCC12CC3C(O1)C23,0.2769
CNC(=O)CC(=O)C#C,0.17
CCC1C2CC1C2O,0.324
C(CO)c1noc(=O)o1,0.2674
CN=COC(=O)N(C)C,0.2588
CC12CCN1C2C1CN1,0.3043
OC1(CC2CCC12)C#N,0.2938
CN1CC2(C)OCC12C,0.2773
CC(C#C)C1OC1C#N,0.2707
CC1(NC1C#C)C(N)=O,0.2498
COC(C)COC(C)C,0.3313
CN=C1OC(C)CC1=O,0.1856
CC#CC(O)C(O)C#N,0.2808
c1c[nH]cnc(=O)c1=O,0.1658
NC1CCC1(O)C#N,0.2606
N=C1N2CC2C=C1C#N,0.1754
CC1C(C)N1CC#N,0.2689
Cn1c2c(cn1)nco2,0.2247
CN1C=CC(=O)C2CC12,0.181
c1cnn(c1)CC(=O)N,0.2437
CC1C=CCC(=O)C1C,0.2245
CC#CC(C)OC(C)=N,0.2745
NC12CC1OCOC2=N,0.26
CC(C)(O)C1CC1CO,0.3035
OCC12CN3C(C13)C2=O,0.225
CC12CN3C4C3C1(C)C24,0.296
CC1C2OCC3CN1C23,0.2888
COC(C[NH3+])C([O-])=O,0.1652
c1c(c(co1)C#N)C=O,0.199
CC#CC1(COC1)NC,0.2693
Cc1c(ccc(n1)F)F,0.2114
N#CC12OC3C1COC23,0.2499
CC1CC(O)C(=N)O1,0.2871
[NH3+]CC1CC1C([O-])=O,0.1883
CC12COC1(CN2)C#C,0.24
CC1(N=COC1=O)C#C,0.2351
COC1OC(C)=NC1C,0.2761
OCC(=O)C#CC1CO1,0.2
OCC1(O)C=CNC1=O,0.2018
CC1(C)C2(C)CCC12C,0.312
CC12OC1C1(OC21)C#C,0.2455
CCCC(C=O)C#CC,0.2163
OC1C2C3C(C#N)C1N23,0.2922
CCC#CC(=NO)CC,0.2034
C1CC(=O)NC(=C1)C=O,0.1676
C#CC#CC1OC1C#C,0.2112
c1cnn2c1NCC=C2,0.1867
c1c(c(no1)C2CC2)N,0.2154
CC#CC1(CC1)C(=O)N,0.2685
CC(C)N(C=O)C(C)C,0.2659
CC1(CC=CC1)C#C,0.2662
CCn1cc(nc1)CO,0.2488
CC1(CCC#C)CCO1,0.3043
OCC1CC2C(O)CN12,0.2706
N=C1OC2CCC12C=O,0.2203
CC1CC2C1CCC2=O,0.2173
C1C2OCC3C=CCC123,0.2535
CC12COC1(C#C)C2O,0.2345
C(=N)N(C=N)C=O,0.2155
CC1OCC(=O)C(=O)O1,0.1738
C1COCC#CCC=C1,0.2393
CNC(=O)C12CC(C1)O2,0.2691
CC1=CCCNC(=O)C1,0.2476
OCC12CCC3CC1N23,0.3199
CC12C3C1C1(C=O)C2N31,0.1854
OCCC1COC=NC1,0.2723
C1CC1CC(=O)NC=O,0.2165
CCCC#CC#CC#N,0.1931
CN1CC=CC1C(C)=O,0.1924
CN=C(C#N)NCC#N,0.2096
CCC1(C)NC(C)C1=O,0.2153
CC1CC1(O)C#C,0.2753
CC1NC(=O)C1CC=O,0.2243
CC1=CNC(=O)C2CC12,0.2082
CCC#CC1(COC1)O,0.2757
OC1CCC(C=O)C=C1,0.2102
CC(=O)C12CC(O)(C1)C2,0.2252
CC1COC11CC1C=O,0.2158
COC1=NCC(N1)C=O,0.1938
CC1=CCC(=O)C2NC12,0.2079
O=C1CCC1C#CC#N,0.2092
OC1CC2CC12OC=N,0.2791
N#CC12CCC1NC=N2,0.242
O=COC1CC(C1)C#N,0.286
CC12OC1C(=O)C2(C)C,0.2103
CC(C)C1C2CCC12O,0.3031
CC1C2NC2C2NC12,0.2878
CC1CC2CC(O1)C2O,0.3164
OCC1CC2OC2C1=O,0.2068
c1c(nc([nH]1)O)O,0.2431
COC1(C)C2CC1O2,0.3125
OC1C(OC=O)C1C#N,0.2551
CC1CCC1CC=O,0.2278
CN1C2C3C4CN4C2C13,0.2971
CC(C)(C(=O)NC)OC,0.279
CC(C)(C)C1CCOC1,0.3137
COc1c([nH]nn1)N,0.2143
CN(CC#C)C(=O)C#N,0.2228
NC1=NC2CC2C1=NO,0.1808
OC12CC1C(=O)CC=C2,0.213
CC12CC1N(CC2)C=O,0.2574
CN(C)c1nc[nH]n1,0.2152
OC1C2COC(C#C)C12,0.2648
CC1(CC1)NC(=O)NC,0.3017
CC(C)(C)C1CC=CC1,0.2654
C#CC12CC=CCC1O2,0.2656
C1CC=CC#CCC=C1,0.2006
Cc1c(ncn1C)C#N,0.2265
CC(=O)C(C#N)C1CO1,0.2284
CN=C1C2OCC3C2N13,0.2388
C1CC23CCC4N2CC134,0.2644
C1OC23CCCC2OC13,0.2876
CC(C)(O)C(=O)C1CO1,0.2145
CN=C1NC(=N)C=NO1,0.1719
CN1CC(O)C(C1)C#N,0.2649
CC(=O)C12CCC1OC2,0.2261
C1CC2CC1CCO2,0.3134
N=C1OC=CC=CC1=O,0.1552
N#CC12CCC(C1)C=C2,0.2573
CN1CC2OCC2C1=O,0.2657
CCCC(O)C(=O)CO,0.2348
OC1C2C3C2C1C3C#C,0.2974
Cc1c(cnc(n1)O)F,0.2013
ON=C1CNC1C1CN1,0.2343
CC12CN(C1)C2(C)CO,0.3038
OC1CC2C3CCC1C23,0.3224
COCCC1CC(=N)O1,0.2874
CC(O)C1CC2(CO2)C1,0.3268
CC1=CN=C(N)OC1=N,0.1807
C1OC2C=CC1CC=C2,0.2305
CC12COC(O1)C=CC2,0.2498
CC1NC(=O)C=CC1O,0.2047
COc1c(ocn1)C#N,0.1937
O=CNC1CN2CC1C2,0.2582
Cn1nc(nn1)NC=N,0.2103
CC1CC1C1C2CCC12,0.3306
CC1(CO)C2OC1C2=O,0.2492
COCCC1CCC1=O,0.2196
Cc1[nH]cc(n1)C=O,0.2051
OCCC1CC2NC12,0.3071
c1cc([nH]c1CO)N,0.2208
CC1OC2CC1COC2,0.3157
C1NC11COCC2NC12,0.2932
C1C2C3C=CC1C1C3N21,0.2453
OCC(O)C(=O)C#N,0.1808
CC1C=CCCC1O,0.2686
c1c2c([nH]n1)NCC2,0.2309
C1CN(C=C1)C(=O)C=O,0.1419
OC1CCOC(=N)C=C1,0.2111
C1CC(=O)C(=C1)NC=O,0.1887
CC12CC(C=O)C1O2,0.2153
c1cnc(=O)[nH]c1C=O,0.1415
CC1C2(C)COC12C=O,0.2161
C1C2CC1COCOC2,0.3231
O=CC1OCC=CC=C1,0.1871
C#CC12C=CC3CC1C23,0.2294
CC1CC(=CCO1)C#N,0.2233
c1cc(oc1N)N2CC2,0.2125
OCC1COCOC1=O,0.2552
COCC1CCC1O,0.3215
CC1OC2CC2C1C#C,0.2824
CC(O)C1(C)NC1C,0.3057
C1CC2C1CC1CC2O1,0.3141
COC12CC1(C)CC2C,0.2959
OCCC(O)(CO)C#N,0.2913
OC12CC1(CC2)OC=O,0.2414
CCC12CC1OC(=N)O2,0.2992
C#Cc1cccnc1O,0.1857
O=C1OC2C1C21CCC1,0.2729
CC1NCC(=O)C(C)=C1,0.1806
CC1CC(=O)C1CC#N,0.2215
CC(O)(C[NH3+])C([O-])=O,0.2648
OC1C2NC(=O)C1C2O,0.259
CC#CC(C)C#CC=O,0.2003
CC1CC=CC2OC12C,0.2395
O=C1CCOCC2CN12,0.2491
O=C1C2C3C1CCN23,0.2198
Cc1c(cc(n1C)N)N,0.2193
N#CC12CC(CC1)N2,0.2772
CC(=NO)C1(CC1)C=O,0.2211
CC12CNC(=O)C1N2,0.2573
C1CC1C(=O)C(=O)C=O,0.1328
CC1CN2N=CC(O)=C12,0.2349
C#CC12OC1CC21CC1,0.2602
C1CC2C3OC(C=C1)C23,0.2285
OC12CC(=O)C1C2C=O,0.2061
CCNc1cc([nH]c1)O,0.2328
C#CCCc1ccn[nH]1,0.2545
OC1C2CC2C(=O)C1=O,0.15
CC1CC23CC4C2OC134,0.269
OC1C(=O)NC=CC1=O,0.18
C1CC1CC2CC(=O)C2,0.2231
CCCC1C(C#C)N1C,0.2561
N#CC12OC3C4C3C1C24,0.2706
C#CCOCC#N,0.2698
N=C1CC(O1)C#C,0.2764
OC12C3NC(=N)C1OC23,0.2273
CCCC1C2CC1CC2,0.367
C1C(COCO1)C(=O)N,0.2693
CC1C=CCC(=O)C=C1,0.1804
CC(C)NC(=NC)C#N,0.2009
CC#CC1CC2CC1C2,0.2973
CC12C3C4C(C13)N4C2=O,0.2237
CN1CC1C1CC2CC12,0.3004
CC1CC2=C(C1)C=NN2,0.248
CC12NC1C(O)C2C#C,0.282
CC1(O)C(O)C1OC=O,0.241
N#CC1CC2CC(C2)N1,0.2572
[O-]C(=O)C[NH2+]CC#C,0.2657
CC(C)CC1OC1C=O,0.2189
CC1CC1(O)C1CN1,0.288
O=C(CC#N)CC1CN1,0.2248
CC(CO)C(C)CC#C,0.312
CC12CC1OC(=O)C2=O,0.1733
C1CC23OC4CC2OC134,0.2847
COC1CC=CC2OC12,0.239
CCC1CC(=N)N1C=O,0.2294
CCC(C)C#CC1CC1,0.281
COCC1OC(=N)C1O,0.2737
CN1C=C2COC2C1=O,0.1857
CCCC1C2C3CC3N12,0.2786
CCC1C2OC(N)=NC12,0.2686
CCC(=O)NC1(CC1)C,0.272
C#CC1NC1CN1CC1,0.2652
C1C2OC(C12)C1COC1,0.3168
CCCc1ccccn1,0.2274
OC1COC=NCC1=O,0.2138
CN=C1CCCC(=O)N1,0.2342
CC1=C2COC2C2OC12,0.2282
CC(C)C12NC1CC2O,0.2962
O=CC12CC1C(O2)C#C,0.2204
OC1CCC(=O)C11CC1,0.2236
CC1(CC1)C(C#N)C#N,0.2983
C#CC1OCOCC=C1,0.2608
CC(C)C12OC1CC2=O,0.2153
CC1C2C3CC2(C3)C1=O,0.2166
C1C2C3C(N12)C31CCO1,0.2959
CC(CO)C(O)C(N)=O,0.2715
CC1CC2NC12C(N)=O,0.2447
CCC1(CC1C#N)C=O,0.2198
OC1CC2COC2C1,0.324
CC1CC2(C)CC12,0.3336
OCC1N2C3CC2C13O,0.2941
c1nnn(n1)C(=O)N,0.2299
CCOC1OCCC1=O,0.215
OCC1=CC2OC2C1O,0.2371
CC1CC2CN2C1C=O,0.2117
COCC(C)CCC#N,0.2999
OC1CNC1C#CC#C,0.219
CCOC(CC#C)C#C,0.2891
CC1CC11CCCO1,0.3126
N#CC1=CC2COC2C1,0.2156
CCOC=NC(C)C#C,0.2708
C#CCC12OC3C1OC23,0.2869
Cc1cn(nc1C)C,0.2513
CCC12OC1CN1CC21,0.2923
COC1CCOC1CO,0.3138
CC1(CC1C#N)N1CC1,0.2733
N=COC(CC#C)C#N,0.2792
CC1(CO1)C1=CC=NN1,0.2479
C1CC1CN2CC(=O)C2,0.2073
CC1N(C=O)C2CC12C,0.2607
O=CC1C2CC3OC1C23,0.2081
CC1=C(CNC1=O)C#N,0.194
c1c(nc([nH]c1=O)F)N,0.2026
C1C2CC1C1CC2O1,0.311
CCC1OC2=NCCC12,0.2661
OC(C=O)C(=O)CC#N,0.2055
COC1OCC=C1C#C,0.2107
CC12CC(=O)C1(N2)C=O,0.2017
N=C1OCOCC2NC12,0.2588
CN1CC1(C)C1CC1,0.3026
OC1C(O)C1C1(O)CC1,0.2757
N#CC12COCC1CO2,0.2729
c1c[nH]nc1C(=O)N,0.2297
CC12OC3C(C=C1)C23O,0.2292
c1c[nH]c(=O)c(c1O)N,0.1681
CCC(C)(CC)C(C)O,0.3309
CCc1c([nH]c(n1)O)O,0.2322
OC12CC=CC1CC2=O,0.2162
O=CNC1CC2(CO2)C1,0.279
CC#CC1(CC1O)C=O,0.224
COC1(C)C2OC=NC12,0.252
NC(C#N)C#CCC#N,0.2727
COC12CC1NC2C=O,0.1978
OC1C2(O)C3NC2C13O,0.2836
OCC1(O)CCCOC1,0.2928
CC1CC(C=C1N)=NO,0.1892
C1C2CC=CCOC12,0.2573
C#CC12N=CN3CC1C23,0.2158
CC1C2C3C1C(=O)CN23,0.2175
CC(=O)CC#CC(=O)N,0.2247
C#CC1C2C=CC1N2C,0.2147
CC12C=CC3(C)CC1C23,0.2382
NC1=NC=CC(=N)N=C1,0.1455
CC1C2OC2C1C1CO1,0.3287
CC1OC1(CC#C)C#C,0.2823
C#Cc1cnc(cn1)O,0.1814
COC(=N)CNCCO,0.2785
O=C1C=CC2C3CC3C12,0.1797
CC1COC(C=O)C1C,0.2091
OC1C2OC2CC1C=O,0.2304
CC1CC2(CC2(C)C)C1,0.33
N=COC1CCC2NC12,0.2692
CC1C2C(C#C)C(=O)N12,0.2293
CCC1COCC1=O,0.215
C(C(F)(F)F)NC(=O)N,0.308
CCCOC(C)(C)CO,0.3167
CC1(O)CCC11CCC1,0.3219
CC1(CCC=CCO1)C,0.2636
CN=C1C(O)C(C)N1C,0.2488
COC1CC2OCCC12,0.3096
CC1(OC1C#C)C1CN1,0.2586
CNc1ncc(cn1)F,0.1761
CCC1(N)COC1C#N,0.2584
COC1(CO)CC(C)C1,0.3278
CC(C#N)C1(C)COC1,0.2894
C(C#N)N=CNC=O,0.2359
C(CC#CCC=O)CO,0.2191
COC1(CC2CC12)C=O,0.2119
O=CC1=CCCC11CO1,0.1929
OC1C2C3C2C2CC3C12,0.3228
CC#CC(N)C#CC#N,0.2208
CCOCC(=O)OC,0.2779
Cc1c[nH]nc1,0.2601
CC1N(C)C1(C#C)C#N,0.2444
O=C1CC2(CO2)C=CN1,0.2045
CC(=O)C(=O)C(=O)CO,0.1418
CCc1cc(co1)C,0.2351
c1c([nH]c(=O)c(n1)N)F,0.1663
C1CC12CCN=COC2,0.2591
COC12CC1(C)C1NC21,0.314
CC1(CC(O1)(C)C)C,0.3135
O=C1CCCCC1C#C,0.2166
CC1OCC2=C1N=CO2,0.2294
OC1CN2C3COC1C23,0.2943
C(=O)c1c(nc([nH]1)O)N,0.1744
OCC1OC23CC(C2)C13,0.3013
[NH3+]C1C(CO)C1C([O-])=O,0.2707
C1C=C(CC1=O)C=O,0.1847
O=C1CCC=CC2NC12,0.2109
CCC12CC1N1CC21,0.287
C(C(=O)C#CC(=O)N)O,0.1983
CN1C2CC2(C#N)C1=O,0.2448
CC1C(C)C1CC=O,0.2257
CC1CC2COC1C=C2,0.2494
CCc1nc(no1)NC,0.222
CNC(=O)CC(O)C#N,0.2472
C1CN1CC#CC(=O)N,0.2197
c1cnn(n1)C2COC2,0.2443
C1Cn2c1nc(n2)O,0.2449
CCC(=O)n1cnnc1,0.2105
C1CN=COCCC1=O,0.2193
OCC12CC1(CO2)C=O,0.2161
CC1=C(COCC1)C#N,0.2202
CC1OCC(=O)C1O,0.2199
CC#CC#CC(=O)N,0.1949
COC12C3C1C1C3CC21,0.3191
CC(C)(C)C#CC#N,0.2474
c1cc(nc(c1O)O)N,0.1826
COCCC1=CCOC1,0.2471
CC12CN=COC1C2O,0.2733
CC1=CCCCC1C#C,0.2571
c1c(n[nH]n1)OC2CC2,0.2324
CC12CC3C1N2CC3O,0.3101
COC1CCC2(C)OC12,0.328
C(CO)c1c(nn[nH]1)N,0.216
CN=C(C#N)NCC#C,0.2053
COC12C3CC1N(C)C23,0.2957
CC12OC3COC1C2O3,0.2987
O=C(C#C)C12CC(C1)C2,0.1962
CC(NC=O)C#CC#N,0.2206
Cc1cc(on1)C2CC2,0.2346
CN=C1OCC2NC12C,0.2607
CC1CC2OC3C1C23C,0.3059
CC1C2(C)OCC12C#C,0.2602
CC1(O)CC1C1(C)CC1,0.3158
C(=O)Oc1c(nno1)N,0.1825
CC1=CCC(O)C1CO,0.2593
C1C2CCC3OC1C2O3,0.3242
C1C2COCOCC1O2,0.3105
N#CC1CC2C3CC1N23,0.28
C1C2C1C13CC4C1C2N34,0.3044
CC(O)C1C(C)C1CO,0.3042
OCCC(=O)C1CO1,0.2241
CCC(=O)NCC(=O)N,0.2546
O=C1CC2(CC2N1)C#N,0.2684
O=C1C=C(C#C)C2NC12,0.1607
CC1(O)COC2CC2C1,0.3092
COCC1CC1CC#N,0.2971
CC1C=CC2COCC12,0.2618
CN1C2C3CC2C13C=O,0.1874
CC(=N)OC1=NON=C1,0.2269
CC(C(=O)C)C(=O)C,0.2164
CC12COCCC1C2O,0.3045
COCC(O)C(C)C#C,0.3027
c1c2n(c(=O)o1)CCC2,0.2313
CCCOC(=O)N,0.3235
CC1NC1C1=CN=NN1,0.2423
CC(C)OC1C(C)C1O,0.2959
C[NH2+]CC(OC)C([O-])=O,0.1719
CC12CC3CN4C(C14)C23,0.3101
NC1=NC2C3NC3C2O1,0.2782
C#CC1=NC2CCC2O1,0.2114
COC=NCC(C)CO,0.2615
c1c(c(=O)ocn1)C#N,0.1769
NC1=NNC(=N)C=N1,0.128
OC12CC1(OCC2)C#N,0.26
OCC1(CCC1O)C#C,0.2887
CC(OCC#C)C1CN1,0.2625
CC1=CC2CC1C(=O)N2,0.2186
OC12C=CC3C1N3C2=N,0.2243
CN=COC1COC1=N,0.2538
CC(C=O)C1COCO1,0.2214
OCC1(COC1=O)C#N,0.2675
CC1OC2C(C#C)C12O,0.2714
CC#CCNCC#N,0.267
O=CC1OC2(CC2)C1=O,0.2008
CC1OC2C3OC3C12C,0.2999
CN1C2CC1C2(O)C=O,0.1636
OC1C(OC1C#C)C=O,0.2187
CC12C3C(CN13)C21CC1,0.3185
OC1CC2N=CN3C1C23,0.2304
NC1=NC=C(O1)C1CO1,0.2177
CC1(NCC1=O)C#N,0.2142
CCC1=CC2(C)CC1C2,0.2347
CC1CC=CC(CO)C1,0.2649
C1CC=CC(=CC1)C#N,0.1786
CCOCC1CC2CC12,0.3388
CC(NCC1CN1)C#N,0.2732
CCC(CC(N)=O)C#N,0.2669
CNC(=O)OCC1CN1,0.2937
C1c2c(nno2)OC=N1,0.1983
CC(=NO)C1CC1CO,0.2475
CCC12CCC1NC2=O,0.27
Cn1nc(c(n1)OC)O,0.213
COC1CC11CN=CO1,0.2497
CC12CC1COCC=C2,0.2473
CN=c1c(cnc[nH]1)F,0.178
Cc1cc(cnc1)F,0.2211
CC1C2C1C1(C)CCC21,0.3187
C1CC2C1C1CCOC21,0.3074
CC(O)C12NC1CC2=O,0.2195
C#CC(C#C)NC=O,0.2718
CC1C2CCC12CCO,0.3227
CCCC1CCC1C#N,0.3283
OC1C2C3CN3C12C#N,0.2419
CC(O)C(CC#C)C#N,0.294
N=COC12CC1CC=C2,0.248
N#CC12C3CCC1OC23,0.2668
C(OCC1CO1)C1CO1,0.3369
CCCN=C1CCCO1,0.2725
OCC12CCC(OC1)O2,0.3258
CCC(O)(CO)C(C)C,0.3272
ON=C1COCCC1O,0.2458
O=C(C#N)C12CC(C1)C2,0.1975
OC1CCC2CC12C#N,0.3057
COC(=O)C(C)CC#N,0.2821
CC1OC(=N)C=C1,0.2155
ON=C1COCC2NC12,0.2415
c1c(c(co1)N)CO,0.2299
C1CC(C1)(CO)C(=O)N,0.2721
CC12NC1CCC2(C)O,0.3006
Cc1nc(=O)cc(o1)N,0.2071
OC1CCC2C=CCC12,0.2651
CC(NC=O)C1COC1,0.2672
[O-]C(=O)C1CC[NH+]=CN1,0.2463
C1C2N1CC13CC21CC3,0.2732
CC#CC12CC3C1OC23,0.2679
OC1COC1C(=O)C=O,0.1385
OCC1C2OC2C2OC12,0.3128
CCC1(C)CC(=O)C1O,0.223
OC1C2CN2C1C1CN1,0.292
CNC(=NCC=O)C=O,0.1505
c1coc(nc1=O)F,0.2118
CC1CCC2(C)CCC12,0.3508
c1c(c([nH]n1)CCO)O,0.2311
OC1CC(C1)OC=O,0.2794
NC(=O)C(C#C)N1CC1,0.2566
OC1C2CCN2C1=O,0.2268
CC1(C)OCC1O,0.3065
CC1C2CNC(=O)CC12,0.2669
C1CC(=NO)C=C1C#N,0.1636
CCCC1CCN1C=O,0.2636
CCCC(C#N)(C#N)O,0.2932
CC1C2CC3CC2C13,0.3612
C1CC=CC=C(C1)C#N,0.1682
CC1N(CC11CO1)C=O,0.2632
CC1(O)C2OC1C1NC21,0.3036
CC(OCCC#N)C=O,0.2274
OC1CC1(CC#N)C#N,0.3069
OC1C2CC1COCC2,0.3279
CC(C)(C)C1OCCO1,0.3316
CC(O)C#CC(C)C#C,0.2852
N=C1OC(C#N)C1C#N,0.2793
CC12CN1C1COC2C1,0.3146
OC1C2CCC1(O)C2=O,0.2144
CC1C2C3C(N12)C3(C)C,0.3165
CC1C(CC1(C)O)C=O,0.2238
OCC1(O)C2OC1C=C2,0.2368
COC12CN3C1CCC23,0.3246
O=C1CC(O1)C#N,0.2823
Cc1ccc(o1)N(=O)=O,0.171
CC#CC(=O)CC1CO1,0.2082
CC1CC2C1C2(C)C,0.3396
CC12OC1C1OC1C=C2,0.2395
ON=C1CCC1OC=N,0.2401
C1CC2C3C4C1C4N23,0.2837
CC12OC3(C#C)C1CC23,0.2499
CC12CCC1(C)OCC2,0.3171
CCC1CN(CC)C1=O,0.2768
COC(CC#N)C(C)=O,0.2165
c1c[nH]c(c1CO)C=O,0.182
CN(C=O)C1CCOC1,0.2618
OCCC1C2CC(O)C12,0.3224
CCCN=C1OCC=C1,0.2056
O=CC1C2CCN12,0.2067
CNc1c(=O)nnon1,0.154
CC(C)(C(=O)CO)OC,0.2358
OCC1(CNC=N1)C=O,0.1972
c1(c(c([nH]c1O)N)O)N,0.2078
C1CC1C#CC(=O)C=O,0.1554
CC(O)C(C=O)C#N,0.2196
OCC12CC(C1)(O2)C#C,0.2578
CC(C=O)C1=NNN=C1,0.2206
CC1OCCC=C1,0.2651
OC1CC2COCC12O,0.3011
CC(C)(C)C#CCC=O,0.2186
CC1COC1C(=O)CO,0.2142
C1C(=O)C=C(C1=O)CO,0.1592
CN1CC(=O)C1CC=O,0.2021
N=C1NN=CN=CC1=N,0.1502
NC(C#N)C1CCOC1,0.2778
CC12CC3C(C1CO)N23,0.3021
O=C1C(CC2CN12)C#C,0.2294
CC(C)c1ncncn1,0.218
O=CC12CC3CC(C1)N23,0.2014
NC(=O)C1CC2(O)CC12,0.2624
CCOCC#N,0.2934
CC(C)OC(C)C#N,0.3006
COc1cc(oc1)CO,0.2257
CC12CCN3C1C2C3=O,0.2428
CC(C)(C(=O)CO)O,0.2376
[O-]C(=O)C1=CC2CC1[NH2+]2,0.1628
CCC1C(C)OC1(C)C,0.3116
CN1N=CC(=N)C=C1F,0.1726
c1cc(=O)[nH]c(c1F)N,0.1643
CC(=O)C1(CC1)OC,0.223
CC(O)C12CC1OC=N2,0.2563
CC1C2CC(C2)OC1=N,0.2736
c1coc(c1N2CC2)N,0.2157
OC1CCC=CC(O)C1,0.2558
CC12CN3CC(C)(O1)C23,0.2751
CCC12C3CC4C(C14)C23,0.3008
CCC1(C)CC(C)CO1,0.3176
CC1OC1C1=CN=CO1,0.2281
OC(CC=O)C(=O)C#N,0.1539
CC1(COC1)C(N)C#N,0.2731
CC1CC1(C)O,0.3256
CC1C2OC2C=C1C#N,0.2068
CC12OCCC1N=CO2,0.2742
C(C1CCO1)C1CCO1,0.3149
OCC12OC3C1CCC23,0.3036
CCOCC1COC=N1,0.2695
C(CNC=O)C#CC=O,0.2046
CC1CC=CC1(C)C,0.2644
OC12COC1C1(CC1)C2,0.2945
CC(O)C1(O)CC1CO,0.3038
N=C1NN=NC(=N)N=C1,0.1669
OC12CN3C4C3C1(O)C24,0.2628
CCOC1COC(=O)C1,0.2782
CC1=CC2(CO2)COC1,0.2463
COCC12NC1C1CC21,0.2763
CCOCC(CO)C=O,0.2182
CCC1C2C3CC2C13O,0.3248
O=CC1=CNCC2CC12,0.1816
CC1OC(CC1O)C#C,0.2824
C1CC2=C(C1)C1OC1C2,0.2362
CC1C2C(=O)OC12C#N,0.2586
OC1CC11C2C3OC1C23,0.2957
C1C2C3C4OCCC24N13,0.293
OCC1NC1(C=O)C=O,0.2077
CCC(O)C(=O)CCO,0.238
CC12OC1C(=O)CC=C2,0.2098
O=CC1NC11CC(=O)C1,0.2086
CC1CNCC(=O)N1C,0.2454
CC#CC1COCC=C1,0.2544
O=C1C2CC1NC(=O)C2,0.2058
CC(CC#CC=O)C#C,0.2049
COCCC(C)COC,0.3356
CC(OC=O)C(C)C#N,0.285
CN(CCC#C)C(=O)N,0.2856
N=C1N=COC(C=O)=N1,0.1684
Cc1ccn(n1)C=O,0.2215
CC(O)C#CC(O)C#N,0.2666
N=C1OC2CC1OC2=O,0.2547
NC(=[NH2+])C1=COC(=N)[N-]1,0.1704
NC1(C#N)C2OC(=N)C12,0.2566
CC12CC(C1)OC2=N,0.2875
CCN1C2CC1C1OC21,0.2844
CC12CC(C1)C1CC21O,0.3166
N#CCC1C2C3CC3C12,0.2622
O=C1CC2(OC12)C1CN1,0.2118
CC(CO)(C#C)C1CO1,0.3007
C1OC2CC3COCC123,0.3106
CC(C)C1C(O)C1C#C,0.2842
CC1OC2CC12CC#C,0.2788
CC1CC2CC(C=O)N12,0.1838
O1C2C1C1C=CC3C2C13,0.2364
CC(C)C1CCCOC1,0.3226
CCC1(C)CCO1,0.3178
OC12C3CC1C3C2C#C,0.2917
Cc1cccc(c1)C#N,0.2106
CCCC1CN=C(C)O1,0.2712
CC1CC(C#N)C1(C)C,0.327
CC(C)C(CO)C=O,0.2276
NC(=O)C1CCC(=N)O1,0.263
CN(C1CC1)C(=O)CO,0.2574
CC1CN(CCO)C1=O,0.2676
O1C2C3C1C1OC3OC21,0.305
CN=C1CC(CC=O)O1,0.2221
CC1(C)CNC(CO)=N1,0.2535
CC1OC11CC(O)C1,0.321
O=CC(=O)C1CCC=C1,0.1433
CC12OC1C1(NC21)C=O,0.204
CCCC(O)C(C)CC,0.3331
Cn1ccnc1C(=O)N,0.2112
OC1CC2OCCCC12,0.3184
C1CC2=CCOC3C1C23,0.2318
C#CC12CC3C=CC1N23,0.2052
COC1C(=O)CCC1=O,0.1848
C1C2NC3=NON=C3C12,0.2052
O=CN1CCC2CCC12,0.2642
O=CC1CCCCOC1,0.2168
Cc1cc(nc(c1)O)C,0.2125
COC(=O)C12CC(C1)C2,0.2686
CCC(CC#N)C(C)=O,0.2275
N=COCC1CNC1=O,0.2748
C1CC12C=CCNC2=O,0.2476
O=C1CC(C#C)C(=O)C1,0.1967
OCC12CC(C=C1)C2O,0.2395
CC12CCC3CC1CC23,0.3549
COC(C=O)C#C,0.2053
CC1OC(C)(C)C1CO,0.305
CC1OC2C3CC=C1C23,0.2008
CC1OCC(O)C1CO,0.3001
CC1CC2CC1C2(C)O,0.3269
CC(=N)OC(CO)C#N,0.2886
COC1CC1(C)OC=N,0.2711
N=C1C=NON=C1,0.1899
c1[nH]c2c(n1)[nH]c(=O)[nH]2,0.2061
CC1=C(C)C2OCC1O2,0.2421
Cn1ccc(c1N)C=O,0.1842
CC1C2CCC2C1=O,0.2155
C1CC1(CCNC=O)O,0.2547
C1NC11C2OC1C1NC21,0.301
COC12CC3C1N(C)C23,0.2982
C#CC1NC11CCC=C1,0.232
Cc1c(cn[nH]1)CC#C,0.252
CC1CC1NC(=O)C#C,0.2236
CCCC(C#C)C(C)=O,0.2231
OC1C=CC(O)C1C#N,0.2634
C1CC(C1)N(C=O)C=O,0.2247
CCC1(O)COC1C,0.3012
CC12C3C4N3C1CC24O,0.2841
CC(C)OCCCC#C,0.3085
CCC1CC2NC12C=O,0.2039
O=CC1OCC(=C1)C#N,0.1834
CN1C=C2CNC2C1=O,0.1872
OCC1OC2(CC12)C#C,0.2476
CC(CCC=O)C=O,0.215
Cc1nc(=O)oc(n1)F,0.2191
CC1=Cc2c(cc[nH]2)C1,0.1763
CC#CC1(O)CC1CO,0.27
CC1CC2CCCC12C,0.3481
N=C1OCOC2CNC12,0.2429
Cc1c(ocn1)OC=O,0.2293
OCC12NC3C1CC23O,0.2968
COC1=NNC(=N)C=N1,0.1365
Cn1c(=O)ncnc1F,0.2113
CC1CC1(O)C(C)(C)C,0.3176
CC(=NC)OC1(CC1)C,0.273
OC1=CC=C(N1)C1CO1,0.2216
CCC(O)C1CCO1,0.3242
CC1(CC1(N)C#C)C#N,0.276
O=C1CC23CC(C2)C13,0.2184
CC12CC3C4C1C2C34O,0.2969
OC1C2CC3(CN3)C12O,0.304
c1cnc-2ncc[nH]c12,0.146
CCC1(O)CNCC1=O,0.1908
CC1C2CCN2C1=O,0.2372
CC12C3C1C1C3CN21,0.3014
CC1N2CC1(CC2)C#N,0.2673
C1OC1C1C2CC=CC12,0.2459
CC1(CCC1)C(O)C#N,0.3049
NC1=NC(CC1=O)C#N,0.1864
NC12CC1N=COC2=O,0.2308
OC1C2C3NC3C(=O)C12,0.1998
CNc1nccc(n1)F,0.1994
Cc1ccnc(c1O)F,0.2123
CC(C#C)C(C)C(N)=O,0.2682
CNC1CCOC1C#N,0.2531
COC(C)(CO)CCO,0.317
CCC(C)(C)C(=NO)C,0.2581
C1C2OC3C4NC4C2C13,0.3146
OC12CC3CC1C23C#N,0.2721
CC1CC2=C(CCC2)C1,0.2526
O=CN1CC1(C=O)C#N,0.2155
COC1OC(C)C=C1,0.2607
O=C1C2NC2C2CCC12,0.2054
CN=C1N=NON=C1N,0.1615
C1C2C3OC4C3CN2C14,0.2678
COC1(CC1)C(C)CO,0.3141
CC12CN3CC1C3C2O,0.2913
CC1CC2(C)CCC12C,0.3281
CCCC1OC11COC1,0.3227
CNC1=CC(=O)N2CC12,0.2023
C#CC(=O)NC=O,0.1986
CCC(C)(CO)C1CC1,0.3267
CCC1C2CC=CC12C,0.2445
CC1C2N1CCC21CN1,0.3049
CCC(C)(C)CNC=O,0.2811
CC([NH2+]C1CC1)C([O-])=O,0.2615
C1C2CC3CC3CC12,0.3414
OCCC12C3C4C(C13)N24,0.2801
CNC(=O)CC(C)C=O,0.2304
OC1CCC(O)COC1,0.3121
CC12CCC3C=CC1C23,0.2365
O=CCC12NC1CC=C2,0.2106
NC1C(CC11CO1)C#N,0.2784
CC12OC1CC2(O)C=O,0.2185
CN1C2CC2(C)CC1=O,0.2574
OC1(CC=O)C2CC1O2,0.2308
C1N2CC3CCOCC123,0.3166
CN1C(C)(C)C1(C)CO,0.2972
O=CC(CN1CC1)C#C,0.2128
Cc1c(cc[nH]1)C(=O)N,0.2145
CC(CC#C)C1CCC1,0.3135
C1COC(=O)O1,0.3336
CC1(CO1)C1=CC=NO1,0.2369
C1C2CCC3NC3CN12,0.2923
c1nc(no1)C#CCO,0.2151
CCC1OCC1(C)CC,0.3145
CC(CO)C(CO)CO,0.3046
O=CC1COCC(=O)C1,0.2022
CC1OC(=O)C(=C1)C#C,0.1986
ON=C1CCC2CCC12,0.2454
COCC12CN1C1CC21,0.2893
CC(C#N)C12CC(C1)O2,0.2829
CC1(CO)C2COC12C,0.2987
O=CCC1CCC2CC12,0.2268
CCC1CN1C(=N)C=O,0.1739
CCNC(=O)COCC,0.2805
CCC1C(CC1=O)C#N,0.2198
CC(C)CC(=O)CC=O,0.2097
O=CC12CCN1C2C#N,0.2001
N#CC#CC12CC(C1)C2,0.2373
NCC1(NCC1O)C#N,0.266
COC(C#C)C(C)C,0.3002
CC1(C)OC(=N)C=C1,0.2115
CC1CC(C)=C(C1)C#N,0.2158
CC1C2N1CC21CC1O,0.2953
CC1(C)NC1CCO,0.3156
CC1(O)C(=O)CC11CO1,0.1997
C1OC1C1=CC2OC2C1,0.2279
CNc1c(oc(=O)[nH]1)N,0.2342
CC12CC(CO)CC1N2,0.3043
C1CC2(CC2)C(=C1)CO,0.2469
C#Cc1c(con1)C#N,0.2221
ON=C1C=CC2COC12,0.1915
OCC12OCC3CC1C23,0.3172
OC12C3OC(C13)C21CC1,0.2839
N#CC12CCC1CC2,0.3041
C#CC(=O)c1cc[nH]c1,0.1788
C1CC2OCCC2O1,0.3247
CC(O)(C=O)C1CO1,0.2223
CC1=NOC(=N1)C1CN1,0.2311
CCC1OC1(C)C1CC1,0.3509
OC(COC=N)CC#N,0.2826
CC(=O)c1cnccn1,0.1665
CC#CC1CC1CO,0.2837
CCN=C(C(=O)C)N,0.1873
C[NH2+]CC(CO)C([O-])=O,0.2696
C1OC2C1C1C3CC2C13,0.3146
CC12NC1C1OC2C1O,0.2793
CCC#Cc1ccoc1,0.2139
CC1NC1C(CO)C#N,0.2888
O=C1NC(C=C1)C#C,0.2148
CC(C)Nc1ccn[nH]1,0.2372
Cc1cnc(o1)CCO,0.2377
CC1CC2=CN=NN12,0.2609
NC(=O)C(C[NH3+])C([O-])=O,0.2591
C#CC1C2OC=NC12,0.2442
CC1OC2C1C2(O)C#C,0.2541
CC1OC(=N)CCC1=O,0.2174
CCc1[nH]cc(n1)C=O,0.2051
C1C2C1C13CN2C1CO3,0.2735
CC1(CN1)C(O)CCO,0.318
CC1C2C3CC1(CO)C23,0.3075
CCN1CC11CC(O)C1,0.302
CC12CC(O1)C1CC21O,0.3095
CC1=CCOC1(C)C#N,0.2522
CCC(OCC#C)C#N,0.2761
COC(=NCC=O)N,0.1956
OC1C2C3NC3(C#C)C12,0.2719
OC1C2NC2C=C1C#C,0.1977
CCC(COC)C1CO1,0.3323
CC(C)CC1COC1=N,0.2883
CC(C)C#CC1OC1C,0.2732
CCC1=CC(=N)OC1=O,0.1971
OC1C2CCN2C1C#C,0.2338
CC1CC1C1CC2OC12,0.3336
OC1C2C3NC3CC12O,0.2798
OC1C2C(=O)OC12C=O,0.2167
CC1C2CNC1C(=N)O2,0.2593
C(#N)c1c(nc([nH]1)N)N,0.192
c1c(cncn1)C(=O)N,0.2006
O1C=C2N=CN=C2N=N1,0.1519
CCCn1nccn1,0.2567
CN1CC(OC1=O)C#N,0.2588
C#CC1OC2OC1C=C2,0.2429
OC12CC(C1)N1CC21,0.2987
O=CC1CCC=CC1,0.2241
O=CC1CC2CC2O1,0.2081
CCC1(O)CC1(C)OC,0.3039
CC1(C)CN2CC(=O)C12,0.201
C1OC2C3COCC23O1,0.3101
CC12C(O)C1NC2C#N,0.2506
CC(C#C)(C#C)C#N,0.2905
CCn1c(nnc1N)N,0.2466
CC12CCC1CC2CO,0.3308
[NH3+]C1CC2(NC12)C([O-])=O,0.2588
c1c(c(n[nH]1)O)N(=O)=O,0.1707
OC1C=C2CC3OC1C23,0.2129
NC1C(NC1=N)C#N,0.2607
O=CCC1CCCO1,0.2256
OCC1=NOC(=N)N=C1,0.1599
C1CC(=O)CCC=C1,0.225
N=C1ON=C(O1)C#C,0.193
FC(F)(F)C1C2CC1C2,0.415
COCCC1CN=CO1,0.272
CC12CC(C3OC13)C2=O,0.2381
N=C1NCC2(CO2)C1=O,0.1763
Cc1c(c(co1)N)C#N,0.1921
CC(=O)C(C)(C)C1CC1,0.2282
c1c([nH]nn1)C#CCO,0.2073
CCCn1ccnc1C,0.2458
OC1C2CN2C1C1CO1,0.2891
C1C2OC3CN1C23,0.2741
CN(C=O)C12CC(C1)C2,0.2696
CCC(=O)NC(=O)NC,0.2451
C#CC12NC3CC1NC23,0.2525
CC1OCCC(C=O)=C1,0.1953
CC1OC2(C)CC12,0.3186
CC1COC2C(O)C12,0.3098
c1nc2c(o1)COC2,0.2293
CCC1(C)CC2CC12,0.3358
CN1C(C[NH3+])C1C([O-])=O,0.2491
CC#CC1CC(C)C=C1,0.2576
CN1C2C3OC2(C#N)C13,0.2299
OC1COCC=C1,0.2662
CC1=NCC(=NO)CO1,0.2382
CCCC1=CCC(=O)N1,0.2143
CCC(C)(O)C(F)(F)F,0.3548
CN(C)c1ncco1,0.2257
C(CO)C(CCO)C#N,0.3041
OC1CCC2CC2(O)C1,0.3119
CC1CC2(C1)NC2C=O,0.2201
C1OC23COC4C(C24)C13,0.3016
CC1CC1CC(C)=O,0.2284
CC1C(C)(O)C11CCC1,0.3041
C1CC1(CO)OC(=O)N,0.3058
N#CC1=CCC2CC12,0.2094
CN=C1OC(C)C1O,0.2734
C1CN2CCN=C2O1,0.2731
COCC1OC1(C)C,0.3387
CC(O)C(C)(O)C=O,0.2227
C(#N)c1c(oc(=O)o1)O,0.2122
C1CN2C1=NCC2=O,0.23
Cc1c(c(n[nH]1)NC)O,0.2272
C#CCC1=CCC2OC12,0.2427
CCC(=NO)CC(=O)N,0.2326
O1C2C3C4C1C2N=CN34,0.2161
CCOCC(O)C(C)O,0.3324
OC(C=O)C1COCO1,0.2246
c1c(onn1)OC(=N)N,0.2333
CN1CCC(=C1)C=O,0.1734
CCc1c[nH]cc1C=O,0.1929
N#CC1C2OC3C2OC13,0.2882
CC1(C)OCC2OC12,0.3378
OC1C2(O)CC1(C2)C#N,0.2969
CC1(CN1CCO)C#C,0.2753
N#CC1C2CC1C=C2,0.232
C1CC(=O)NC=CC=C1,0.1883
CC1C2C3(O)CN1C23C,0.2874
CC1CNC(=O)C(C)O1,0.2603
CC1(CN1)C1NC1CO,0.3132
C1C(CN1C=O)OC=O,0.2469
OC1C=CC2CC3C2C13,0.2477
CC1=CCC(O)C2CC12,0.2452
Cc1c(n(cn1)C)C#N,0.2118
CC12OC3(C)CC1(O)C23,0.2825
CC1(O)COCC1O,0.3101
C1NC1C1=CC2CC1C2,0.2248
C1CC1(CNC=O)O,0.2483
[NH3+]C1C2CC2C1C([O-])=O,0.2696
CC1C2C3CN1C23C#C,0.2526
O=C1CC2(CN2)C2OC12,0.2127
CCC1(C)NC11COC1,0.2979
CC1OCC2OC1C=C2,0.235
C1CNCC(=O)CC1=O,0.196
CC1CC2CCC=C12,0.2469
OC1CC11CCCO1,0.308
c1c([nH]nc1N)C#N,0.1867
c1c(nn[nH]1)OCC=O,0.2047
OCC12CC(=O)C1O2,0.2174
OC1CC(OC=N)C1=O,0.2003
OCC1CC2CC1O2,0.3212
N=COCCC(=O)C#N,0.1797
CC1=CCCCC1(C)C,0.2608
CC1C2CC1(C=O)N2C,0.1912
CC1C(O)CC1C#N,0.3065
C1OC2CC3(COC3)C12,0.3078
CC1OC(=N)CC11CN1,0.2813
COC(C)CC(N)C#N,0.2844
C(C#Cc1nnon1)O,0.195
Cc1cnc(nc1C)C,0.2107
C1C2CC1C21C2CC1O2,0.3214
CC(=O)C1(O)CNC1=N,0.2165
N=C1CC(=O)C2CC2O1,0.2255
C1NC11C2NC2C11CO1,0.2938
OC12C3OCC1C(=O)C23,0.2335
OC1(COC(=N)C1)C#C,0.2695
CC(C)C1OC1C#C,0.2802
CC1=CCC2(C)NC12,0.2457
CNC(C)(C#N)C#CC,0.2636
OC12CCC11CCC2O1,0.2776
COC(=N)N1C=NN=N1,0.2402
OC1CC(O)C1CC#N,0.3087
OCC12NC1C=CC2=O,0.1753
ON=C1C2CC3OC2C13,0.2492
OC12CCCC1NC2=O,0.272
CC1COC(C)=NC1,0.2712
CN=C1NC2CC12O,0.2355
CCc1nc(co1)O,0.2213
CC(=O)N(C)C(=O)C#C,0.1917
C#CC1NC11CC2CC12,0.2681
N#CC1(CN2CC2)CO1,0.2524
CC(C)c1c(nno1)N,0.1977
OC1C2NC2C(O)C1=O,0.2182
O=CCOC1CN=CO1,0.2287
Cc1nccc(n1)F,0.2232
CCC1OC2COCC12,0.3313
CC1=CC(CO)C2NC12,0.2437
C#CC1CC2=CC=NN12,0.252
CC12NC3C1NC23CO,0.2759
OCC1CCCC1O,0.3247
CC(C)C1CC2CC2C1,0.3359
CC(=O)N(C)C(=O)OC,0.2398
CNC(=O)C([NH3+])C([O-])=O,0.2596
COc1ccc(o1)C#N,0.1894
CCC1C(=O)NC=C1C,0.2088
OCC1C2NC(=O)C12,0.2534
C1CC1CCC#CC=O,0.2054
CC(C#C)C1CN=CO1,0.2707
CCc1cc(c[nH]1)CO,0.2382
CC12CC3(O1)C=CCC23,0.2264
O=CC1CC1C#C,0.2234
C1C2CC(C3CCO3)N12,0.3046
CC#CC(CCO)C=O,0.2162
CC1CN1CC(F)(F)F,0.3207
CC(C)(C#N)C(O)CO,0.307
CCCC1CCCO1,0.3246
CCCC1CCC(=O)N1,0.2732
CC12CC3C(O1)C23,0.3119
NCC(O)(C#N)C1CO1,0.2543
Cc1nc(oc(=O)n1)O,0.2162
C(C=O)N=COC(=O)N,0.2238
O=C1C2CC1C=CCO2,0.1976
CCC12CC1N=C(N)O2,0.27
CC(=O)OCC#N,0.2857
OC1=NC(=O)NC(=N)N1,0.2363
N#CC1CC2C3OC1C23,0.2801
CNC(C)C(=O)OC=N,0.2008
OC1C2OCC12CC=O,0.2137
CC1CC(CO)C1,0.3391
Cn1cc(nc1)N(C)C,0.2114
OCC#CC1CC1O,0.2656
O=CCC1C2CC1C2=O,0.215
CC1C(C)C1CC#N,0.3188
CC(OC(C)(C)C)C#N,0.3012
C1OC1C12CC1CCO2,0.3181
CCC(C#N)C#CC,0.287
ON=C1CC2(CO2)C=C1,0.1869
CC1(C)OCCC1C=O,0.224
CC(C)N1C=COC1=N,0.2179
Cn1cccc(c1=O)F,0.1785
NC(=O)CC1COC1=N,0.2442
CN=C1N=C[N-]C(N)=[NH+]1,0.1824
COC(=N)C(=O)CCO,0.2016
O=C1OC2CCCC2=C1,0.2251
N=C1OCC1NC1CC1,0.2468
CC(C#N)C1(C)CC1,0.3231
CC1CC(CC#N)O1,0.2929
CC(O)C1CN(C1)C=O,0.2662
CN1CC1CCC(N)=O,0.2526
CC#CC1=CCOC1,0.2042
Cc1c(c([nH]n1)O)CO,0.252
O=CN1CC11COC1=O,0.2424
C1CC(C1)C(=O)NC=O,0.2163
CCCC1NCC1=NO,0.2332
C#CC1CC2CC1C2,0.3082
Cc1c([nH]c(n1)C)O,0.2347
CC(=[NH2+])NCCC([O-])=O,0.2422
CC1C(CC11CC1)C#N,0.313
CC(O)C1=CCCOC1,0.2575
C1COCCC1CO,0.319
CC1N2CC2CC1(C)O,0.2944
C1CC2(C1)C1CCC21,0.3331
CCC#CC(CO)C#C,0.2811
c1c(c[nH]c1C=O)O,0.1658
N#CC1NC2CCC1C2,0.2741
CC1(C)OC2C(C#N)C12,0.2826
CN1CC2C3C4C(C14)N23,0.2609
CC1CC=C(CO1)C#C,0.2131
NC(=O)C1NC1C1CO1,0.257
CCC1C2NC1C2=NO,0.2534
CC(=O)C(O)(CO)C=O,0.1913
NC1=CC(=NN1)C1CO1,0.2326
C1C2C1C13COC21CO3,0.2719
OCC1=NOC=CC1=N,0.192
CC1CC11CC(=O)CO1,0.2179
C1CC(=CCC1=O)C#N,0.2083
CCCn1cccn1,0.2623
OC1CC11CCC1=O,0.2177
O=C1N=CON=N1,0.2391
Cc1noc(=O)o1,0.2683
C#CC12CNC1=NCC2,0.2453
C1CN1CC#CCO,0.2674
CC1C(CO)N1CC#C,0.2637
OC1CC1C1OC2CC12,0.2998
C(#N)c1c(non1)N,0.1911
C#CC12OCC(O1)C=C2,0.2413
N#CC12CC1C1CN1C2,0.2585
CN=C1OCC2CCN12,0.2668
c1(c(nno1)O)N,0.1885
CCCC1C2C3OC3C12,0.2849
CC1COCC(=C1)C#N,0.2236
c1c2c(cno2)on1,0.2077
CNc1c(nn(n1)C)O,0.202
OC1CC2CC2C11CO1,0.3013
C1C2C3OC3C3(CN3)C12,0.302
CC1=CCCCC(=O)N1,0.2167
CC1C2C3NC3C12C=O,0.2005
c1c([nH]c(=O)[nH]1)C(=O)N,0.1792
COCC1(C)C(C)C1C,0.327
O=C1CC2OC2CC1=O,0.1588
CC1OC11CC2CN2C1,0.3113
COC(C#N)C1(C)CC1,0.3027
CC1CC2COCC12O,0.3148
C(CCC#N)CC=O,0.2289
OC1(C=O)C2NC1C=C2,0.1812
CC1CCC1(C)C(N)=O,0.272
CC12CC1COC2C#N,0.2946
O=CC1(CCOC1)C#C,0.2212
NC1=NC2CC1OC2=N,0.2422
NC(=[NH2+])[C-](O)C(=O)C#N,0.1538
CC1=CC2CCOC1O2,0.2542
CC#CC1C(C)NC1=O,0.265
OC1C2[NH2+]C1C2C([O-])=O,0.185
CC1C2CN=C(CO)N12,0.2438
NC1=CC(=N)C=NC=N1,0.1361
C#CC1NCC=C1C#N,0.206
C(CCOC(=O)N)CO,0.3235
CCCC(CC)CCO,0.3418
N#CC1CCCC2OC12,0.3132
CC1(O)CC2NC12C#N,0.2598
CCC12OC3C1CC23O,0.2971
CC1CC1OCC1CN1,0.3143
C1C2OC3C4OC1C4C23,0.29
O=CC1(CC2CO2)CC1,0.2248
Cn1cc(c(n1)N)N,0.2174
O=C1CC=CC1CC#C,0.2201
CC1(CO)C2C3CN1C23,0.3164
NC12C(O)C1OC2=O,0.2435
COCCCNC=O,0.2838
CC(O)C1CCC(O)C1,0.3232
CC(C)N1CCC1=O,0.2753
CC1OC1CC1CN1C,0.3081
CC12CC1(C)C1OCC21,0.3211
CC(C)c1c(cn[nH]1)N,0.2307
C1OCC23C4C5C(N24)C135,0.2667
O=C1CC(C1)C1CO1,0.2255
CCc1c(nn(n1)C)C,0.2426
CC1(CC(O)CO)CN1,0.2987
COc1c[nH]nc1O,0.231
CNC(=O)C(=O)C#C,0.1609
c1c(con1)CCC=O,0.2227
CC(O)C(C)CC#C,0.312
CC(C)(C)C(=O)CC=O,0.2052
OC1CCC11CN2CC12,0.2904
CC(C)C(=O)C#CC#N,0.1824
c1c2c(on1)CN=CN2,0.1967
c1c(n[nH]n1)NCC=O,0.1843
CN=C1C=CNN=C1F,0.17
CC1OC(=N)C(C)C1=O,0.2155
CN1CC1C1CO1,0.3092
c1c(c(cnc1O)N)N,0.2002
OC12CC1OC21CCC1,0.282
O=C1OC2CC3C1N3C2,0.256
O=C1C2CC3(CC3)C1O2,0.231
CC1CC2=CCOCC12,0.2563
CC1OCCC(=O)C=C1,0.1879
OC12CC3OC1C2O3,0.2949
C#CC(=O)C(F)(F)F,0.2045
CC1CC2C3OC3C12,0.3213
CC(CC#N)C1CN1C,0.2694
CC12OC1(C=O)C1NC21,0.2094
C1=C(NC(=O)C1=O)CO,0.1507
CC1(C)CC2CC=CC12,0.2587
OC1CCC1C#N,0.2996
OC1(CC(C1)C=O)C=O,0.2069
CNc1ccc([nH]1)CO,0.2188
OC1CC2N3CC3C12O,0.2715
CC(C)OC(C)CO,0.3162
O=CN1C2C3C=CC2C13,0.2161
NC=NC(C=O)C#N,0.2093
CC#CCCCC=O,0.2236
CC1=CCN2CC2C1=O,0.1847
C#Cc1ccon1,0.2255
CC(C(C)=O)C(N)=O,0.2109
CC1OC2C1C1CC21C,0.3113
CCC(=O)C1(C)CN1C,0.2034
C#CCOc1cnon1,0.2319
OCCCC1CN1C=O,0.2529
CC12NC3(C)C1NC23,0.2968
O=C1OC23CCC2CC13,0.2745
CC1OCC1C1(C)CO1,0.32
COC1CC2CC2(C)O1,0.324
OC1CN2CCC2C1=O,0.179
COCC1CC11CCC1,0.3324
C1CN2C1=CCC2=O,0.207
CC1(CN=CO1)C1CO1,0.2745
CC12CC(O)C1(N2)C#N,0.2834
c1c2c(no1)COCO2,0.2203
CC1CC2COC1(C)C2,0.312
CC1=CC2CC(=O)C2C1,0.2196
C1CC12C(=O)NC(=N2)N,0.2235
OC1C2NC2C(=O)C1=O,0.1525
CN1C2CC(=O)C12C=O,0.1983
C[C-]1OC(=O)C=C1C[NH3+],0.2265
CC12NC1C1OCCC21,0.2888
C#CC1=CCC(=O)CC1,0.2106
C(CO)c1c(onn1)N,0.2075
CC12CC1C(C)(O2)C#N,0.2697
OC(CC#C)C1CCC1,0.3045
OC12CC1(CC2)NC=O,0.2669
CC1(C)C(O)CC1=NO,0.2502
CCC1CC2OC2C=C1,0.2456
CC1CC2CC12CC#N,0.2993
CC12OC3C=CC1(C)C23,0.2209
CCC1OC=NC1C#N,0.2696
OC1(CC#C)CCOC1,0.2846
OC12CC1OC1CC21O,0.2808
C(CC1CCO1)C1CC1,0.3302
CC(C)C1CC1CCO,0.3377
OC(CC#CC#N)C#N,0.2429
CC12OCC1C2C=O,0.2127
OCC(=O)OCC1CO1,0.2724
CCC(C(C)O)C(C)=O,0.2276
CC1CC2(C1)NC2C#C,0.2745
CCN1C2C3CC3(C)C12,0.316
CCC1NC11COC1,0.3034
CC1C2COC12CC=O,0.2144
CC1(CCO1)C(O)C#N,0.2688
Cn1cnc(n1)NC=O,0.2295
CC1CCOCC1C#N,0.3003
OC1CC2C(NC12)C#N,0.2604
C1C2NC3=C(C=CN3)C12,0.2208
COCC1CC1C(N)=O,0.2662
N=C(C#C)N1CCN=C1,0.1968
CC12CCC1C(=O)CC2,0.2162
O=C1C2(CN2)CC11CN1,0.2029
C1OC11COC11COC1,0.3098
COC1CC1OCC#C,0.2637
NC1=NC(=N)OC=C1F,0.175
CCC1CC1(CC)C#C,0.2928
COCC1NC1C,0.325
OCC1(O)C2NCC12O,0.2634
OC1CC2(CCC12)C=O,0.2202
COc1cc[nH]c1,0.2406
CN1C(=O)CNCC1=O,0.2227
C1C2C3C2C2C=CC3C12,0.2503
C#CC1CC=CC1C#C,0.2603
COCC1C2C3CN3C12,0.2849
CC1(COCCC1=O)C,0.2229
COC1OCCC11CC1,0.3474
C1C2CC3=NC=NN3C12,0.2597
O=CC(=O)C1CNC1=O,0.1562
Cc1[nH]cc(n1)CCO,0.2442
CCN(C=O)C(=NC)N,0.217
O=C1OCC1CC1CN1,0.2425
C1C2(CN1C=O)COC2,0.2666
OC12CC(C1)C1CCC21,0.3269
C1CC1N1CC1C1CO1,0.3023
COC(C)C1=NCCO1,0.2625
CC12OC1CCN1CC21,0.2984
C1OC2C1C21OCC=C1,0.2148
CN=C1C(O)C2(C)CN12,0.2403
CC1COC11CNC1=O,0.2488
NC(=O)C1C2C3CC2N13,0.2714
CC(C)C1CN=CO1,0.2712
CC(O)C1(CCO)CC1,0.3322
CCC(C#CC)C(C)O,0.2975
CCNC(C#C)C#N,0.2568
C1CC11CC2OCC1O2,0.337
COCCOCCOC,0.3297
CC(C)Oc1cnoc1,0.2216
CC(O)CCC1CCC1,0.3337
N=C1OCC2=CN=CN12,0.222
CN1C2COCC1C=C2,0.23
COC1CC1(C)C,0.3339
OCC1CN2N=NC=C12,0.2582
C1NC11C2C3OC2C13,0.3068
CC1(OC=N)OCC=C1,0.2543
CCC1CC(C)C1=O,0.2177
OC1CCC2CCC12,0.3273
c1c(c(c(nn1)N)N)F,0.2015
CC12OC1C(C=O)C2O,0.2111
O=CC1C2CCC(=O)N12,0.1963
CC1CCC(C)(C)C=C1,0.265
CC1C(O)C(=O)C11CN1,0.199
C1CC(=O)C=C1CO,0.1949
N=COCC1OCC1=O,0.211
CC1CC11OC2C(O)C12,0.2844
CN1CC1C1CC1C#C,0.2646
O=C1CC2C(C3CO3)N12,0.2353
CC1=CC2OC1C2=NO,0.2256
CCC1(CO)CCC1O,0.325
O=C1CN(CC2CO2)C1,0.2103
CC(OC1CC1)C(C)=O,0.228
CNC(=O)C1(CC1)C=O,0.2129
ON=C1C2CC1(N2)C#C,0.247
CN=C1N=COC=C1F,0.1969
O=CC12CN3C4C(C14)C23,0.1984
CC(CCO)C(=O)C=O,0.1529
CCC(C)NC(=O)OC,0.3118
Cc1nc([nH]n1)C2CC2,0.2556
C#CC#CCCC#N,0.2287
CCC(O)C1(C)NC1C,0.3034
CC12OC1C1(CN1)C2O,0.3079
c1c[nH]c2c1cno2,0.2166
CC12CC1NCC(=O)C2,0.2113
CCC12OC3C1C2C3O,0.2965
O=C1CCC2NC2CO1,0.2725
CCC1C2CC2(C)C1C,0.3246
C1CC1C#CC(F)(F)F,0.2776
CC(O)C#CC1NC1C,0.2682
CC1(CCO1)C1CC1O,0.2949
O=CC1C2CCCN12,0.2094
CCC1(CC)CC2CC12,0.3293
c1cncc(cc1=O)O,0.147
OC1CC2CC(=O)C12,0.2177
CC(O)(CNC=O)C#C,0.2705
CC#CC(C)COC=N,0.2741
Cc1cocc1C(C)C,0.2417
ON=C1COC(C1)C#N,0.2456
OC1C2C3OC3C12C#C,0.2402
C1C2C3C4C=CC2C1C34,0.2453
N=COC(=O)C=O,0.1748
OCC1C2OCOC1C2,0.3193
C1C23CC=CC12C1OC31,0.218
CCC1=C(C)C(O)CC1,0.2509
CC1CC(C1)C1(C)CO1,0.3454
C(C=O)O,0.2196
C1OC1C1=NC=CC=N1,0.2105
Cc1c([nH]c(n1)C)CO,0.2329
CC1CCC(O)C(=O)N1,0.2809
OC1=CC(=N)N=NN1,0.1641
N#CC12CC(N1)C=CC2,0.2356
N=C1OCCC(=C1)C#N,0.1869
C1OC2CC1OCOC2,0.3183
CC12CC1C(O2)C1CO1,0.3132
CN1CCCCC(=O)C1,0.1968
OCC1=CCC2CN2C1,0.2447
CC1C2C3N1CC23C=O,0.211
Cc1ncnn1C(=O)C,0.2216
CC(=O)OC(CO)C#C,0.2711
C1CCC(C1)O,0.3338
O=C1NCC11C2COC12,0.2591
CC1OCC(C)N2CC12,0.3036
CC1CC2(CO2)C1CO,0.3298
C#Cc1c(c[nH]c1N)O,0.2
C1C2CCC3OC3C12,0.3371
CC1(C)COC1(C)CO,0.3149
O=C1C2NC3C=CN1C23,0.2094
CC(O)C1=CN=NC=N1,0.1704
OC1C2CC3OCC13N2,0.301
CC1N2CC1(C)C2,0.3089
OC(C#C)(C#C)C1CN1,0.2461
OCC1C2C3CC2C13,0.3378
CC(O)C1C(C)C1C,0.3258
CC12CC3C(O)C(O1)C23,0.3069
Cc1c(c(=O)cc[nH]1)F,0.198
O=CC1CC2OCCC12,0.223
OCC1=CCC2OC12,0.245
CC1CC2(NC12)C#C,0.2543
CC1C(O)C(C)(C)C1=O,0.2114
C1Cn2c(=O)[nH]nc2N1,0.2505
NC(=O)C1CCC1CO,0.2695
CC1(O)C(NC1=N)C=O,0.2075
CCC1CC1C#CCO,0.2705
CC1(O)CC2(CN2)C1=O,0.1919
C1COC=NC12COC2,0.2618
OCC(O)C1(CO1)C=O,0.2107
CC1CC2C(O)CC12O,0.3096
CC1C2(O)CC2C1(C)C,0.3218
CC1NC1COCCO,0.3254
O=C1COC2CC2O1,0.256
COC1C(CO)C1C#N,0.2861
CCC1OC(C)C11CN1,0.3093
CC1CC(C=O)C(=O)C1,0.2095
CCC1C2CC2NC1=O,0.2624
C#CC1(CC1)C2CC2,0.287
CCCOC(C)C(N)=O,0.2743
CC(=O)C1(CO)CCO1,0.2073
OC1CNC(=O)NC1=N,0.252
OC1=NC=NC(=N)C=N1,0.1758
C#Cc1nc(co1)C=O,0.1989
O=C1NC(=O)C2CC1N2,0.2251
CC1CC2C=CC(C)C12,0.2553
CCC12CCC(=O)C1N2,0.2191
CC1OC11CC(O)C1=O,0.186
N#CC1=CCC2OC12,0.2114
CC12CC3CC1C=CC23,0.2478
CC(C)C1CC(O)C1,0.3307
CN=C1OC(F)=NC=N1,0.1892
OC1C2NC2C11CO1,0.2982
COC=NCC1CC1O,0.2693
CC12CC3C4C(N13)C24O,0.2799
c1c[nH]c(c1O)CO,0.2243
CC1N(C)C11COC1=O,0.2431
CN=C1NC(O)=NC=N1,0.1831
O=C1COCCC1C#C,0.2027
C1C2CC11C=CC3C2C13,0.1782
CN=COCC1COC1,0.2724
CC1(C)CC=CC2NC12,0.2408
CCC1C2OC1C2O,0.3014
c1[nH]nc(n1)OC(=N)N,0.2518
CCCC(C)(NC)C#N,0.2725
CC(C)(O)C(O)C1CO1,0.3218
CCC#CC(C)(C)C,0.3022
C1C2OC3CC(C3)OC12,0.3077
OC1COCC=CC1O,0.2376
c1c(cncc1O)N,0.1975
CC1=CCOC(=O)N1C,0.2206
CN1N=NC(=N)C(C)=N1,0.1732
C1=CNC(=O)C1=O,0.148
CC1CC(=O)N1C(C)=N,0.2351
Cn1cc(nc1)C2CC2,0.2354
[O-]C(=O)CC12CC1[NH2+]C2,0.2727
c1cnc(cn1)N2CC2,0.1881
CCC(C)CCC=O,0.2293
CNC(=N)c1ncon1,0.1788
C#CCOCC(=O)C=O,0.1565
ON=C1CC2(O)C(O)C12,0.2431
CC1C2CC(O)CC12C,0.3183
CC12C3CC(C1CO)N23,0.3044
OCCC12CCC1OC2,0.3051
O=CC12NC1CCC2=O,0.1998
CCN(CCC=O)C=O,0.2178
CNC(=O)C12CC1CO2,0.2592
CCC1CCNC(=O)N1,0.2933
COC12CC1CC2C#C,0.2869
CC12CN1CC=C2C#N,0.191
OC(C#N)C1CCCO1,0.2747
OCC1NC1(C#N)C#N,0.2521
CC1N=C(C#C)N2CC12,0.2058
CNc1ncc(nn1)N,0.1483
CC#CC1C2OC2C1O,0.2814
CC(O)C1OC(=N)C=C1,0.2096
OCC1C2C3CN=C1N23,0.1969
CNC(=O)C1OC1CO,0.266
NC1COC2=C1N=CO2,0.2185
O=CC12CCC1=CCO2,0.1977
O=C1C2CC1OCCO2,0.1816
OCC1(O)C=CC2NC12,0.2462
CC1C2C(C1C)C2(C)C,0.3322
OC1CC(=CC1O)C#C,0.2074
N=C1OCC1NCC#N,0.2611
OC1CCC=C1C=O,0.1894
OC1C2CC2C=CC1=O,0.1855
CNc1cc(co1)O,0.2197
ON=C1CC(C1)C#N,0.2473
CCCC1(CN1C)C#N,0.2767
N=C1OC2CCCC12,0.2886
OCCC(CO)NC=O,0.2815
O=C1CC2(CN3CC23)C1,0.2121
COC12CC3(O)C1NC23,0.2881
CC1CCC2C(O)C12,0.3139
OC12CC(OC1)C21CN1,0.2827
C(=O)NC(=O)NC(=O)N,0.2313
CC1CC2COC2C=C1,0.2515
C1OCC2C3C=CC2C13,0.238
CC1CCN=C(N1)C=O,0.1718
OCCC(OC=O)C=O,0.2212
Cc1cnn(n1)C2CC2,0.238
OC12CCN3C4C(C14)C23,0.2799
CCC1[NH2+]CC1C([O-])=O,0.2728
OC1CC2(CC2)C1O,0.3131
O=CC12CC3OC3C1O2,0.2173
C#CC1CC2NC12C#N,0.2581
CC12CC3CC1C23C,0.3215
CCOC(=NCC=O)N,0.1953
CCC1NCC(=O)C=C1,0.178
CCc1c([nH]cc1O)C,0.2289
CCC(C)C1OCC1C,0.3165
CC1=CCC2COC2C1,0.2561
CC1(CO)CN1CC=O,0.2181
CC1NC2C1NCC2=O,0.2035
c1c(n2c([nH]1)ncn2)O,0.2288
CC1C2CN2C(=O)C1=O,0.1527
CC1CC11C2CC3C2N13,0.315
CC1(CC(O1)C=O)C=O,0.2099
CC1CC=C(C1)C#C,0.2091
CC#CC(=N)N(C)C=O,0.2098
CC12C3OC(C1O)C23O,0.293
C1C2NC11COCOC21,0.3191
CC1NC1(C)C#CC#N,0.213
CNCC(=O)OCC=O,0.1955
c1c(onn1)CCC#N,0.2337
OC1C2CC1C2=O,0.2441
C(=O)C#CC(=O)C(=O)N,0.1596
NC12CC1C(O)C2C#N,0.2668
CC1OC1CCC1CC1,0.353
CC1CN2N=C(N)N=C12,0.2259
NC12C3NC1CC23C#N,0.2479
CC1COC(C1)C#C,0.2917
CCCc1cccn1C,0.2388
C#CC12NC1CC1NC21,0.2563
OC1C2CC3C2CC13O,0.3062
OCC1(O)C2CN2C1=O,0.2189
CC(C=O)C(C)(O)C=O,0.2024
N#CC12CN3C(CO1)C23,0.2631
CC#CCN1C(C)C1C,0.2715
NC(=O)NCC(O)C=O,0.2031
C(CC#N)CC(F)(F)F,0.3544
COC1=NNC(=N)C=C1,0.1519
CC(O)C1C=CC2OC12,0.2404
CCC1COC(C)C=C1,0.262
C1OC2CN=C3OCC123,0.2554
C#Cc1cnn[nH]1,0.2135
N=C1N2CC3C2C3C1=O,0.1688
NC(CC#N)C#CC#N,0.2229
COC1CC=C(C)C1C,0.2589
COCC1(C)CC2OC12,0.3353
C1C2OCC3OC12C=C3,0.2146
CC(C#C)(C#N)C1CN1,0.2632
C1CC12CCNC2=O,0.2722
c1(=O)n(nno1)C(=N)N,0.2042
O=CC1C2CC3(CC3)N12,0.2024
OC12COC1C(=O)NC2,0.2445
N#CC12CC3COC1C23,0.2673
OC(C#C)C1(O)COC1,0.2655
CC(O)C1C2OC=NC12,0.2571
OCCC12CC1CC2,0.3264
CCN(C=O)C(=O)NC,0.2375
C#CCCC#CC#C,0.2295
CC(=O)C(O)CCC#N,0.2387
OCC1(C#N)C2CCN12,0.271
CC1(CNCCN1)C#N,0.2452
O=C1C=C2NC3CC1C23,0.1777
OC12CCC1(O)CC2,0.3109
CC1COCCC1=NO,0.2464
OC1(C#C)C2NC1C=C2,0.2232
COc1ncc(o1)C#N,0.2029
CC1CC(C)OC(C)O1,0.3461
COC1COC(=N)C1O,0.2686
CC1=CC(OC1)(C)C,0.2503
CNC(C#C)C#CC#N,0.2069
NC(C#N)C1=CON=N1,0.2241
c1c(c(n[nH]1)O)NC=O,0.2168
CC12C3OC3C1CC2O,0.3109
CC1C2OC2CCC1O,0.3276
OC1C=CC2C3CC12O3,0.232
CC1CC(C1)(C=O)C=O,0.2137
CC1OC1C1CC=CC1,0.2649
CC(C)(C)C1CCC1,0.3568
CC1(CN=C(N)O1)C#N,0.2501
CN1CC1COCC=O,0.2031
C1CC2CC1COCO2,0.3232
CC12CC=C(CO)C1N2,0.2371
CC1CC(C)(O1)C(C)=O,0.2162
C#Cc1cc[nH]c1C#N,0.1887
COC1C(C)OC1=NC,0.2632
O=CC1CC=CC2OC12,0.2224
O=C1C2C3OC1C23C#N,0.2189
CCOC1CC1(O)C#C,0.2588
N#CC12CC3C1CCN23,0.2634
CN1C2CC(=O)C1C2=O,0.2001
OC1(CC1)C(=N)OC=O,0.2361
CC(C)(CCO)COC,0.3273
CCC(OC)C(O)C#N,0.2713
CN1CCC(=O)C12CC2,0.1954
CC1OC1C1CC1C=O,0.2281
CCCC(=O)C(C)CC,0.2297
c1c(ncc(=O)[nH]1)O,0.1441
OC1CC11OCC1C#C,0.2692
Cc1coc(c1C#N)C,0.2145
CC1(C)CC2COCC12,0.3271
C#CC1(CN=CO1)C#N,0.2552
CCCC1(CCC1)C#N,0.3324
COc1c([nH]nc1O)N,0.2379
CC(C)CC1CC2OC12,0.3294
CCC1=CNC(=O)C1,0.2096
CN1CC1C=O,0.1969
CC1CC11C2C3C1CN23,0.3167
OCC#CC1CN=CO1,0.2692
CC(=NO)C1=NCCN1,0.1835
NC(C#N)C(N)C#N,0.2656
CCC1CC2OC12C#N,0.2735
OC1C2OC2C2COC12,0.2979
CC#CC1(C)NC1C=O,0.2135
CC1CC1(O)C(O)C=O,0.2163
CC1C2C3OC2C3C1C,0.2926
CC12CC(CO1)OCC2,0.3217
CC1=CC2(CN2)C(O)C1,0.2377
CC12CCOC(=N)C1N2,0.2567
OC12CCC1C1NC1C2,0.3099
CCCc1cnoc1,0.2454
CC(C)C1(C)NC1C=O,0.2182
C1C2CC3(CC3)CN12,0.3204
OC1C2CC3(COC3)C12,0.3024
CCC(O)C(C)CC=O,0.2292
CN1C2C3NC2C13C#C,0.2417
OCC1=CCN2CC12,0.2354
NC(=O)C1CNC(=O)O1,0.2715
N#CC1CC2CC12,0.311
OCCCC(O)CC#C,0.3038
O=C(C#C)C12CC(C1)O2,0.1789
N=C1NC=NCCO1,0.2335
C(C1CO1)C1CO1,0.354
CC1C2NC2(C)C11CC1,0.3232
CC(CO)NC(=O)C#C,0.2316
C#CC1C2NC2C1C#N,0.268
CC(CO)C(O)CO,0.3156
NC1=CC(=NO1)C1CO1,0.2248
CC1=CC(=O)C2CC2C1,0.1912
OC12COC1CCOC2,0.3114
OC(C#C)C1CC(=O)O1,0.283
CCCC(=O)NC(C)C,0.2774
CC(=O)CC1(CCC1)O,0.2276
CC12C3COC1=NCC23,0.221
O=COC1CC1OC=O,0.2686
CCCNC(=O)CC#N,0.2781
CC(=O)C1C2C3CC3N12,0.2103
CC1(CC=O)NC1C#N,0.2156
O=C1CC2CC2O1,0.2799
CC12CC(O1)C2C#C,0.2788
OCC1CC2CC2O1,0.3195
N=C1OC2=C(O1)C=CC2,0.1716
CC(=O)c1c(nc[nH]1)O,0.1765
CC1=C(F)C(=N)OC=C1,0.1712
C1Cc2c(nn[nH]2)OC1,0.2193
Cc1ccn(c1O)C=O,0.1754
C(COC=O)NC=O,0.2704
CCC1CCC(C1)C=O,0.2293
C1C2N1CCC21COC1,0.3026
N#CC1CC2OCC2N1,0.2758
CC1(C)C2CCC12C,0.3255
CCC1CC2OC12CC,0.3325
CC1(C)C2OC3(CC3)C12,0.3008
OC1C2CCC(O)C1O2,0.2792
CCN1CC2NC(=O)C12,0.2298
CC12OCC=C1CC2O,0.2311
CCC1(CNC1=O)C#C,0.2641
O=CNC12C3C4C1N4C23,0.2327
COC1C2OC1C2C,0.3149
CC12CC1(C)C(O2)C#C,0.2539
CCNC(=O)C(C)OC,0.2744
OCC12COC1C2C#N,0.281
CCC1OCC(C)C1C,0.3146
OC1CC2OCC1CO2,0.3206
CC(C)Oc1c[nH]nc1,0.2304
CN1CC(O)C(C1)=NO,0.2034
COCC1C(C=O)N1C,0.1976
O=C1CC2(C1)OC2C#C,0.2163
c1c(nn[nH]1)C(F)(F)F,0.2645
CC1CCCC11CC1O,0.3298
CC12OC3CCCC1C23,0.3023
[O-]C(=O)C12CC1C[NH2+]C2,0.2599
CC1COCC=CC=C1,0.2038
CC#CCc1ccon1,0.2436
Cc1c2c(c[nH]1)OCO2,0.2325
CN1C=CC(=N)OC1=O,0.1939
OCC(O)C1COCO1,0.3247
O=CC12OC3C1C2C3=O,0.19
CC(N)=[NH+]C1=CC=N[N-]1,0.1608
O=CC1C2NC(=O)OC12,0.2185
C#CCC(=NO)CCO,0.2575
OC1(C#C)C2CC1C2,0.289
CN1CC2NC(C#N)C12,0.2382
c1cnnc(n1)C#N,0.1652
CN1C2C3C=CC1(C)C23,0.2166
CCNC(=O)CC#N,0.2791
CC1CC2C1CCC2C,0.3539
OC1COC11CC1C#C,0.2707
CC1CN(CC1=O)C=O,0.2151
N#CCOC1=NCCN1,0.2368
CC1C2CC1C2(O)C#C,0.2885
CNC(CNC=O)C#N,0.234
CCCC1COC(=O)N1,0.3111
CC#CC12CN1CC2=O,0.2128
CNC12COC1C2O,0.2645
O1C=C2N=CC=C2N=N1,0.1459
OC1C(CC11CC1)C#N,0.2986
OCCCC1CNC1=O,0.2804
CC1C2C(C1O)N2C=O,0.2453
c1c(c(c([nH]1)O)O)CO,0.2133
C#CCn1c(cnn1)O,0.2427
NC12C(OC1=O)C2C#N,0.2407
NC(=O)C1CC1(O)C=O,0.2123
CC12CCC(O1)C1OC21,0.3361
C#CCCn1ncnn1,0.2496
N#CC1C2OC2C1C#N,0.2874
CCOC12C3CC1OC23,0.3055
COC1(CC2OC12)C=O,0.2073
O=C1COCC2CC12,0.2131
CC12CC1C1OCC1C2,0.3155
CC12NC1CC2(N)C#N,0.2708
CC12CC1(O)CC2(C)O,0.3123
CN1CCCC1=O,0.2714
OC1CC=CC2(CO2)C1,0.2507
N=C1CC2=C(N1)ON=C2,0.2084
C1OC11CCN2CC12,0.3144
O=C1CC(C#N)C11CC1,0.22
CC1C2C3CC1(C=O)C23,0.219
CCNc1c(nno1)C,0.203
CC1OCC23CCC12O3,0.3135
CC1(C)C2NC(=O)NC12,0.2797
Cc1c[nH]nc1NC=N,0.2208
COC1CCCOC1=O,0.2483
C1C2CC=CC3CCC123,0.2648
C1COCC(=C1)CO,0.2621
N#CC1C2NC1C21CO1,0.2853
N=C1COCC=CCO1,0.2326
NC1C2OCC2OC1=O,0.2442
CC1NC11C2NC1C=C2,0.218
CC(C)C(O)(CN)C#N,0.2595
CN=C(C(=O)OC)N,0.2054
COC1C2C3C(C)C1N23,0.3082
CC1C2OC(C=O)C12O,0.2104
NC1C2OC1C2(O)C#N,0.2584
C1CN=COCC=C1,0.2532
CC#CC(=O)C1CC1,0.2065
CC1OC1(C)C#CCO,0.2713
COC1C2NC3C2OC13,0.2816
CC1CC11COC1,0.3111
CCC(=NC)N(C)C=O,0.2419
OC1(CC#N)CNC1=O,0.2622
C#Cc1c(c(n[nH]1)N)N,0.1836
CN1CC2(O)CC12C#N,0.2371
CN1CC1C(O)CO,0.2907
OC1(COC11CC1)C#N,0.2511
N#CC1CN=C(N1)C#N,0.2064
O=CC12CC1(CC2)C=O,0.1933
O=C1CC23OC(C=C2)C13,0.1941
CC1CC2CC2C1C#N,0.3161
N#CCC1C2C3CC1C23,0.3003
CC1CN1CC#N,0.2767
CNC(CC1CO1)C#N,0.2668
CCC1(C)OCC1C#C,0.2853
c1c(nco1)COC=O,0.2488
OCC1(O)CCC1=O,0.1963
O=CC1CC2C3CC1N23,0.2095
CC1CC(C=O)C1C,0.2224
CC1=NOC(=N)C(C)=N1,0.17
CC1(C)CC(C)(O1)C#N,0.2869
CC1NC(=O)C1CC#N,0.2765
CC1C2CCCCC12C,0.327
CC12CC(C1)(CO2)C#N,0.2816
CC1CCC(C)(CO)C1,0.336
O=CCC1NCCC1=O,0.1971
CCCN1CC2(C1)CO2,0.2979
Cc1nnn(n1)C(=O)C,0.2127
CC12CC1C=CC2=NO,0.1859
CC#N,0.364
O=C1C2C3CC1N23,0.2343
CCC(C)(O)C#N,0.3172
COCCC(=O)CC#C,0.2328
COCC1=CC(=N)OC1,0.216
OC12C3CCC11OC2C31,0.2977
CCC1(O)COC1C=O,0.2122
Cc1cc[nH]c(=O)c1N,0.1682
CC1C(C#N)C2OC12C,0.293
CC1=CC2(C)CC1C=C2,0.2136
CC(=N[O-])C(O)C1C[NH2+]1,0.0995
COC1CCOCC1C,0.3305
CC(C)(C)NC(=N)C#N,0.2096
C1CC23NC2CCC3O1,0.3151
c1c(=O)[nH]c(c(n1)O)N,0.1403
CC1=C(C)C(=N)OC1,0.2184
N=C1C=NNC=N1,0.1856
COC1CC(O)C=C1,0.2519
COC12CC1OCC=C2,0.2431
CC1OC(C)(C#N)C1N,0.2647
C(C(=O)N)C(=N)NC=O,0.2293
O=C1OC2CC12C1CC1,0.2617
CC1OCC2CC1C=C2,0.2464
CC1=CC23CCC2C1C3,0.2273
C1CC2C3OC3C3C1C23,0.3196
CCC1CCOC1(C)C,0.3131
C1CC11C2CC3CC2C13,0.3533
c1[nH]c(=O)c(c(n1)N)F,0.1852
Cc1nc(no1)C(C)C,0.2623
C#CC1C2C=CC1C=C2,0.2124
OC1CNC2=C1N=CN2,0.2259
C1C=CC=CC=C1C=O,0.1554
OCC1OCCC11CN1,0.2883
CCC12CN=C3OC1C23,0.1624
CC1(CCN1C=O)C#N,0.2635
CN1C2C(=O)CC12C#C,0.2039
CN=c1n(nno1)C,0.1972
CN1N=CC(=O)NC1=N,0.1789
COC1(CC1CO)C=O,0.2198
N#CCC1C2CCOC12,0.2959
CC1=C(CO)C2CC1O2,0.2278
CCCOC(=O)C#N,0.2472
CC(C)c1c(ocn1)N,0.2193
C1CN=COC12COC2,0.273
CC1C2CC2C1NC=O,0.2768
OC1CC2(CN2)C1C#N,0.2831
C(=O)Nc1noc(=O)o1,0.229
CC1=CC=CC=CCC1,0.1762
N=C1ON=CC=C1C#C,0.1475
C#CC1CC2CC1C=C2,0.2533
CC(C#N)C(C)(C)C=O,0.2289
CN1C2CCC12C#N,0.2727
OC1CC2NC11COC21,0.2717
C1C=C(NC1=O)CCO,0.214
CC1C2NC(=O)C(=O)C12,0.1715
CC12C3C4OC1C4C23O,0.3069
C1OC2CC3C4OC3C124,0.2974
CC1(C)C2CC1C2CO,0.3378
CC1CC(=CN1)C(C)=O,0.1775
C1OC1C1C2CCN12,0.3117
CCC(C)(O)CC#C,0.2995
CCC1C2OCC12C#N,0.2709
OC1C2CC1(O)CC2=O,0.227
O=C1C2CN3CC2CC13,0.2194
CC1CC2C3CC(C3)C12,0.3542
Cc1cc(c(o1)C#N)N,0.1891
COC12CN(C1)C2,0.3211
C1C2CC3=C(N=NN3)N12,0.2208
CCCOCCC(C)O,0.3143
CC12CC(CO)(C1)C=C2,0.2395
C#CCC1(CC1)O,0.2942
CC1(C)CN2C(C=O)C12,0.2025
CC12CC3N1C2C31CC1,0.31
Cc1c([nH]c(=O)o1)C#C,0.1908
CC1C2CC(C)C12CO,0.3152
NC=[NH+]C1=C([O-])ON=N1,0.125
c1([nH]c(=O)on1)C(=O)N,0.2051
COCCC1OCC=C1,0.2496
NCC1=NC=NNC1=N,0.1622
OC1C2CC1C(N2)C#N,0.2666
OC(C#C)C1(O)CC1O,0.2451
CC1COC(=O)OC=N1,0.2556
N=C1OC=NN1CC#C,0.2183
CC(C)(O)C1C2CC1O2,0.2866
CNC(=N)C(=O)CO,0.1667
CC(CO)(OC=O)C#N,0.2742
CC(C)(C#CC=O)OC,0.2056
CNC(=O)N1CCC1=O,0.2417
CCC1(O)CC1C(C)O,0.3179
CC1(CC=O)OCC1=O,0.2067
CC12CC3=CC4C(C14)C23,0.1754
Cn1c(=O)ccc(n1)F,0.1661
CC(O)C12CC1CO2,0.3063
O=C1C2COC3CN1C23,0.2303
CC1(C)C(CC1=O)C=O,0.2156
C1CCOCCC=CC1,0.26
CCC1(C)COC(C)O1,0.3247
CC1CC2C(O)C12CO,0.3155
CCC(CC[NH3+])C([O-])=O,0.2756
O=CN1C2C3CC1C23,0.25
CC1C(O)C1CC(C)=O,0.2275
C1OCC2(CC=CC2)O1,0.2648
O=CC#CC1(CN1)C#C,0.1893
OCC1(O)CC1O,0.303
C(#N)c1c(oc(n1)O)N,0.203
CCC1CC2(CO2)C=C1,0.249
CN=CN(CC#C)C=N,0.2193
N=C1OCC2C1N2C=O,0.246
CCC1OCC(O)C=C1,0.2504
CC1CC11OC(C)C1C,0.3
N#CC12CCC(OC1)O2,0.2751
CCCCn1cccn1,0.2622
COCC(O)CC1CO1,0.3256
CCCC1CC(O)C=C1,0.2583
COc1c(nc[nH]1)O,0.2211
CC(CCCC#C)C=O,0.2259
C1C2CC3=C(C=CO3)C12,0.2246
CC1(CCC(=O)CN1)C,0.1962
O=C1CC2OC11CNC21,0.2105
COC(CC#CC)C#N,0.2696
O=C1OCC11CCO1,0.2447
OCC1COC(=N1)C#N,0.2086
C1OC23COC4C2NC134,0.2623
CCCC#CC(=O)OC,0.2337
c1cc(n2c1CC2)CO,0.2351
CN=C(CO)OC=O,0.2419
CN=C1OC2CC(C)C12,0.2723
CC12CN3C1C1CC1C23,0.3016
CC#CC1C2NC1C2=O,0.2379
O=COC12CC1CC=C2,0.2455
CC1C2C3OCC2(C)C13,0.3224
COC1=NCC(=N)N1C,0.2331
CCC(NC(N)=O)C#N,0.2896
CC12CC1C1COC2O1,0.3377
CNC(=O)C1CO1,0.2656
CC1N2C3CC2(C)C13C,0.3104
COCCC#CC1CN1,0.2685
CCn1c(noc1=O)C,0.2498
C#Cc1c(nn[nH]1)O,0.1945
CC(C)CC1(CO1)C=O,0.2201
CC1CC2C(C#N)C12,0.3143
CC(=O)C1C(O)C1CO,0.2176
C1C23CCC12COC3,0.3132
c1c(cnc(=O)[nH]1)C=O,0.1829
CC12CC1(O)CCCO2,0.3126
CC1C2CC1(O)C(C)C2,0.3202
O=CC1OC1CN1CC1,0.2044
CCCC1C2CC1O2,0.3147
CCC(C)CC1CCO1,0.3202
CC1(C)OC2CC1C2,0.324
CC1C2CC2C1C1CO1,0.3266
NC(C#N)C1CC2OC12,0.2779
CCC(=O)C1(C)NC1C,0.2214
CC1CC(O)C(=O)CO1,0.2113
O=C1CC2CNC(=O)N12,0.251
CC12C3CC4C(C14)C23,0.3092
CCC(O)(C#C)C(C)C,0.2951
CCCC12CCC1OC2,0.3053
OC1CC1(O)C(=O)C=O,0.149
OC12CC1(COC2)C#C,0.2771
c1nc(on1)CCC#N,0.2638
C1CC=C(CC=C1)CO,0.2448
CC1OCC2COC1O2,0.3257
CCc1cnc(o1)OC,0.2389
Cc1conc1C#C,0.2255
CCc1c(cno1)C#C,0.2147
OC1=NC(=N)C=NO1,0.1984
CC1(C)C2C3CC1OC23,0.3168
CCC1CC2OC2(C)C1,0.3388
CC1(C)CC1C1(C)CC1,0.3197
CC1C2C3CC=C1C23C,0.1791
CC12CCC3C(CC1)C23,0.3401
CCOCC1OC1(C)C,0.3385
OC12CC1(O)C(=N)OC2,0.2604
c1c2c([nH]c1N)CCO2,0.2094
c1cc2ncncn2c1,0.161
CC1C2C3C4C2C1C34C,0.3235
O=C1OCC=C1C1CO1,0.2214
CC(O)C1CN2CC12,0.2928
O=C1CC2CC2C=CN1,0.2083
N#CC1CO1,0.3004
C1OC2CCC=CC2=C1,0.1945
COC1C2N3CC3C12O,0.2835
Cc1cn(c(c1O)C)C,0.2286
CC1OC(CO)C1=NO,0.2399
C1C(=NO)COCO1,0.2507
OCC1C2CC=CCN12,0.2447
c1cc(=O)cncc1N,0.142
CC1CC2CC2(CO)C1,0.3237
CCC1(C)CN=C(C)O1,0.2722
CC(=O)C12CNC1CO2,0.203
CN1C(CCO)CC1=O,0.2784
CC1=CC2(CC1)COC2,0.2543
O=C(C#C)C(C#C)C#N,0.1952
OC(C1CC1)C1CN1,0.3001
CC12CC1(C=O)C1CC21,0.2181
Cc1cc(nc(n1)C)N,0.2194
CC1CC(C)=CC1C#C,0.2566
C(c1nc(no1)C=O)O,0.191
Cc1c([nH]c(=NC)o1)O,0.2246
OC12CC(C1)OC1CC21,0.3066
CC1(O)CN2CC12CO,0.2937
N#CC12CC3C=CC1N23,0.2103
c1c(nno1)C(=O)N,0.2121
CC1OC11C2CC2C1C,0.3263
C1C2CN1C1=C2ON=N1,0.1617
C1CC12COCCOC2,0.3176
O=C1NC2CC(C2)C=C1,0.2037
CC(COC)(C=O)C=O,0.196
OCC1COC1CO,0.3081
NC(=O)NC1C2CC1O2,0.2959
Cc1cc(=O)nnn1C,0.1711
OC1C2CC3(COC13)O2,0.3022
CC1C2NC2CN2CC12,0.279
Cn1ccc2c1cco2,0.2021
c1c(non1)NC=O,0.221
Cn1cc(cn1)C#N,0.24
CC(C=O)C12CC1CO2,0.2096
CC(O)C1(CC1O)C#C,0.2789
c1cn2c([nH]1)nc(n2)N,0.2222
O=CC1CN=C(N1)C#C,0.1963
ON=C1CC2C(C=O)C12,0.2099
C#CC1CC2OC2C=C1,0.2413
CC1(CC(C1)CO)C,0.3387
CC1C=CCC1NC=O,0.26
C#CC#CC1OCC=C1,0.2209
CC12CN(C1)CC(=O)C2,0.1882
C1C2C=CCCC=CC12,0.2172
CC12CC3C(O1)C(=O)C23,0.2088
CNc1cc[nH]c(=O)c1,0.1881
CC1N2CC11OC(=O)C21,0.2183
C1c2c(n[nH]n2)N=C1N,0.2068
COC1COCCC1O,0.2983
COCC1(O)C2CC1O2,0.321
C[NH+](C)CC(C=O)=N[O-],0.1576
N=C1OCC2C1OC2=O,0.262
CC1(C)C2OC(=N)C12N,0.2592
N#CC1C2CC2C11CC1,0.292
CC1(CC1)C(CO)C#N,0.3025
OC1CC11CC(O)CO1,0.2986
CC1(CC=O)CC2CC12,0.225
N=C1NC=C(O1)C=O,0.1614
CC#CC(=O)COC=O,0.2035
COC12CC1C=CC2,0.2482
[NH3+]CCC1=NOC=C1[O-],0.2152
OC1CCC1CC=O,0.2277
OC1CCCCC2CC12,0.3211
O=C1OC2CC3CC12N3,0.2503
CCC1(CC(N)=O)CN1,0.2684
OC1CC11CC(=O)C=C1,0.1901
NC1=CC(=N)NC(=O)C1,0.1946
CCC12COC1C2C,0.3018
CN1C2C(O)C1C2CO,0.2948
CC1C2CC2N1CC#N,0.255
O=C1CC2(C1)NC2C#C,0.2172
COCC#CC1(C)CN1,0.2609
CC(O)C(C)CC1CO1,0.3281
CCCC1OCC1C#C,0.2881
CC1CC(CC1=O)C#N,0.2219
c1c(cn[nH]1)OCCO,0.2349
Cc1c([nH]nc1O)CO,0.2384
[O-]C(=O)C(NC=[NH2+])C#C,0.1385
CC12C3CC(C1=O)C23O,0.2402
CC1C(C)(C)C1(O)C#C,0.268
COCC(=NCC=O)N,0.2244
CCCC(C)(O)CC#C,0.2994
COC1C(CO)NC1=O,0.2562
C#CC1(CC1)C(=O)C=O,0.151
CC(C)C1OC2C(C)C12,0.3105
C#CCC(=N)NC=O,0.2284
C1C2OC22CCOCC12,0.3295
CC1(OCC11CC1)C#C,0.2761
c1cc([nH]c1NC=O)O,0.1786
CC(O)C1C(C)OC1C,0.3035
N#CCC1CCC2NC12,0.2915
C(c1c(non1)N)O,0.2125
CC(=O)NCC(O)C#N,0.2551
CC12CC1(CO)C=CC2,0.2485
C1CC1OCCC=O,0.2275
CN1C(CO)CC1=O,0.2764
CC1=C(N=NN1)C1CO1,0.2395
c1c(cn[nH]1)N(=O)=O,0.2078
c1nc(c(o1)C#N)CN,0.2056
CC1C2N1CC=C2C#N,0.1902
Cn1cccc1C2CC2,0.2358
O=CC1CC11CC2CN12,0.2209
CC12CC(C1)OC2CO,0.3178
OCC12C=CC3CC1C23,0.2394
CC1(CC1CC=O)C#N,0.2255
NC1C(N)C1(O)C#N,0.2573
NC(=O)CC1C2CC1O2,0.2575
CCOC1C(C)C1CC,0.3125
CC1C(O)C(=O)C1O,0.2213
c1cc(=O)[nH]cc1O,0.1613
CC1CC1(O)C(=O)C#C,0.1938
CCc1nc[nH]c(=O)n1,0.2031
C1C=CC(=CCO1)C=O,0.1732
CC(C#C)C(O)CC=O,0.2275
CC12CC1(C)C(CO)C2,0.3128
Cc1cc(cn1C=O)N,0.1678
Cc1coc(nc1=O)F,0.2158
CC1C2CC1C(=O)O2,0.2753
CC1(C)COCC(=N)O1,0.2743
CC1(OC2CC12)C#C,0.2697
OC12C3OC3C1C2C#C,0.2635
CC1CC2(O)CC12,0.3295
OCC1=CC(CC1)C#C,0.2583
Cc1cc(n(c1)C=O)N,0.1758
CN1CCc2c1occ2,0.2075
N=COC1=NC=CC=N1,0.2091
CC1N2CCC12CC=O,0.2066
CC1C(CC2CN12)C#N,0.2799
CCC1=CC2CC1C2,0.2359
CC1C2C=CC(=O)CN12,0.1613
CNc1c[nH]nc1N,0.2212
O=C1C(CC11CN1)C#N,0.2119
CCCC1(COC1)C=O,0.2244
CN(C)CC(F)(F)F,0.3012
COC1CC1CCCO,0.3247
CC1NC(=O)CC11CC1,0.2737
CC(=N)OC1COC1,0.2699
CCC1(COC1)CCO,0.3164
CC1(CO1)C1=CC=CN1,0.2347
CC1=CC(=CO1)C1CO1,0.2305
COCC1COCC1C,0.3186
CCC#CC1CN1C=O,0.2453
C1CC12CC=CCC2=O,0.2239
OCC1C(=O)NC11CC1,0.2716
C1CC1OC(=O)CO,0.2719
C#CC(CCC#N)C#C,0.2885
CN1CC(C(C)=O)C1=O,0.2249
CN1C2C1C(=O)NC2=N,0.222
C1OC2C3CC12C=C3,0.2305
CC1(CO)CCC(=O)C1,0.2224
O=C1CC2CC3C1CN23,0.2095
CC12COC1C2OC=N,0.2699
CC(=O)C1NC1(C)C#C,0.2115
OC12CC1CCC2C=O,0.2186
N=C1CN=C(CC=O)N1,0.2097
CC1OC2CC(O)CC12,0.3267
CCC1C(C)C1C(C)C,0.3317
N=C1NC(=O)C2(CC2)O1,0.2429
CCOCC(CC)C=O,0.2282
CCOCC(C)C1CC1,0.3406
CN1CC2(C)OCC12,0.2859
CC#CC#CC1CO1,0.2122
COC1C2C(O)C2C1C,0.3074
C1C=Cc2c([nH]nn2)N1,0.1906
CCC#CC(O)C1CO1,0.291
CC12NC1(C)C1CC21,0.3436
CC(=NC)OC(=O)C#C,0.2169
OC12CC3(O)CC1C2C3,0.3121
CC1CC2CCCC2=C1,0.2488
CC1C2CC11OC(=O)C21,0.2566
CCC1CC(=N)NC1=O,0.2479
Cc1c(ccc(n1)O)N,0.1813
OC1CC(=O)CC11CN1,0.2207
CC1C2[NH2+]C1C2C([O-])=O,0.1779
CC(CNC(C)=O)C#N,0.2738
c1c2c(no1)OCCN2,0.2198
CCC1=CCOC1(C)C,0.2456
C#CC(=O)C(=N)N,0.1719
Cc1nc(=O)nc(o1)O,0.2184
CC12OC3C1NC2C3=O,0.2007
CC1CCC(=C1)C(C)=O,0.1937
OC1CCN2CC1(O)C2,0.2738
CN1CC2OC(C#C)C12,0.2357
OC(COC=N)C1CO1,0.2818
O=C1CCC1CC1CC1,0.2195
COCC(O)C(C)=O,0.2382
OC12CC(C1)C(C2)C=O,0.2227
CC1(O)COC11CCC1,0.3021
C#CC1OCC2CC2O1,0.29
Cc1nc([nH]n1)CC=O,0.2133
COC1COCC2CC12,0.311
C#CC12OC3C1OC23,0.2499
N#CC1CNC2CC2N1,0.2387
CC(O)C1CC1C,0.3327
CC1NC(=O)C2C(O)C12,0.254
OC12CC1N(C=O)C2=O,0.219
CCC1C2CCC12C,0.3279
OC12CC3(C=O)C1CC23,0.2212
CNC(=O)OCCC#N,0.2915
CCC#Cc1ncno1,0.209
CC1(CC(O)C1)C1CC1,0.3301
OCC1NC11C2CC1O2,0.31
CCC(=O)OC1(CC1)C,0.2781
C(CC#CC(=O)N)C=O,0.219
CN=C1ON=NC(N)=N1,0.1466
CC1(COC1)C(=O)C#N,0.1765
CC1CNC2C1OC2=O,0.2378
CCC(O)C1=CN=CO1,0.2423
C#Cc1ncc(o1)N,0.179
c1cnoc(=O)n1,0.1647
OC1COC2C3CC12O3,0.2863
OCC12CC3C(O1)C23,0.2971
CC1C(O)CC1(O)C#N,0.283
Cc1cc(=O)c(co1)O,0.196
c1c(c(c([nH]1)C=O)O)N,0.1806
N#CC1C2NCC=CC12,0.2205
CCC(C)CN=COC,0.2698
COCC1C(C)CC1C,0.3297
CN1C2CC2N=C1CO,0.2364
CC1NC1C#CCC#N,0.2662
CC1(C[NH2+]C1)C([O-])=O,0.2766
CN1CC=CC(O)C1=O,0.25
CC(C)C1OC1C(C)=O,0.2211
COC1C2C3OC1C23O,0.2979
NC(=NCC#C)C1CO1,0.2518
CCC1CC2(C1)CC2,0.3482
CC1C2CC1C1C(O)C21,0.3124
Cn1cc2c(c1)CCC2,0.2363
OC(C#N)C1CO1,0.287
CC1C(C)C1OC(C)=O,0.2752
C1C(=NO)C=C(N1)C=O,0.1232
CCC1CN(C)C1C=O,0.1821
c1c(n[nH]c(=O)n1)F,0.1639
N#CC12COCC1N2,0.2889
CC(C)(C#C)OC1CC1,0.2863
CCNCC(=O)C#N,0.1539
NC1=C(O)C(=N)C=NN1,0.1607
CC1OC(=O)OC11CC1,0.3206
CN1CC2(C1)CO2,0.2969
CC12C3CN1C(C#N)C23,0.267
N=C1OC2OC1C1OC21,0.2818
C1CCCC(CC1)C=O,0.2273
NC1(CC1O)C#N,0.2734
CN=c1cnc(n[nH]1)O,0.1362
COC1CC2(C)CC12O,0.3274
CC(O)CC(=O)CO,0.2381
CC1OC(C#N)C1C,0.2791
CC(O)C12NC3C1NC23,0.2869
CC12CC(OC1)C2(C)O,0.2922
CCC1(O)C(C)C1C#N,0.2932
OC1=NC(=N)C=NN1,0.1891
CNc1cncnc1N,0.2007
O=C1OC2CC12C#C,0.2516
c1c(c(on1)N(=O)=O)N,0.1542
CN1CC1C12CC1CC2,0.3074
OCCC(O)CC1CC1,0.323
OC1=C(OC=N1)C1CO1,0.2096
CC1C2C(CC#N)CN12,0.2709
CC12OC(C)(C=C1)C2=O,0.2394
O=CNC1C2CC1C2,0.2764
OC12CC3CC(C1)C23O,0.298
N=C1OC=CC=N1,0.1678
CC1(C)COC(=N)C1O,0.2876
CCC12C3CC1CC23O,0.3103
C1C2C3C2C2CC3CC12,0.3432
CC12COCC1OC2=O,0.2741
CC1C2CC2C1C#N,0.3078
COC1=NCC(C)N1,0.2774
CC12CC(C1)(O2)C#N,0.2575
CCCC(=NO)C1CC1,0.2478
COCCC(=NO)CO,0.2497
Cn1c(c(cn1)N)CO,0.2094
CC1CN=COC1C#C,0.2663
N#CCC1OC1C1CO1,0.3139
CCC1C2OC(=O)C12O,0.2485
CC12CC1(C)C1CC1O2,0.3044
C#CC1=CC2C3CC2C13,0.1846
COC(C#C)C#CC#C,0.2204
COCCC(C)C(C)O,0.3167
COC1(CC(=O)C1)CO,0.2219
CCc1cnc(nc1)N,0.1927
COC1COCC1OC,0.316
CC12CCCCC1O2,0.3396
CC12CC(CN3CC13)O2,0.3022
OCC1CC(=O)C2OC12,0.2128
CC#CC(C)(C#N)C#N,0.2789
COC1(CCC1)CC=O,0.2258
CC1COC(=O)N1,0.3151
CC(C=O)C(C)C1CO1,0.2268
O=CC12CC(C1)C21CO1,0.2139
O=CNCC1NC1C#N,0.2692
CC1OC(CO)C1=O,0.2163
O=C1C2C3C1C(C#C)N23,0.2232
CCC1C(=O)C2CC12C,0.2252
CC1OCCCC1(C)C,0.3187
CCC1CCCCC1O,0.3178
c1c(nnnn1)CO,0.1657
c1cnn2c1CC23CC3,0.2623
C1C2CC3OCCC2C13,0.3216
CC12NC1(C)C1(C)OC21,0.3145
OC1C2OC3C(O)C1C23,0.2907
c1nc(=O)c(c(o1)O)F,0.1986
CCC1OC2C1NC2=O,0.249
Cc1ccc2n1CCO2,0.2282
C1CC1(CC=O)CC=O,0.2204
CN1C2CC(O)C12C#C,0.2601
CC1OCC2=C1N=NO2,0.1707
Cc1c(c(on1)CO)N,0.2059
CN(C)Cc1cocn1,0.2235
OC1CCOC1CC#C,0.3088
OC1C=CC2OC1C2=O,0.2131
N#CC1(CCN1)C1CC1,0.275
CC1CC1C(C)=NO,0.249
Cc1c[nH]cc1CC#C,0.2468
CN1CCC=CC(=O)C1,0.1705
CCC12OC3C1CC23C,0.314
CC1C2(C)C3OC3C12O,0.2829
NC1C(=N)OCOC1=N,0.2556
OCCC12CC1COC2,0.325
OC12CCCC1C1NC21,0.2986
NC(=O)C(CO)NC=O,0.2663
CCCC1OCC1C#N,0.2844
CCC#CCOC=N,0.2794
CC12OCC11CC2CC1,0.2941
CC1C=CC2OC(=N)C12,0.2525
CC1(CNC1CO)C#N,0.2762
CN(C=O)C=O,0.2374
COC1C2OC(C)C12C,0.2997
CC12CC(C1)NCC2=O,0.2072
c1cnc(cc1CO)N,0.2003
C1CCC(C1)OC(=O)N,0.3226
C(c1c(n[nH]c1O)N)O,0.2434
COCc1nc(co1)O,0.2147
CC(=O)[C-]1C[NH2+]CC1=O,0.174
C1C(=O)NC(=N1)N,0.2392
Cc1c(c[nH]c1O)O,0.2164
CC1C2C3C2N2CC1C32,0.2816
COCC(CO)(CO)O,0.311
CC12CCC1C2CO,0.3164
CC(C)OC1(CC1)C#C,0.277
CNC(=O)C(O)CC=O,0.2225
CCC1CC(=O)N1C=O,0.219
OC12CCOC3C1OC23,0.3061
CC1CN=C(NC=O)N1,0.2018
CC1OCC(O)C=C1,0.2501
CNc1nc(co1)C#N,0.1971
OCCN1N=NNC1=N,0.1955
CCC(CC)OCC#C,0.2807
CC1NC(=O)OC1C,0.313
CC1(C(=O)N(C=N1)C)C,0.2309
c1[nH]nc(n1)CC2CC2,0.2682
CC#CC1OCOC1C,0.2818
c1cnn2c1C=CCC2,0.1896
CN1C2C3CC1C23C#N,0.2459
O=C1CC(N1)C#CC#N,0.2132
c1c(c(cnn1)F)O,0.2001
CCC1CCC2OC12,0.3427
CCC12CN(C1)CC2=O,0.2041
OC12C3C1C1(O)CC2C31,0.3019
CC(C)NC(=O)OC,0.3108
CC1(C)C2OC1C1CC21,0.3197
Cc1c(c[nH]c1O)C=O,0.1713
CC1C2(C)NC(=O)C12C,0.2496
OC1(CC2(CN2)C1)C#N,0.2643
CC1CC1C(=N)OC=O,0.2524
CC#CC(C)CCO,0.303
c1c2c(n[nH]1)NCCN2,0.222
OCC1=CNC(=N)C=N1,0.1491
CC1(C)OC(=O)C1C#C,0.2669
CC1(CCC1)C(=O)OC,0.2787
CC1(O)CCOCC1O,0.3109
O=C1OC2CN3CC1C23,0.2345
CC1CCOC=NCC1,0.2578
CC12CN1C1CC21,0.2935
CC#CC12CC1OC2=O,0.2422
N=C1OC2CC2C11CN1,0.2511
COC(C)C1=COC=N1,0.2454
COC1CC11C2CC1O2,0.3089
O=CN1CC2C(C#N)C12,0.2554
CCC(C#C)C1CO1,0.307
C#CC(=NO)CC#N,0.2074
CC1OC(CO)C1O,0.2977
CC1=CCC2OCC1O2,0.2547
C1CC2OCCNC2=N1,0.2487
C1C2CCC3OCOC123,0.3177
CCC1(C)OCC(=N)O1,0.2895
COC1C2C3CC=C1C23,0.1793
OC1CC1C1=CCOC1,0.2365
OC12CC3C4C(C14)C23,0.3033
C1CC(O1)C1=CN=CO1,0.2369
CC(CO)C(C)=NO,0.2567
CC(OC(C)(C)C)C#C,0.296
CCc1cnn(c1)C,0.2524
CC(=O)OCC(O)C#C,0.272
CC(O)CC1COC=N1,0.2681
C1OC11CC2CC(C2)C1,0.3426
CCC(CCO)CC=O,0.2283
OC1C2COC12C#N,0.2471
CC(=O)C1CC1CO,0.2287
CNC1C(OC1=O)C=O,0.1952
CCC1CN=C(N1)C#N,0.1983
NC12C3OC3C1OC2=O,0.2457
OCC12C=CC3OC1C23,0.2227
CC1(CCC1)COC=O,0.2862
OC1CCC(O)(C1)C#C,0.299
CC1(O)C2N3CC2(C)C13,0.296
COCC12CC(=O)C1N2,0.2213
CC1C2CC(NC12)C#N,0.259
CC1(O)CC2OCC12C,0.3059
CC12CCC1(C)OCO2,0.3296
CC(C)C1NC1(C)C#N,0.2841
CC1CCC2CC(C2)O1,0.3161
C1C2C3OCCC=C1C23,0.2242
CN1C=CCCC1=O,0.2099
Cc1c(nc([nH]1)N)OC,0.2166
CC1OCC2=CCCC12,0.2507
CN1CC2NC3C1C23O,0.264
NC1=CC(=N)C(O)=NN1,0.1779
NC(=O)C1CCN=CO1,0.262
CC1(CNC1=O)C#C,0.2654
CN(C)C1CC1(N)C#N,0.2616
C1CC1CC2(CC2)O,0.3262
c1c2c(co1)C(=NC2)N,0.2072
OC12CC3C(C1)C3C2,0.3261
CC12CC(C=O)=CC1O2,0.1851
Cc1c(nc(o1)CN)O,0.2149
CCC(C)NC(=N)C#N,0.209
CC1NC1(C)C(C)(C)O,0.2898
CC12C(CC1O)C2C#N,0.2933
CCC1N2CC2C11CO1,0.3102
CC12COC1C2(C)C=O,0.2148
N=C1NN=NC=CC1=O,0.155
C1C23COCC12C=CC3,0.2455
CC12CC3=CCCC1C23,0.2195
c1c2n(nn1)C(=O)CO2,0.1916
c1c(non1)NCC#N,0.2114
N#CC1C=CC2NC12,0.2428
O=CC12CCC1C(=O)O2,0.2172
C#CC12OC3C=CC1C23,0.2059
O=CC1(NC1C#C)C=O,0.1987
CC1=CN(C=O)C(=N)N1,0.1833
CC(O)C1COC1=N,0.2881
O=C1OCCCC11CN1,0.258
CCCCC1CO1,0.3547
C1C2OC3CC(C=C3)C12,0.2327
OCC12OC3CC1C23,0.302
CN(CC#C)C(=O)N,0.2787
CCc1c[nH]cc1N,0.2314
NC12C3NC1C(=O)NC23,0.2343
CC(=N)N(CC#C)C=O,0.2336
CC(C)OC1CC2CC12,0.3224
NC1=CN=C(F)NC1=N,0.1744
C(c1c(c(no1)N)N)N,0.2142
Cc1ccncc1N,0.2013
CCC1=CC(O)COC1,0.2476
CCC1CC1C#CC#C,0.2168
CCC(C)N1C=NN=N1,0.2686
CC(C)C1CCCC=C1,0.2643
CC1=CCOC2CC1C2,0.2473
CC1(CO1)C1(CC1)C#N,0.3097
COC1CCC11CC1O,0.2981
CNC(=O)C(=O)C=O,0.1268
OC1C2C3OC1C23C=O,0.2172
C1CC11N=C2CC3C1N23,0.1791
CC(=O)NC(=O)CO,0.2245
CC1C2CC=CC1C2=O,0.2161
CC1C2OC(C=C2)C1O,0.2525
CC12CC(=O)N1C=CC2,0.2175
OC1CC2(CC1C2)C#N,0.3056
OC12CC1C1COC2C1,0.3171
OC(C=O)C1CC1C#C,0.2164
C1C2COC3CC12C=C3,0.2244
Cc1ccnccc1=O,0.1589
N#CC1CCOC2CC12,0.294
O=C1NC2CC=CCC12,0.254
CC1=Cc2c(nc[nH]2)C1,0.1804
CC1C(O)C2CC1(O)C2,0.3263
O=C1OC(C=C1)C#C,0.2227
CC1C(OCC1=O)C#N,0.2173
CC1C2C3C4C3N1C24,0.3008
C(CC(=O)C(=O)N)CO,0.1789
CC1(C)C2CCC12,0.3392
CNC(=O)n1ncnn1,0.2193
CCCC1C(C)C1C#N,0.3113
O=CN1C(C#C)C1C#C,0.2467
NC1(CC2CC12)C#N,0.294
CC1N2C(C#N)C2C1=O,0.2129
CC(C=O)C1=CC=NN1,0.2054
OC1CC2OC2CC1=O,0.2352
c1c(cn[nH]1)CCC=O,0.2156
OCC12NC(C=C1)C2O,0.234
C(C1CN1)C1=CN=CN1,0.2473
c1c(c2c([nH]1)CCC2)O,0.2308
CC1C2NC(=O)CC12O,0.2634
CCC1(CCC1)C(C)C,0.3492
C1C2CC1C1CC2CO1,0.3239
OCC1CC=CC(=O)N1,0.2075
N#CC12CNC1C=CC2,0.2408
CC1C2C(O)C3CN1C23,0.264
OC1CCC2C3CN3C12,0.2792
N#CC1C2CC1(N2)C#N,0.2662
ON=C1CC(O)C11CO1,0.2296
CC1=CC(=O)N(CC1)C,0.2046
CC1OC=NCC11CC1,0.2728
CCN=C1CN=CN1C,0.2144
CC(=O)C(CO)C=O,0.2057
CCC1(CN1)C=O,0.2234
CCN1CC1C#CC#C,0.2047
CC1=CC(=N)OC(N)=N1,0.1845
CNC(=O)OC1CC1C,0.3112
C1CC23CC(CCO2)C13,0.3001
CC1OC2(C)CC1(C)C2,0.3174
N#CCN=C1OC2CC12,0.2695
CC(C)C(C)(C#N)C#N,0.3222
CC12NC1C1C2CC1=O,0.206
CC1=NC2CCC2(C)O1,0.2639
O=C1CCC2CC3C2N13,0.2419
N#CC1COC2CC2N1,0.249
OC1C2CC1N2CC#N,0.2595
CC(=O)C(=O)C(=N)N,0.1688
O=CC1NC1CCC#C,0.2213
O=C(C#C)C12CN1CC2,0.1864
FC(F)(F)C12CC(C1)N2,0.3337
OCC(O)CN1CC1,0.2929
CC12NC1C(CO)C2O,0.2977
Cc1c(ccn1C)N,0.2252
CNC(C#N)C#CCO,0.2521
O=CC12CC1CO2,0.2186
CCC1(COC1=O)C#C,0.2621
CC1CCC=CCOC1,0.2457
O=C1C2CC1C(=O)CC2,0.2105
Cc1cc(c(o1)O)NC,0.2074
CC12C(CO)C1CC2O,0.3159
CC1=C(N)C(=N)OC=C1,0.1584
CC(C#C)N1C=CC=C1,0.2368
C1C2CN3C4CCC12C34,0.306
C1C2CN3C=CC=C3C12,0.2329
CC12COC34CC(C13)C24,0.3055
CC1(O)C(O)C1C1CN1,0.2801
OC1CN2C1=CNC2=O,0.2138
C[NH+]=CNC(C)C([O-])=O,0.2397
C(C(=O)N)OC=O,0.2649
CC1C2C(C#N)N2C1=N,0.247
CC(O)C1CCC1C#C,0.2974
CC12OC3CC1C2O3,0.3344
CC1CN1C(=N)C(C)=O,0.1841
NC1C(C#C)C1(N)C#N,0.245
Cn1c(ccn1)CCO,0.2538
C#CC(=O)c1ccno1,0.1857
CC1(O)C2OC1C1OC21,0.3025
CC1C2OC1C21CO1,0.3192
C(=O)(N)n1nnnn1,0.2303
CC(OC=N)C(O)CO,0.2828
Cn1ccc(c1N)CO,0.2262
CC1C2CC2C(C)C1O,0.3219
COC(=O)CC(=O)C#C,0.2077
c1c(nncn1)CC#N,0.164
CC12COC1CC(=N)O2,0.2847
NC(=O)C1N=COC1=O,0.2205
CC1(NC1C#N)C(N)=O,0.2596
OC12CC1CC=C2C#C,0.2021
CC1(O)CCC1=O,0.2186
CC12OC=NCC1C2O,0.2754
C1C2OC1C1OCCC21,0.3231
CC1OC(=N)C2(C)OC12,0.2708
C1C(=NCCO)OCO1,0.258
CCOC1CNCC1=O,0.1874
O=CC1COCC11CO1,0.222
CC(O)C1C2CCC12O,0.3095
COC(C)(CC#N)C=O,0.2097
C1CC23OC2COCC13,0.3205
CC1N(C)CC(O)C1=O,0.1877
C1CC23COC4C2CC134,0.2963
CC12CCC1C1COC21,0.309
O=C(OCC#N)C1CN1,0.2504
CCCC(=O)C1CC1C,0.2305
CCN1C2CC(=O)CC12,0.2123
CCn1c(nc(n1)C)C,0.2575
CC1CC2(OC12C)C=O,0.2176
C#CC12C=CC3CN1C23,0.2208
CC1COC(C)C11CN1,0.3036
C1CC11CC2OC1C=C2,0.2534
Cn1c(c(nn1)OC)O,0.2167
N=C1ON=CC=CC1=N,0.1692
CC(=O)OCC(F)(F)F,0.2886
CC(=O)C(O)C1(O)CC1,0.2129
OCC(=O)C(O)C1CO1,0.2298
CNC(=O)C(C)C(C)=O,0.2099
OC(CNC=O)C#N,0.261
CC1=CNC(O)=NC1=N,0.2012
NC1=CC(=O)OC(=N)O1,0.215
OC(C#N)C1=CNN=N1,0.2552
CCN=C1CC(C)CO1,0.273
CC12C3C4C(C1O)C2N34,0.2993
OC12CC3CC(C1)C3C2,0.3272
CC1CCC2(OC12)C=O,0.2213
CC1CCOCC2CN12,0.2969
NC1(C#C)C(O)C1C#N,0.255
Cc1cncc(n1)O,0.1979
CCN=C1CCCCO1,0.2621
CC1(C)C2C3CC2C13,0.3705
CC1OCC11C2CC1C2,0.327
NC(C#C)C1=NNN=C1,0.2357
CNc1cc(=O)cn[nH]1,0.1856
CC(=O)NC=NCC#N,0.2373
c1nc(=O)c(c(o1)F)N,0.176
CC(C#N)C1=COC=C1,0.2428
CCc1[nH]c(cn1)C#C,0.2031
N#CC1=CCC2(CN2)C1,0.2131
c1[nH]c(=NCC#N)[nH]n1,0.2225
CCOC1CC(C)(O)C1,0.3168
O=CCC12CC(C1)C=C2,0.2115
C1C(N1)(CO)CO,0.3188
NC1C2OC(=O)C12C#N,0.2378
CCOC1CC1(C)CC,0.3131
OC1C(CC11CO1)C#C,0.2924
CC12CC3(CN1C23)C#C,0.2644
CN=C(N)C(=O)C(C)O,0.1865
O=C1C(C#C)C2CCN12,0.2313
CCOC1CC(O)CO1,0.3228
CC1N(C)C11C2CC1O2,0.2998
C1C=CCc2c1nno2,0.2188
Cc1ccc(nc1F)O,0.2084
CCC1NC(=O)C=C1C,0.2162
CC(=O)CC1CC(=O)O1,0.2294
CC1CC(C1)C(=O)C#C,0.2052
CC12CC(O)C1(CO)O2,0.2994
OC12CC3OC1CC23,0.3009
OC12CC1C1(CC1)C2=O,0.221
C1C2CC3CCC=C3C12,0.2441
CCC1N2CC1(C2)C#N,0.2724
CC(CO)C1(CO1)C=O,0.2178
CC1(CC(=NO)C1)C,0.2484
O=CC12C3NC1C(=O)C23,0.1883
CC1CN1C(C#N)C#N,0.2536
CCC12CC1(O)CO2,0.299
Cc1c(nc(=O)[nH]n1)F,0.18
Cc1c(n(c(=O)[nH]1)C)O,0.2273
CC12OC1CCC1OC21,0.3321
CCC1(CO1)C(=O)C=O,0.1583
c1c(c[nH]c1O)C2CC2,0.2421
CC1(C)OCC(=O)C1O,0.2197
CCNc1c(cco1)O,0.2097
CC1C2NC2C=CC1O,0.239
Cn1cnc2c1CCN2,0.2065
OC1CCC2(CCC2)C1,0.3172
CCCC(C=O)C#C,0.2203
OC1(C[NH2+]C1)C([O-])=O,0.279
OC12COC3CCC1C23,0.3078
CN=C1ON=NC(C)=C1,0.1548
CC12COC(C1)OC2=N,0.2872
Cn1c(cc(n1)O)C=O,0.1687
COC(=O)C(O)CC#N,0.268
CC1CC2(C)NC2C1O,0.3047
OC1CC2=C(C1)C=NN2,0.249
C#CCNC=O,0.2752
CC1(C)NC11CCOC1,0.3111
OC12CC1C1C(C=O)C21,0.1887
CCC12OC(C=C1)C2=O,0.2437
C1CC23OC=NC2C3O1,0.2335
N=COC(C#C)C1CN1,0.2572
N=C1NC=NC(C=O)=N1,0.1474
CCC(CC)C(=O)C,0.2301
N=C1ON=NOC1=N,0.2229
C(C(=O)C#N)C(F)(F)F,0.2122
CCc1c(c([nH]n1)C)N,0.2397
OC1CC1C1CN1C=O,0.2525
O=C1CCC=C1C1CN1,0.1809
CC1=CCC(=O)C1CO,0.2162
COC(CC#N)C#CC,0.2872
NC1=CC(=N)N(C1)C=O,0.2075
CC12CCC1(C)C(=O)C2,0.2171
C#CC#CC(=O)N1CC1,0.1885
O=C1CCCC2CN2C1,0.214
CNc1cc[nH]c1OC,0.2191
c1c[nH]c(c1C(=O)N)O,0.2009
CC(=O)C12CCC1(C)O2,0.2212
CC1OCC11C2CCN12,0.3086
O=C1CCC2C3CN1C23,0.2398
CC12CC3C1CC2C3=O,0.2278
COc1ccn(c1)C=O,0.1739
C#Cc1cc(n[nH]1)C#C,0.2048
CC1OC1(C)CCO,0.3362
CC(CC1CC1)C1CO1,0.3533
CC1(C)C(C#C)C1C#C,0.2664
COC=Nc1ncon1,0.2215
CC1COCC11CN1C,0.311
CC1CC2C(CO)N12,0.296
CC12CC3(O)CC3C1O2,0.3213
COCc1cnoc1N,0.2233
Cc1[nH]nc(n1)CC=O,0.2223
CC12OC3C1C2NC3=O,0.2343
CC12N=COC11CC2C1,0.2564
CCN(C)c1c[nH]nc1,0.2116
CC1C2CC(C=O)=CC12,0.1882
OCC1C2OC3C2OC13,0.2997
OC1CC2CC(=O)CC12,0.2215
Cc1nn2cnnc2o1,0.2294
CN=COCC(O)C=O,0.22
OC1CN=CNC(=O)C1,0.2194
CC1CC=CC(O1)C#C,0.2631
COC1CC(O)C1C#C,0.2863
OCC1COCC(=N)O1,0.2712
CC(O)C1CC11COC1,0.3056
CNC(CO)(CO)C#N,0.2758
C1CC(O1)C1COC1,0.3198
CC(O)CC1=NNN=N1,0.2493
CCc1c(ocn1)N,0.2198
c1c[nH]c2c1NC(=O)C2,0.2001
CCC12OC3CC1C23O,0.2949
Cc1nn(c(=O)o1)C=O,0.2243
C1CC=CC(=O)C=C1,0.179
CC12C3CN1C2(CO)C3,0.3245
N=C1C=NON=NC1=N,0.1475
CC#CCc1ccc[nH]1,0.2432
CN1C2C3OC2(C)C13C,0.2935
C1C2CC3(CCOC3)N12,0.3162
Cc1cnc(cn1)OC,0.1925
CC1C=CC2(CC2)C1O,0.2465
OC(COCC=O)C#C,0.2235
CC(OC=O)C1NC1C,0.2716
CC#CC(CO)C#N,0.2823
CC12OCCC1CC2=O,0.1967
OC(CC#CC#N)C#C,0.2379
c1c(nn[nH]1)CNC=O,0.2505
CC12CCC1CCC=C2,0.266
C1C=CC(=O)C(=O)C=C1,0.1534
N=C1OC23CCC12OC3,0.2657
c1c(c(c(nn1)N)F)F,0.199
O=COC1C2C3OC1C23,0.2758
CCCN1C2CC(=O)C12,0.208
CC12OC1C=CC2C=O,0.209
C1C2CC34CC(C3)C4N12,0.3127
C#CC1=CC(=O)CCN1,0.1644
CC12COC3C1CC23O,0.3019
CC(OCC#C)C(C)=O,0.2287
O=C1C=CCC1CC#N,0.1918
CC12CC1CC(O2)C#C,0.2683
CC12CC1(C)C1(O)CC21,0.3124
CC1CCC2(NC12)C#N,0.2758
CCC(=O)C(=N)NCC,0.1716
CC(C)C(=O)N1CCC1,0.2638
C1OC1C1CCC1,0.3485
C1Cc2nc(nn2C1)O,0.2441
CC#CC(CO)C(C)O,0.292
N#CC#CC#CC1CO1,0.1832
OC1CN=COC1C=O,0.2196
Cc1cc(c(o1)OC)O,0.2156
CC1C2C3OC2C13CO,0.2922
CC1CN2CC1(O)C2,0.2894
C#Cc1cc(oc1)C=O,0.1776
C1OCC11OC2CC1C2,0.319
CC1=CCN(C1)CC#N,0.2398
CN1C2CN3C2C3C1=O,0.2446
CCC1(C)CCOCO1,0.3339
c1c(nco1)CC=O,0.217
c1c[nH]c(c1CO)O,0.2341
CC(CC#C)OC=O,0.2828
CC#CC(=O)OCC=O,0.2139
C1C2CC3OC3C3C2N13,0.2962
CC1C2N1C(=N)C2(C)O,0.2459
CCC#CC1NCC1=O,0.2074
OC(CC1CO1)C1CC1,0.3249
COc1cc(cnc1)N,0.1985
CC(C)(O)C1OC1(C)C,0.338
OC1CN=C2NCC12O,0.2361
CC1(CCC1)CCC#N,0.3357
Cc1c(cncc1F)F,0.2233
CC1C2CC(C=O)C12O,0.2157
OCCC1C=CCC1O,0.2633
CCC12COCC1(C)N2,0.2989
C1NC11C2OC3CC2C13,0.3084
COC(=O)C(=N)N1CC1,0.2062
COC1CN2CC12C#N,0.2586
CCC(CC)(C#CC)O,0.2916
CC12NC(C=C1)C21CO1,0.2357
CC12CC3C(CC1)C23,0.3388
CC1CNCC(=O)CN1,0.1967
CC1OC(C)C1(O)C#C,0.2729
CC1(CC2CC12O)C#N,0.3091
C(C#N)OCC(=O)C=O,0.1569
CCC(CCC=O)OC,0.2288
COC1(CC1O)C#CC,0.2643
CC1(O)CCC2COC12,0.3135
OC(CN1CC1)C#N,0.2617
CCC1C2C3CC2C13,0.3728
C1CC2CCCOC2C1,0.3278
Cn1cc(nc1CO)N,0.2034
COC1(CCC1)C#N,0.2931
c1cc(c(cc1F)F)O,0.2094
C#CCC1=CC2CC1O2,0.2305
OC1COC2CC12C=O,0.2213
CC(C)(C#N)NCC#C,0.2689
CCOC1CC2OC12C,0.3247
CC(=N)OC1=CNN=N1,0.2392
CCC1NC1CC#N,0.3008
CC(O)C1CC=CC1,0.2653
C1OC11CC2CC1CO2,0.3298
O=COC1CC11CCC1,0.2711
CCCC1CC(C1)(C)C,0.3565
COc1conc1CO,0.2275
CC#CCOC(=NC)C,0.2751
COC1OC2CCC1C2,0.3337
CC1C2NC(=O)C2N1C,0.2262
OC1CC1C#CCC=O,0.2131
COc1cccnc1,0.2105
c1c(c(ncn1)C=O)N,0.1498
CC1C(C)C1OC=O,0.2744
CC12CC3N(C1)C23C#C,0.2546
CC1(C)CC2CC(C1)O2,0.3151
CC1OC2(C)C(O)C12O,0.2963
CC1C2CC1(O2)C1CO1,0.3026
OCCC12C3C4C3N1C24,0.278
CC(C=O)C1=CNC=C1,0.201
CC12COC1C2CCO,0.3025
CC1N(C)C2COC12C,0.2859
CC1OC2C(C)C(O)C12,0.2958
O=COCC1CC2NC12,0.256
CNc1c(n(cn1)C)O,0.2374
OC1CC(C1)OCC=O,0.2144
CC(C)C12CC(C1)C=C2,0.2385
O1N=NC2=CN=CC2=N1,0.1414
NC(=O)N1CC2CC1C2,0.2858
C#CCCC1(COC1)O,0.3058
CC1CCC2(CO2)C1=O,0.2042
O=C1CC2COC(C2)O1,0.2697
CC1CCCC1(C)C=O,0.2293
C#CCc1ccco1,0.2357
Cn1nc(c(n1)N)CO,0.2126
NC1=NC(COC1)C=O,0.2111
CCCCC1(C)CN1C,0.2984
CC(C)C(NC=O)C#C,0.2724
NC1(CC1CC#C)C#N,0.2861
CC12C3C4CC(C)(C14)N23,0.3075
C1C=CCC(=O)C=C1,0.1823
C#CCc1cc(n[nH]1)N,0.233
CC1C2CCC3(CC3)C12,0.3206
C(c1c(onn1)C#N)N,0.1841
CC12CC3C=CC1(O)C23,0.2316
CCN1C(C)C1C1CN1,0.2915
CC(CC#N)OC1CC1,0.2939
OCC1COCC11CC1,0.3197
OC1C2CCC1(O2)C#C,0.2646
Cn1ccc(c1)N(C)C,0.218
Cc1c(onn1)CO,0.2237
O=C1C=CN2CCN=C12,0.1407
C1C(CC1=O)CCCO,0.2228
CC1OC11C2CC1(O)C2,0.3241
CCN=C1C2(CC2)CO1,0.2699
CC12OC1C1OC21,0.2936
CC1CC=CC(C1)C=O,0.21
OC1C(O)C11NCC1O,0.2805
COCC(N)C#CC#N,0.228
CC(=O)OCC1COC1,0.2636
CCC(=O)NCC=O,0.2193
CC12C3C(O)C1(O)CN23,0.2868
CN1CC(=O)C1C(N)=O,0.1918
CC(=O)C1OC1C(N)=O,0.2178
Cc1c(ocn1)CC=O,0.2008
C1C2(COC2)C(=O)N1,0.2706
N#CC1C2CC2C2NC12,0.297
O=CC1COC2CC2O1,0.2037
c1cc(c(nc1)N)O,0.1944
CC1N(C=O)C1(C)C#C,0.2522
O=C1CC2(CNC12)C#N,0.2018
C1CC1C1CC2CC12,0.3394
CC#CC(O)(CO)C#C,0.2631
C1CC23COC12CO3,0.2776
C1CNC(=CC1=O)C#N,0.165
CC1CNC(CN1)C#N,0.2416
CCC1=CCCC11CN1,0.235
CCC1CC(C1)N1CC1,0.31
CCN=C1CNC(=O)O1,0.2648
C1C2N=C3OC4C1C2C34,0.189
C1CC(C1)OCCC#N,0.2978
OCC1C2CN1C2C=O,0.209
OCC12CN1CCC2,0.3052
NC1=CC(=N)OC=N1,0.1717
C(OC1COC1)C1CO1,0.315
CC(C)(C)CC(=O)C#N,0.2061
CCCCC1(O)CC1O,0.3178
C1C2C3CCOCC3N12,0.3067
c1ccc(cc1)CCO,0.242
COC(=O)C1OC1(C)C,0.2631
C1C=CC(N1)(C#N)C#N,0.2366
CCOCC(C)N1CC1,0.3136
CNc1ncc(nn1)O,0.1536
CC12C3C4C(C4C1O)C23,0.2964
OCC1COC1C=O,0.2118
CCCC1C2CCCC12,0.3338
CC([NH3+])C1NC1C([O-])=O,0.2583
C#CC1C2OC3C2OC13,0.2823
C1COC(O1)C(F)(F)F,0.3569
COC(=O)C(=O)C#C,0.1704
C1CC(C1)C2COC2,0.3228
Cc1cc([nH]c1)OC=O,0.2043
CNC1(C#N)C(N)C1O,0.2554
CC1(CC1)C12CCC1N2,0.3196
N=C1NC(=O)NC1C#C,0.2584
c1c(nc(=O)oc1N)N,0.2057
CC1CCN1CCC#N,0.2613
C(C#CC(CO)CO)O,0.276
CC1N(C)C1(C)C(C)=O,0.2122
C(CC=O)CO,0.2303
COC(CC#N)C(N)=O,0.2605
O=C1NC=C(N1)C1CO1,0.215
NC(=O)NC1CC(O)C1,0.2986
CCC(C)C(CO)=NO,0.2535
C1C=Cc2c(non2)O1,0.1899
CC1OCC1C(N)C#N,0.2719
CCC1CNCC(=N)O1,0.249
CN=COC1CC1(C)O,0.2657
CC(C1COC1)C(N)=O,0.2707
O=C1NCC11COCO1,0.2605
CC1CC2(C)CC1CO2,0.3126
CN1CC1C(=O)N1CC1,0.2215
OC12CCC1(CC2)C#C,0.2831
N#CC1CCOCCO1,0.2839
CC(=O)C12CN(C1)C2,0.1975
CN1CC(O)(C=O)C1=O,0.2095
c1c(c([nH]c1N)C#N)N,0.189
COCC1CC(C1)C#C,0.303
CCNC(=O)OC(C)=N,0.2699
C1NC23C1NC1C2OC31,0.272
CN(C)c1c(nno1)O,0.1802
CC(=O)C1(C)CN1C=O,0.2154
NC1=C2C3CC3N2N=C1,0.198
Cc1c(non1)OC,0.2335
COC1C2OC=NC12,0.2531
C1CC23CCC12CC=C3,0.2576
COCC(C=O)C#C,0.2219
N=C(OCCC=O)C=O,0.1806
OCC(=O)C1OC1C#N,0.2206
CC(=O)OC1COC1=O,0.2702
CCN1C2CCC(=O)C12,0.2055
CC(OCC=O)C#N,0.2288
COc1ccnc(=O)o1,0.1827
COC1C(=O)C=CC1=O,0.141
C(CNC=O)C#N,0.2785
CC(O)C1NC1CCO,0.3168
CC1CC(C)C(C)=C1C,0.253
O=C1CC(CC#N)N1,0.28
C(=O)c1c(non1)C=O,0.1822
CCC1(CC2NC12)C=O,0.2135
O=CC12CC3C1C2C3=O,0.2066
CC(=NO)C1CCC1=O,0.2052
CC(O)C#CC#CCO,0.2196
CCCC(C)C1CC1C,0.3472
OCC12CC1(O)CCC2,0.324
CCC1OCCC1=O,0.2169
CC(CC#N)C(C)(C)C,0.3455
COC1CC2(O)COC12,0.2963
COC12CC(C=C1)C2=O,0.2268
[O-]C(=O)C[NH2+]CCC#C,0.2698
OCC1C2C=CC(=O)N12,0.1951
CC(O)C1=C(O)N=NN1,0.2242
C1NC1C1OCC2OC12,0.3281
CCC12C3CC1(C)CN23,0.3089
CCC12CN3C(C13)C2=O,0.2251
OC1=CN=CC(=N)O1,0.1593
CC(O)CC1CC(C)C1,0.3275
OC1C2CC(O2)C1O,0.3166
CC(O)C1(CC#C)CO1,0.3049
CC1C2C1(C)OC2(C)C,0.3139
ON=C1CC2CCC1O2,0.2539
CCN=c1ocno1,0.2315
CC(=O)N1CCNC1=N,0.2436
OCC1N=CNC1C#N,0.241
COC1C2COC1CO2,0.3162
CC1CC2(CC2)OC=N1,0.2665
CC1NC(C)(C)C1=O,0.216
Cc1cnoc1C=O,0.19
CC(C=O)C1CC(=O)C1,0.2162
CC(C=O)C1CC2OC12,0.2261
C1CC2(O1)C1CC2C1,0.3337
C(CC=O)CC(=O)N,0.2267
N=C1OCC11C2CCN12,0.2557
O=CC1=CNCC1C#N,0.1846
N=C1NC2COC12C#C,0.2341
COC(=O)n1cncn1,0.2391
COc1c(cncn1)N,0.1979
C#CCNC(C=O)C=O,0.19
CC(C)C(C)(C(C)C)O,0.3224
CC12NC1CC2(O)C#N,0.2746
CC1=CC2(C)OC2CC1,0.2386
C1CC1C#CCC#N,0.2719
OC1(C#C)C2COC12,0.2533
OC1CNC(=O)C=C1,0.2045
C#CC12CC(C#N)C1O2,0.2605
COC1C2OC2CC1C,0.3167
c1c(nc(=O)on1)C=O,0.1382
CCCC1CC2OC12C,0.3302
O=CNCC1(CN1)C#N,0.2661
CCOC(C)(CO)C#C,0.2933
C1OC23CC(C=CC2)C13,0.2372
COCC1COCC1O,0.3082
COc1c(ocn1)C=O,0.1827
c1c(nc(o1)CO)O,0.2227
CC(OC(=O)C=O)C#N,0.1811
CC(=O)C1(CC#N)CN1,0.2328
N#CCC1C2C3CC2C13,0.3378
CC12CCCCCC1O2,0.331
ON=C1C=CNC1C#C,0.1763
Cc1cnn(c1)CC#C,0.2514
C1C2CCC3C=CCC123,0.2638
CC12CCC1(O2)C=O,0.2177
CC(C#N)N1C(C)C1C,0.2711
Cc1cc(=O)oc(n1)O,0.1972
CC1(C)CC(=NO)C1O,0.2459
CC1(C=C(CO1)CO)C,0.2511
N#CC12CC3C(C=C1)C23,0.2379
CCCC(C)CN1CC1,0.3168
CC12C3OC4C(C13)C24O,0.2884
CN1CC2OCC(=O)C12,0.1923
c1cc(oc(=O)c1O)F,0.1675
CCCC(=N)OC=O,0.2618
CC1C2OC1C1(C)CC21,0.3332
C(#N)c1nc(=O)[nH]nn1,0.151
CC1OCC1CCC=O,0.2243
c1c(cn[nH]1)OCC#N,0.2334
C1C2CCOC1C1OC21,0.3229
O=CC12COC1C1CC21,0.2212
CCC(=O)C(=NC)N,0.1914
N#CC12CC1COC2,0.2996
C1NC11CCC11CO1,0.3005
CC1OC2CN3C2C13C,0.3106
COCC(=N)OC,0.2759
CC1CC2NC2(C)C1=O,0.2119
OCCC1(O)CC2OC12,0.3004
CC1CC(O)C1OC=N,0.2701
C(=O)C#CC(F)(F)F,0.199
CCC12CC1OC2C#C,0.2548
CC12CCC(C1)NC2=O,0.2657
CC12OC1C1COC2O1,0.3207
CC12OCC1C=CC2=O,0.1763
OCC12CC(CO)(C1)O2,0.3158
O=CC(CC1CO1)C#C,0.2195
C1C23COCOC12CO3,0.2905
NC1=C(OC=C1)C1CO1,0.2051
CN1C2CC2(O)C1=O,0.2319
CC12CC(C)(O1)C2O,0.3328
COC1CC2NC(=O)C12,0.2695
CC12CC3CC(=O)C1C23,0.2216
CC1C(C=O)C1C(C)=O,0.2001
CC1C2C3NC(=O)C1C23,0.2557
CCC(O)C1=COC=N1,0.2447
CC(C)OC(=O)CC=O,0.2265
Cc1c(n[nH]n1)CC#C,0.2524
Cc1nc(co1)C#C,0.2147
CC(O)C1(O)C2CC1C2,0.3118
COCCC1CCC1C,0.332
C1C=CC=CNC1=O,0.1898
CC1C2C(CO)C(C)N12,0.2867
CC1(NCC2OC12)C=O,0.1977
C(c1[nH]nc(n1)O)O,0.2469
c1c[nH]c(c1O)C=O,0.1817
OC1CC2CCC2C1=O,0.2205
CN(C=N)C(=N)C=O,0.1545
OC1CC2OC(=O)NC12,0.3052
CCn1ccc(n1)CO,0.2558
CC1(CO)CCCC=C1,0.2671
CC(O)C1CC2OC2C1,0.3288
CC1OC2C1N(C)C2=O,0.2515
CCC(C)[NH2+]CC([O-])=O,0.2667
OCCC12NC1CC2=O,0.2199
CC1=CC(C)=NC(=N)O1,0.1724
CC1CC2=C(NC=C2)N1,0.2259
N=CN1C(=N)C=CC1=O,0.1634
CC1NC1C1=NC=NN1,0.2574
CC#CCN1CC1CO,0.2672
C1C2C3C2C2OC1OC32,0.3313
N#CCC12NC3C1NC23,0.2682
Cc1conc1CC#C,0.2463
c1nc(c2n1C=CC2)O,0.1803
N=C1OC=NC=CC1=N,0.1737
CN(C)C(C=O)C(C)=O,0.1736
Cn1c(=O)cccn1,0.1736
C#CCC1C2C3C1CN23,0.2904
CC(C)C(=O)COC=O,0.2275
CC#CCCC1(C)CO1,0.3029
CC(=O)C(O)C1CCC1,0.2348
CC1CC2OCC(O)C12,0.3006
OC(CC#CC=O)C#C,0.2048
CC#CC1(O)C2CCC12,0.2673
Cc1c(noc1C)C,0.2422
O=C1CN2CC1C2C#C,0.2031
OCC1CCC2CC1C2,0.3364
OC12CC=CC11CC2O1,0.2192
c1ccc(cc1)C2CC2,0.2274
CC1C2C(C)NC(=O)N12,0.2816
C1COC(OC1)CCO,0.3409
CC(=O)C#CC1COC1,0.2068
CCC1OCC2NC12C,0.3056
C1CC12C3(COC3)CO2,0.2923
COC1(C)CC(O)CO1,0.3298
CCCCn1nnnn1,0.2732
CN1CC1CC(C)(C)C,0.2922
CN1C2C3OC3C12CO,0.2618
CCC1(OC1C)C=O,0.2188
CC1OC(C=O)C2CC12,0.2249
C#CCn1cn[nH]c1=O,0.2386
COC(C)COC(N)=O,0.3133
C1CC1(C=O)C2COC2,0.2231
CC1C2OCCC12C#C,0.282
COC1C2OC1C2(C)C,0.3189
CN1CC1(CO)C1CN1,0.2907
CC1(C#C)C2COCC12,0.2941
O=C(C#N)C1CC(=O)O1,0.1954
CC1OC(=N)C1C#N,0.2838
c1cn[nH]c1NC2CC2,0.2407
CN1CC1C1CCC1O,0.2955
CC1C2NC2(C)C1C#C,0.2764
CN1C(=O)C2CN2C1=O,0.2364
CNC(=O)N1CC1C,0.2914
CCC1CC2OCC2=C1,0.2423
OC(C#C)C1OC1C#N,0.2727
CN(C=O)c1ncno1,0.2245
CCN=C1CN=C(N1)C,0.2242
CC(O)C1C2NC2C1C,0.3029
CC1=CCc2c1[nH]cc2,0.183
CC12CC=CC1(CO)N2,0.2356
CC12C3CC1C(=NO)C23,0.2506
COCC1C(C)CC1O,0.3208
CC(=O)CCOC=N,0.235
OC1C2C3CCC1(O)C23,0.3152
CC(C)(O)C1CC1C#C,0.2884
CC12OCC1C21COC1,0.3035
CC1OC2(CC2O)C=C1,0.2238
CC1CCC2=C1C=NO2,0.233
NC(CNCC#C)C#N,0.2727
CC1(CCC1=O)N1CC1,0.2153
C#CC12CC3C(C1)C3C2,0.3134
O=C1CNCC(N1)C#C,0.2584
OC1CC=CCC11CN1,0.2605
CC1(CN(C(=O)N1)C)C,0.2922
OCCC1N2CC1(O)C2,0.311
N=C1C=CCN1C=O,0.1997
CN1CC(NC1=O)C#C,0.2657
CC1C2CC1(OC2)C#C,0.2678
C#CC12CC1C(N2)C#N,0.2485
O=C1CCCC2(CN2)C1,0.2201
CC12COC1C2CO,0.3009
C1C2OCC3CCCC123,0.3103
CCC(C)CC(C)(C)O,0.3191
OCCCC(O)C#N,0.2865
OCC(O)CC1CN1,0.2989
CN1C(C#C)C11COC1,0.2584
CC1COC2=CNC=C12,0.2298
OCC1=CC(=O)NC1=N,0.189
CC(CO)NC(=N)C#N,0.2089
CC12CC(O)(C1)C(=O)O2,0.279
c1cc(cc(c1)N)C=O,0.1606
CCC12CC(=O)C1O2,0.2164
C(CC(=O)NC=N)C#N,0.2291
CC(O)C12CN(C1)C2,0.2841
OCC(C=O)C1CN1,0.2132
CC1C2C3CN4C3C1C24,0.3004
CC12CC1(CC#C)CO2,0.2778
CC1C(O)C1C(N)=O,0.2488
CCCOCC(O)CO,0.3324
C#Cc1c(nno1)CO,0.1961
CCc1ncncn1,0.2187
CC(C)C12CC1(O)CO2,0.2983
CC(O)C(=O)C1CO1,0.2219
C1CC11C2OC2C11CO1,0.323
CC12C3C4N3C1(C)C24O,0.2632
CCCCOC(=N)C#N,0.2422
CCCC(C#N)C(C)O,0.3239
COC12CC1C1OC21,0.2942
C1C2OC3C4CC3(C4)C12,0.3202
C#CC12CCC1C1CN21,0.2561
CC12C3OC(C)(C13)C2O,0.3128
c1cc(ncc1O)N,0.1798
CC1C(C#N)C1(C)O,0.2931
CCC12NC1CC2=O,0.2205
CC1(O)CCCC1O,0.3308
COCCCC1CO1,0.342
CC12C3CC1C(=O)C23,0.2431
CC1(CC#N)CN2CC12,0.2729
OC1CC(C=C1)C#N,0.2575
NCC(=O)OCC1CO1,0.2595
CCC1(CO)CN2CC12,0.2945
CC1C2C(C#C)C2C1=O,0.2215
CC1OC1C(=O)CC=O,0.205
CC1NC1(C#C)C1CO1,0.2814
C(=O)(C(=N)NC(=O)N)N,0.2033
C1C2CC34CC3(CO4)C12,0.2784
Cc1cc(on1)C,0.2483
c1cc(oc(=O)c1)C#N,0.1617
CC12OC(=N)C1C2C#C,0.2567
OC1C2CCC1C(=O)O2,0.2754
CC12CC1(O)CCOC2,0.3207
O=CC1C2CCN2C1=O,0.2065
CCC12CN3C4C3C1C24,0.2966
OC12C3NC1C3OC2=O,0.2577
CC1(CC1)CCC#C,0.313
C#CC(=O)c1cn[nH]n1,0.1958
C1CC1(CC#N)OC=O,0.2752
CN1C2CN(C)C(=O)C12,0.2504
CC(O)C1CN1C(C)=O,0.2501
C#Cc1ncc(nn1)F,0.1675
CC(=O)C1(C)CO1,0.2232
CCn1nc(c(n1)O)N,0.2076
C#CC1OC2CC2C=C1,0.243
CCC(O)C1CN1,0.317
C1OC2COCOCC12,0.3143
CC(C(O)C#C)C1CO1,0.3015
N=C1NC(=O)NC(=O)N1,0.2607
N#CC1OC1C1CCC1,0.2908
CCC(=O)NCC#CC,0.2696
OCC1C2CC1N1CC21,0.2965
OC1C2OC3CCC3C12,0.3097
C(CC#CC#N)C=O,0.2196
CCCOCC1CCO1,0.3216
OC12COC(CC1=O)C2,0.2261
CC12OC1C1CC2(C)C1,0.3255
Cn1c2cn[nH]c2nn1,0.2115
CCn1c(ncn1)N,0.2499
CNc1c(nno1)CO,0.2027
CCC1=C(CCOC1)C,0.2523
C1C2OC11CCN3C2C13,0.2274
CCc1cc(=O)nco1,0.2068
CC12CC(C)(C1)N=CO2,0.2667
CC1C2(C)CC1(O)C2O,0.3163
CC12NC1CC2(O)C#C,0.2573
C1OC2CCCCC=C12,0.2501
CC1=CC(=N)OC=C1,0.1702
CC1OCC2OC2C1=O,0.2024
CC1NC(C2CC2)C1=O,0.2149
CC12CCC1C=CC2O,0.2514
O=CC#CC1OCC=C1,0.1961
CCC(=O)C1CC1OC,0.2334
Cn1cc(cnc1=O)N,0.1505
O=C1C2CN2CC1C#N,0.213
CCC1(CCCCC1)C,0.3578
OC1(C2CN2)C2CC1O2,0.2785
C(C=O)c1[nH]c(=O)[nH]n1,0.1971
Cc1c(onn1)C(=O)N,0.2063
CC1=NC=C(F)OC1=N,0.1667
CCOCC(C=O)C=O,0.2068
c1c(c(c[nH]c1=O)O)N,0.1762
CC(C)(C=O)OCC#C,0.2261
CC12CC1OCOC2,0.336
CC1=CC2C3C(O)C2C13,0.2221
OCC(CC=O)C#N,0.226
OC12CC(=O)C1CCC2,0.2145
CC1=CC2(CCC2)CC1,0.2546
OCC1C2C3OC2C13O,0.2822
CCC1(C)CC2C1N2C,0.3018
CC1=CC2CCC1CC2,0.2605
CC1(COC1CO)C#C,0.2908
CCC(CC)C(=O)CO,0.2376
CN1C=NCC(O)C1=O,0.2235
C1CC2N=COC3C1C23,0.2736
O=CC1OC(=O)C2NC12,0.2143
NC1=NOC(=N)NC1=O,0.1773
O=CC12NC3C(C13)C2=O,0.1907
CC1(C)CCC1CC#C,0.3114
CC12CC1OC1CC2C1,0.3166
CN=C1OCC(O)C1C,0.2725
CCc1nc(on1)OC,0.2596
c1c(coc1N)CCO,0.2237
CCn1ccc(c1)C,0.2456
O=CC12C3CC1OCC23,0.2241
N=C1OC2C(C#N)C12,0.2673
CC1OCOC2(C)CC12,0.3283
C1CCC=C(CC1)C#N,0.2166
c1cnnc(n1)CO,0.1656
CC1CC(C)(C1)OC=O,0.2764
CC1N2CC2CC11CO1,0.3112
CN1C2C(O)C2(N)C1=O,0.2256
N=COC1C2C3CC1N23,0.2794
CN1C(=N)N2CC2C1=O,0.2359
N=C1OCC(=O)CC=C1,0.1928
CC1OC1CC#CC#N,0.2394
CC12OC1COC2C#N,0.2904
CC(C)c1c[nH]nn1,0.2519
CCOCC1CC1,0.3402
COC1C2OC2(C)C1C,0.3158
CC(O)C1CCC(C)C1,0.3374
OC1C2C1N1CC(O)C21,0.2671
C#Cc1conn1,0.2069
C#Cc1c(nc[nH]1)C=O,0.1818
CC12CC(CC=CC1)O2,0.2661
CCCC12C3CC1CC23,0.3231
C(C#N)n1nc(nn1)N,0.2107
O=C1CC2CC2CN1,0.2666
CC1CC2(O)CC1C2O,0.3152
C#CCCC#CCC=O,0.22
c1cncc(=O)cc1O,0.1473
CC1=CCC2(C)COC12,0.2554
Cc1c(c(c([nH]1)N)O)O,0.2152
NCC(OCC#N)C#N,0.2446
COCC1(CO1)C1CC1,0.3385
NC(=O)C1OCCC1=O,0.2011
COC1CC2(O)CC12O,0.2969
CC1C2C1C1=CCOC21,0.2307
OC1C2OC3C2C=CC13,0.2287
Cc1nnc(n1C=O)C,0.2037
O=C1C2COC(=O)C1O2,0.2113
O=CCC1CNC1=O,0.2239
CC(C)(C)C(=N)NC=O,0.2286
CC1(CNC(=O)NC1)C,0.2888
c1c(=O)c(non1)C#N,0.1675
O=C1CC2OCC=C2N1,0.226
CCC1C(C)OC1C#C,0.2761
CCCC(C)CC(C)C,0.3704
C#CCC1C2CC1CC2,0.3156
CC(=O)CCCC#N,0.2352
N=C1NC=NC=CC1=O,0.1677
CCC(NC)C(=O)C#N,0.1487
CC12CC1OC(C2)C#N,0.2803
CC1OCC1C#CC#C,0.225
C#CC1(C#C)C2CC1O2,0.2632
c1c[nH]cc1C(=O)C=O,0.1509
CCC1(C)C2CC1CC2,0.3552
CC1N(C)C(=O)CC1=O,0.2073
O=CC1OCC=CCO1,0.2245
N=C1N=CC=CNC1=O,0.1769
C1CC(C1)CCCC=O,0.2286
C#CC1CC11CN=CO1,0.2538
C1COc2c1c(on2)N,0.2362
CC1C2C3CC(N12)C3=O,0.2218
CC1(C#C)C2OC1C2O,0.2728
CC(O)CC(C)C=O,0.2283
OCC(O)C1COC1=N,0.2723
CN1CC(C#N)C1=O,0.2728
OCCCC1CCC=C1,0.263
OC1=NNC(=N1)C1CN1,0.2322
CC1C2CC1(C2)OC=N,0.2775
O=C1COCCC2NC12,0.2026
CC12C3OC3C1OC2=O,0.2685
CC1C=CC2(OC12)C=O,0.2179
OC1C2OC1C2C1CN1,0.307
CCC1(CCC1=O)C#C,0.2078
CC1CC1NC=O,0.2736
CCC1CCC1N1CC1,0.3085
CC1(CN1)C(O)C(N)=O,0.2621
CN1C(=O)C=CC12CC2,0.1977
c1coc(=O)c(c1N)F,0.1786
C1CC2(C1)CCC1OC21,0.3425
CCCC(C)NCC#N,0.2671
CN(C=O)c1cnno1,0.2041
CCOCC(OC)C#C,0.2898
CC(C)C1(CC1)O,0.302
CCCC#CC=O,0.2054
CC1(CCO)CCCO1,0.3182
O=C1CC=C2NC=NC12,0.2017
OC1C=CCCC1C=O,0.232
CCC12CC(O)(C1)C2O,0.3304
CC12CC1C(=O)C1CC21,0.2138
OC1CC1CC1CC1,0.3325
CCC12OC1COC2=N,0.2685
OC12CN3CC1(C#N)C23,0.255
CCC12CC1C(O)C2,0.322
CC(C)c1cc(oc1)N,0.2249
CC(C)C(=O)NC(=N)N,0.2276
CC1CC2C1CC=C2C,0.2572
O=CC1CC(CN1)C#N,0.2005
O=C1CC2C3CCC1N23,0.2107
N=C1OCCOC1C=O,0.2277
N=COC1=CNC(=O)N1,0.1989
CC1CC2(CN12)C1CN1,0.2955
CC(C)(CCO)CC=O,0.2215
CC12NC(C3NC13)C2=O,0.2353
c1nc2n(n1)CCCN2,0.2434
CC1N(C)C(=O)C11CN1,0.262
COC(CO)(CO)C=O,0.201
C1NC1C1CCCO1,0.3129
CC1=NC2CC2CCO1,0.2503
CC1CC23CC12OC=N3,0.2323
CCC1C([NH3+])C1C([O-])=O,0.2721
CCC(C)CC(=O)C#C,0.2071
c1cn[nH]n1,0.2687
OC12CC1(CC=C2)C=O,0.2001
CN1C2COC2CC1=O,0.2724
C1CC2(CC3NC23)O1,0.3
CC1=C2C3OC3C2CC1,0.234
CC(=O)C1(CC1)C#C,0.2285
OC1CC2OCC12C#N,0.2787
O=C1C2CC3N1C23C#C,0.2456
O=C1CN(CC2CN2)C1,0.2092
CC1(CN1)C1C(O)C1O,0.2965
OC(C#C)C1=CC=NO1,0.2373
CC1COCC2CCC12,0.3162
c1c(nc[nH]1)OC(=O)N,0.2415
CC12C3N1CC2C3=NO,0.2418
CCC1(CC1)C1CCO1,0.3257
O1C=NC2C3C=CC1C23,0.2219
O=CC1COC(O1)C#C,0.222
NC(=O)C1(CCO1)C=O,0.2078
CC1(C)OC2CC1C=C2,0.2428
CCC(O)COCCO,0.3023
OC12COC1C(=O)C2,0.2001
OCC(C#N)C1CC1O,0.3074
OC1C(O)C11C2CN1C2,0.2718
CC1CC1(CO)CC#N,0.2868
Cc1cc(ccc1F)N,0.1974
c1c2c(on1)N=COC2,0.1856
OC1CC11NC(=O)C=C1,0.2016
OCC1=CC2CCC1C2,0.2527
NC1=NC(O)=COC1=N,0.1495
COC1C2C3NC3(C)C12,0.3293
Cn1c2c(cn1)[nH]cn2,0.2169
CC1CC2C3OC2C13,0.3008
CCC(=O)CCC1CO1,0.2352
CCOC1OCCC1O,0.3421
O=CC#CC1NC1C#C,0.1975
CC1N=COC1OC=N,0.2755
CC1(CO1)C1(CO)CC1,0.3261
O=C1NC2CN3C2CC13,0.2349
CC12OC3C1C2N=C3N,0.2252
C1CC23NC2CN=C3N1,0.2484
CC1=CC(=N)C(F)=NN1,0.1788
C#CCC12OC3C1NC23,0.2863
COC1OCC=C1C=O,0.1912
CC12CC3CC=CC1C23,0.2448
OC1CCC23CCC12O3,0.3104
CC1=CC2CC(C2)C1,0.2477
C#CC12CCC1(O2)C#C,0.2325
OCCC1CC(=O)O1,0.2827
COC(=O)C(N)CC#N,0.243
C#Cc1nc(on1)CN,0.2081
CC1C(=O)C2CC2C1=O,0.2084
OC1C(OCC1=O)C=O,0.2067
OC12COC3C(OC1)C23,0.2763
CCN1C2CC(C)(O)C12,0.2937
CC12CC(O)C1(O)CO2,0.2946
CC1C=C(C#C)C2NC12,0.2021
CC1C2N1CCOC2=O,0.2366
CC1CC2C1CC21CO1,0.3267
OC12CC(=O)N3CC1C23,0.2291
OC1CC2C3CC12C=C3,0.2261
OC1CC2(CC3CC23)C1,0.3207
N#CCNCC1CCO1,0.2701
CCC1C2C(O)CN12,0.2879
c1[nH]c2c(n1)CCO2,0.2275
C1OC23CC4N5C2C5C134,0.2723
Cc1[nH]c(cn1)OC,0.2386
c1c2n(cn1)C(=O)CC2,0.1971
O=CN1CC2CC1C2=O,0.204
CNC1CC1(CO)C#N,0.2488
CCNc1c(onn1)N,0.2045
CCC12COC1C2CO,0.298
CC1(C)OCCC1CO,0.3111
C(C=O)C#CCOC=O,0.2235
NC(=O)NCC(O)C#C,0.2663
CC1CC(CO)C(=N)O1,0.2692
O=C1OC2COC2C1=O,0.1592
CN1CC1C1CC1C=O,0.2107
Cn1c(cnn1)CC#N,0.253
O=C1OC2C3CC12CC3,0.2669
O=CCC1NC11COC1,0.2193
O=CC1NC1C(=O)C=O,0.1423
CC1CC(O)C=C1CO,0.2549
CC1C(N)C(=O)OC1=N,0.2425
C1C2CN1C21CCOC1,0.3174
CC12C3CN(C13)C2C#C,0.2527
CC1OCC(=O)C11CC1,0.2194
CCCOCC1OC1C,0.3399
CC(=O)NCC1CCO1,0.2759
c1coc(=O)[nH]c1=O,0.2251
N#CC#CC12CC1OC2,0.2068
CCCC1CC11CCC1,0.3426
OC1C=CCC2(O)CC12,0.2673
COC(C)CC#CC,0.3003
CCC1N=COCC1=O,0.2027
O=COC1COC1C#N,0.2785
CCCOC=NCCO,0.2584
CC12C(O)C1N1CC21,0.2795
CN1C2C3C1C2C3=O,0.2247
CCC1C2CC(O)C12C,0.3152
CC1NC1CC(=O)C#N,0.1777
CC1=CC2OC2C1,0.2422
NC(=O)C12NC1CC=C2,0.2372
COCC(=O)C(=O)OC,0.1817
CCN(CC1CC1)C=O,0.2692
C1CC(C1)C(CO)CO,0.3202
CC(CC=O)CC1CC1,0.2276
N=C1OCC1C(=O)C#C,0.2014
c1cc(nnc1F)F,0.1875
OCC1=CC(=O)NN=N1,0.1801
CC1(CO1)C1(O)CC1O,0.2945
c1c2c(n[nH]1)COCO2,0.2317
CC1CC(=O)C2OC12,0.213
CC1(C)CC11CN=CO1,0.257
CCNC(=NCC)C=O,0.1538
CC1CN(CC#N)C1=O,0.2692
CC12CC3(CCC3O1)C2,0.3153
CC(CNC=O)C1CO1,0.2826
CC1C2C1C1CC2C1,0.3468
CC12CCN=C3OC1C23,0.202
C1OC1C1=NCCN1,0.2323
CC1CC=C2CCC12,0.2472
c1c[nH]cc1N2CCC2,0.2222
c1c[nH]c(=O)cc1O,0.1883
OC12CC1OCC2,0.302
CC#Cc1cc[nH]c1O,0.2157
OC12CC1(C=CC2)C#C,0.2314
CC1OC2CC2CC=C1,0.2547
C1CC23C=CC4C(C24)N13,0.2115
CC1C2CC(C)C1C2=O,0.2294
C1CC2CCC3OC1C23,0.3188
CCOC(=O)C1CCN1,0.2383
CC(O)COC(=O)C=O,0.1812
N#CC1(CN1)C1COC1,0.2617
C1CC1(CC2(CC2)O)O,0.2956
O=CC1CC1C1CCO1,0.2256
CNc1c(n(nn1)C)N,0.2262
CC1COC(=O)C1(C)O,0.2723
CC12CN1C(C#C)C2O,0.262
CC1COCOC1C#N,0.2882
NC1(C#N)C2COCC12,0.2749
CC(O)C1=CCC(C)C1,0.2571
CC1(COC(=N1)C=O)C,0.1916
CCCC1(C)CC1(C)O,0.3178
CC1=CC(CCO)CC1,0.2578
CN=C1CC(O1)C1CN1,0.2751
NC1=NC2CC2NC1=O,0.1919
OC1C2OC3C=CC2C13,0.2373
CN=C1NC(F)=CC=C1,0.1679
CC12OC3C1NC23C#N,0.2563
C1C2C3CCC=C1C23,0.2202
CC1(O)C2C3C2C1C3O,0.3114
C1OC2CC3NC3C2O1,0.2953
CCC(C(C)C)C(C)O,0.3249
c1cc(c(c(c1)F)O)O,0.2247
COCC1CC2NC12,0.3098
c1cn(cn1)CC#N,0.2383
c1c(oc(n1)N)CCO,0.2308
CCc1cc([nH]c1)C=O,0.1812
CC#CC1CC2NC12C,0.2785
CCOc1c(cc[nH]1)C,0.2439
NC1=NNC(=O)C(=N)O1,0.1777
Cc1ccoc(=O)c1N,0.162
CC1C2C3C2N1C3C#C,0.2709
C1NC23COC2CC=C13,0.2279
Cc1c(n[nH]n1)C(C)C,0.2504
CCC12C3CN4C(C13)C24,0.2952
CCOC(CC)C1CN1,0.321
O=C1OCC=C2COC12,0.2271
Cc1c(nc([nH]1)O)OC,0.2296
Cc1cn[nH]c1CC#C,0.2533
Cc1c(nco1)CC#C,0.2369
CCC1CC2=NC=NN12,0.2737
OCC12CC1CC2=O,0.2304
CCC1(O)CCC1CO,0.3211
CC1(OC1CC=O)C=O,0.211
CC1CC2CCC1C2=O,0.2225
OCC1(CCO1)C#C,0.2738
OC1COCC1CC#C,0.3011
O=C1CC2CC(=O)NC12,0.1998
O=CC12COC3C1CC23,0.2153
OC12CC1(OC2=O)C#C,0.2355
COC1C=CCC1=O,0.2145
Cc1nccn1CC=O,0.1761
CC1CC1C1CO1,0.35
c1c2c([nH]n1)COC2=O,0.248
CCC1C(C)C(=O)N1C,0.2757
NC(CCCC#N)C#N,0.2844
CCCCC1OCC=C1,0.248
CC1C2C(O)C1C2=NO,0.2654
C#CC1COC1C#C,0.2751
CC(O)C12CN3CC1C23,0.2915
CC1=CCCC(=O)CC1,0.2256
CC12C3N1C1C=C3CC21,0.1188
COC(CO)CC#CC,0.2917
CC1C(O)C2C=CCC12,0.2481
OC1=NC=C(F)C(=N)N1,0.1859
CC1C2OC2C=C1C=O,0.1833
N#CC1C2NCCOC12,0.262
CC1N2C3CC3(C)C12C,0.3035
CC1(O)C2CC3NC3C12,0.302
NCC(C#N)C#CC#N,0.213
C#CC1C2C3C4C3C2C14,0.288
OC12CN3C(CC1)C23,0.2862
Cn1c(c(c(n1)N)N)O,0.2477
CC1(CO1)C1OCC1=O,0.2234
CN1CC1(C)C#CC#N,0.2131
COCC1(CCO1)C#C,0.2681
CCC12CC(C=O)C1O2,0.2151
CC#CC(C)OC(C)=O,0.2673
CC(C)c1nccn1C,0.246
C(c1nc([nH]n1)N)O,0.2531
OC1CCC(=C1)C#N,0.2216
C1CC11C2CC1OC2,0.3297
c1c(coc(=O)n1)N,0.1519
C1CN(CCC=C1)C=O,0.244
C#Cc1cnoc1C#C,0.1801
CC(N1CC1)C1OC1,0.3206
N=C1NC2C3OC12C=C3,0.2022
CCN1CC(C#N)C1C,0.2603
CN1CC1(CCO)C=O,0.2141
CC1C2CC(C)OC12C,0.3091
CN=CN(CCO)C=O,0.2166
CC1OC=NCC1O,0.2668
O=C1CCOC1C1CN1,0.2114
CC1CC2OC3CC3C12,0.3034
OC1CC11CC(O)C=C1,0.2437
O=C1CC2OC2C1,0.2272
C1COc2c1[nH]nc2O,0.2208
C1C2CCCC22COC12,0.3002
C1C2OC3=NC=NN3C12,0.2571
C1NC11CN2C=CC=C12,0.2399
OC12C3OCC1C=CC23,0.2304
OC12CC(O)(C1)C2C#N,0.2951
Cc1cocn1,0.2468
CCCC([NH3+])CC([O-])=O,0.2772
CC(C)c1c[nH]c(n1)O,0.2533
C1N=COC2OC1C=C2,0.2365
CC1C2C(O)C(C)C12O,0.3061
OCC1C2CCN2C1=O,0.2349
C1c2c([nH]nn2)N=CO1,0.1929
CN1C2C(O)CC12CO,0.2964
CN=C1CNCC(=O)O1,0.2272
CC1CC11CC=CC1O,0.2626
CCC1COC(=O)C1O,0.2599
CC1(CO)OC(=N)C=C1,0.2082
CC#CC1CCC=C1C,0.2588
CC1COC(=O)O1,0.3319
OC(COCC#N)C=O,0.2321
COC1C2CC(C#N)C12,0.2848
CC1=CNC(=O)C2NC12,0.2037
Cc1c(nno1)CC#N,0.2298
CCC(O)(CO)CC=O,0.2153
CC1=NC(=N)N=C(C)O1,0.2196
COC(C#N)C#CCO,0.2681
OC1=NC=NC(=O)C=N1,0.1665
CC(C)OC1(C)CC1C,0.3193
CN=C1OCOC2CC12,0.2618
Cc1c(cnnc1F)F,0.1954
CN=C1OCCN2CC12,0.2473
CC1CCC(=O)C1C=O,0.2004
O=C1C=CC2CC2C=C1,0.1784
COC1C(C)C1(C)O,0.3123
C1CC1NC2(CC2)C#N,0.2567
CCC1(CC1)C#N,0.3207
CCC(CO)C1OC1C,0.3225
OCCC1CC(C1)C#C,0.3039
c1c2c(oc1N)CCO2,0.2065
CC12C3CC11COC2C31,0.3281
CC1CC1C1=CN=CO1,0.2281
c1c(ncc(n1)F)F,0.2015
OC1C2CN3CC2C13,0.2893
O=C1NC2C3COC1C23,0.246
C1C2CC3CCC(O3)C12,0.314
OCC#CC1(CN1)C=O,0.2194
CC12CCC3NC3C1N2,0.2915
CN(CCC=O)C(=O)N,0.2152
O=C1C(OC1C#C)C#C,0.2055
NC(=N)C(=N)OC=O,0.1862
CN1C2C3CC2(C#N)C13,0.2422
O=C1C2CNCC1O2,0.2147
COCCCC(=O)C=O,0.1573
CC1OC11COC1C#N,0.2735
CCC(=O)C(O)C(C)O,0.2378
OC1C2CC(C#N)C1N2,0.2869
O=C1CC=CC2(CN2)C1,0.2181
O=CC12CC(C1)C21CN1,0.2017
NCC1NC(=N)NC1=O,0.2325
C#CC12NC1CC21CO1,0.2542
c1c(noc1N)CC#N,0.2257
CC1OC2(CC12)C#N,0.2563
CC1CC(O)C(C)(C)C1,0.3276
Cc1c(cc[nH]1)CC=O,0.189
CC1(CCO)C2COC12,0.307
O=C(C#C)C12CC1CC2,0.1985
CC1CC(C)=C(C)CO1,0.2554
CC12CC1OCC21CO1,0.3096
C#CC(C#C)OCCO,0.265
CC1CC2OC(=N)C12O,0.2778
CC1OC(=N)NC1C#C,0.256
OC12CC1C1OCC1C2,0.3134
OCC1C(O)C1CC#C,0.3007
C1C2OC3=CC=NN3C12,0.2488
OC12CC(C=C1)C=C2,0.2185
CN1C2C3C4C3C2(O)C14,0.2959
CC1=NC(F)=CC(=N)O1,0.181
OC1CC=CCC2CC12,0.2616
c1c(=O)cc(oc1N)N,0.2098
OC1CCC1N1CC1,0.3151
CC1CCOC(=O)C1C,0.2698
CC1C(O)C2OC2C1O,0.3132
c1c(c(on1)N)N(=O)=O,0.1781
CCC#N,0.3553
CC1=CCCOC(=N)C1,0.2488
OCC12CC1(O)COC2,0.3174
CC12CC3C1CC3(O)C2,0.3312
CC(O)C1=CNN=C1O,0.2465
OC1C2C3C4C3C1(O)C24,0.3012
OC1(CCCC=C1)C#C,0.2544
CC1(O)CC1CCC=O,0.2265
CC1(O)C2COC12,0.2951
OC1CCC1(C#C)C#C,0.2736
C1NC=[NH+]C2=C1N=N[N-]2,0.1418
CCC1(C)OC1COC,0.3348
c1(c([nH]nc1N)N)N,0.2408
O=CC(=O)C1CN1,0.156
O=C1C2COC1C1OC21,0.2119
OCC1CCC2CN12,0.3083
CC12CN1C1C3CC1C23,0.326
CCC#CC(C=O)C#N,0.2124
CC1NC11CCC1CO,0.289
CCCC1C2C3NC3C12,0.2765
CCCC1(CCO)CO1,0.3312
CCC1C2OC(C)C12O,0.2858
COCC1(O)COC1C,0.3132
FC1=NOC=CC1=N,0.1885
CNC(=O)CC1CC1C,0.2746
CC1C2N1CC2(O)C#N,0.254
CC1(C)C(O)C11CCC1,0.3068
CC1C2C(C#N)C(C)N12,0.2637
CN1N=C(N)OC1=N,0.2292
CCCC12OC1CC2C,0.322
CC1N=COCC2OC12,0.2645
CC1C=CC2C=CCC12,0.2534
CC(C#N)C1=NNC=C1,0.263
OCC12CC(C1)(C2)C#N,0.3076
CC12C3N=C4NC1C4C23,0.1623
CCC(O)CCC1CC1,0.3291
C1C=CC=CC=C1CO,0.1804
CCC#CCC1CC1C,0.2983
OCC(=O)N1CC1C#N,0.2512
COC1(CO)C(C)C1C,0.3009
CC1CC(N2CC2)C1=O,0.19
CC12CCC(OC1)C2=O,0.2058
CC1OC1C1CC2OC12,0.3339
c1[nH]c2c(n1)NCCO2,0.2203
CCC1C2NC2CC1O,0.3132
CC12CC1C1(OC21)C=O,0.1955
CC1CC1(C#N)C(N)=O,0.2744
c1c(n2c(n1)C=CC2)O,0.1693
CCN1CC1CCOC,0.3089
CC1CC2CC1OCC2,0.3101
CC1CCC2=C1N=CN2,0.2387
c1cc2n(c1)CCOC2,0.2374
O=C1CCC1C#C,0.2144
OCCC(O)C1(O)CC1,0.3176
CC1CC(=O)C1(C)C,0.2186
CCC(O)CCCC#C,0.3137
CC([NH2+]CC=O)C([O-])=O,0.2127
COC(=O)NC(=O)CN,0.2351
CN1C2C1C(C)(C)C2O,0.2945
CCNC(=O)NCCO,0.2987
CCC1OCC(O1)C=O,0.2196
OC(CC=O)CC#N,0.2294
OCC1C2COC1C=C2,0.2473
CCNc1c(nn[nH]1)O,0.2136
CCC1=CCN(C1)C=O,0.2437
CCC1CC1CCC#N,0.3199
C1C2CC(C12)N1CC1,0.321
CC(C)C12CC1N=CO2,0.2592
N#CC1CNCC2OC12,0.2698
O=C1NCC2OCC1O2,0.2626
COCCc1c[nH]nn1,0.2509
c1c(cnc(n1)CO)F,0.1959
CC(OC(C)=O)C(N)=O,0.2454
C#CC1(CCN1)C#N,0.2498
N=C1ON=C(O1)C1CO1,0.2257
OCCC1C2CC1C2=O,0.2515
CC12CN1C(CO)CC2,0.3073
CC1(C)CC(CC=O)O1,0.2228
CC(C)(C#N)C(F)(F)F,0.3537
O=CC1N2C3CC=C1C23,0.1733
CC12OC3CC1C3C=C2,0.2473
CC1CC=C(C#C)C1=O,0.1854
OC1CC2C3CC3OC12,0.2874
OC1C2CC(C2)C1C=O,0.2197
CC1C2C3C4OC3C4N12,0.2977
CCC12CC(C=C1)C2O,0.2376
CCC1C2C3OC3C12,0.2852
CC(O)C(C)CC=O,0.2294
NC12CCC1OC2C#N,0.2516
COC1CC(CO)C1C,0.3212
C(#CC(=O)N)C(=O)N,0.2063
CN=C1ON=CC=N1,0.1516
OC(C=O)C1(CC1)C#C,0.2096
CN1C2C3CC(=O)C2C13,0.2004
CC1=CC(=N)N=C(N)O1,0.209
c1c([nH]c(=O)cn1)CO,0.1694
c1[nH]c(=O)nc(n1)C=O,0.1619
CC#CCCC#C,0.2925
Cc1c(cc([nH]1)OC)N,0.2267
C#CC(=O)NC1COC1,0.2236
CC1(O)C2CC1(O)CO2,0.2969
CC1(COCOC1)C,0.3318
C1OC23C4C5C4C12NC35,0.2713
N=C1OC2C(CC12)C#N,0.2836
CC1C2CC3C2C(O)C13,0.3178
CCC1C2CC1CC2,0.3688
C(#N)C(C#N)(C(=N)N)N,0.2377
N=C1ON=CN=C1,0.1667
CC(=O)NC=N,0.2283
CC(C=O)C1CC=CC1,0.2233
O=CC1C2CN3CC2C13,0.2033
CC1CC2(NC12)C#N,0.2625
OC1CC2(C1)OC2C=O,0.2183
CC12CC=CC1N2C=O,0.2384
NC1C2OCC12C#N,0.2518
CC1C2CC2CC11CC1,0.3427
COC1OC(=O)C=C1C,0.2229
C1C2OC22C=CCOC12,0.2267
CC(C)C1COC(N)=N1,0.2784
CC1CC2C(CO)C12C,0.3174
N=C1C=NOC(=N)N=C1,0.1629
CN1CC(C1)(C=O)C#C,0.1862
CCC1CC=CC2OC12,0.2409
CC1(C)OC2CCC=C12,0.2425
OC1=CNC(OC=N)=N1,0.2003
CC(O)CC1(C)OC1C,0.3313
c1c2n(cn1)C=CCO2,0.1863
CC(C)OCCN1CC1,0.319
CC1COCC1(C)C#C,0.2968
CC#CC1CC2C(O)C12,0.2868
CN1CC23CC(C)(O2)C13,0.2722
OCC12OC1C(O)C2O,0.3135
CC12C3C4C=C1CC2C34,0.1762
CCC(C)OCC(C)C,0.3317
CC(O)CC1=NON=C1,0.2472
CC1=C(C#N)C2CN2C1,0.1931
CC12CC3N1CC23C#C,0.2725
C#CCNC12CN(C1)C2,0.2675
CC1(CN1CC#C)C#C,0.2629
CCOCC(O)COC,0.3306
CC#CC(C)(C)O,0.2928
CC1C(CCO)C1C=O,0.2245
OC1CC(CC1O)C=O,0.2248
O=C1OC(C#C)C2OC12,0.2504
OC12C3CC11CCC2C31,0.3358
CCC1C2CC(=O)OC12,0.2793
C1CC12CC(=NO)C=C2,0.1849
N=C1OC2CC1NC2=O,0.2457
CC(C)C1(COC1)CO,0.3025
Cc1c(c(n[nH]1)C)C#C,0.2237
CCCC(CO)C(C)C,0.3377
CC1C2CC3NC3C1O2,0.3025
CC12CC(O1)C1CN1C2,0.3011
CC(=O)COCCCO,0.2346
OCC1C2CC2CC1=O,0.2193
CCOC(=O)C(=O)C#N,0.1695
c1cc(ncc1F)CO,0.2167
OC12CCC(C1)OC2=O,0.2788
O=C1C2C3OC1C=CC23,0.1861
CC1=C(O)C(=N)ON=C1,0.174
c1c2c(n[nH]1)CCN2,0.2141
OCC1C2COC12CO,0.2986
OCC1N2CC2CC1=O,0.1966
CC1=CC2C3CC1C23,0.235
CC12C3C1C1(O)CC3C21,0.2991
CCCC(C)(CC)CO,0.3325
C1C2C3C4C1C2CN34,0.3375
N=C1NC2(COC12)C=O,0.1949
N=COC1=CON=N1,0.2061
CC1CC(C)(C)C1C#N,0.3259
CC1C2C3CCC1OC23,0.296
COC12C3C1N1CC2C31,0.285
O=C1C2OC(C=C2)C1=O,0.1417
OCCOC1CN=CO1,0.2801
NC(C#N)C(O)C(N)=O,0.2495
COCC1CC(O)C1C,0.3166
CC#CCCC(N)C#N,0.2732
Cc1c(noc1N)C#C,0.1957
CC(C)C(O)C(C)C=O,0.2207
OC1CC2C(O)CC=C12,0.2449
OCC1C(O)C1(O)CO,0.2909
OC1C2CN3C2C13C#C,0.2699
OC1C2OC2COC1=O,0.2734
CCc1c(c(n[nH]1)O)N,0.2419
OC1CC1CC1COC1,0.3138
OC1CCC2CC1CO2,0.3129
CC(C#N)C1CC1C#N,0.318
O=C1NC=CC1C#C,0.2153
COC(C)C#CC,0.2889
COCc1cc(c[nH]1)N,0.2174
Cn1ncc(n1)CO,0.2468
CC1C(OC1C=O)C=O,0.2093
OCC12OC1C1OC21,0.2913
N#CC1NCC11CCO1,0.2661
CCC1(C)CC2(CC2)O1,0.3028
COC1C2CC=CC12,0.2421
CCCCCOC(=O)C,0.2848
Cc1cc(cnc1C)F,0.2186
CC#CC1OCCC1C,0.289
CC12NC1COC2=N,0.2676
C1CN1CCOCC#N,0.2506
C1CCC2N=COC2C1,0.2644
CC1CCC2C(C#N)C12,0.3109
COC(CO)C1CCO1,0.2995
CC1CNC(=O)CC1=O,0.2181
OCC12C3C(CN13)C2=O,0.2284
C1OC2CC3C=CC2C13,0.2384
OCCC12OC3C1NC23,0.2961
C1CC2(O1)C1NC2C=C1,0.2227
O=C1C2CC3C2COC13,0.2102
CCC1C2CC3OC2C13,0.3197
OCC1N2CC1(C2)C#C,0.2818
C1NC1C12COCC1O2,0.3115
CCC1COC1C(C)O,0.3195
CC12CNC1C2C#N,0.2669
NC1=NCC(O)C2OC12,0.2369
CC(C)OC1(CC1)C#N,0.2921
CC1=CC23CC2(CC3)C1,0.233
Cc1[nH]c2c(n1)CC=C2,0.1795
CNc1ncc(=O)on1,0.1407
O=C1C2CC3C2OC13,0.2094
C1C2CC11CC3OC3C21,0.338
O=C1C2NC2C2CC1C2,0.2135
CC1(CC2CCN12)C#N,0.2562
OCC1COC(=O)CO1,0.2637
CC1=CNN=C1C1CN1,0.2355
CCC1=C(CCC1=O)C,0.1979
OC12CC1OCC2C=O,0.1993
COC1C2C3CC2(C)C13,0.3369
CCOCC(C)(C)C#N,0.3072
CC1=C(OC(=N)N1)C#C,0.1779
C#CC1CC2=CCOC12,0.2331
CC1(CC(=N)O1)C1CC1,0.2903
CCc1ccnn1CC,0.2538
O=CC12CC1C(=O)CN2,0.1973
Cn1c(ccc1N)C#N,0.1915
CC1C2OC(=N)C12N,0.2598
N#CC12COC(C1)C=C2,0.2463
CC#CC(=O)C(O)C#N,0.2117
CC12CCOC1C=CC2,0.2607
O=C1OC2C3C4C2C1N34,0.2496
CC1CC(=O)C2NC12C,0.2144
c1c(c[nH]c1O)N(=O)=O,0.1593
O=CC1CCC1C#C,0.2234
Cc1cnn(n1)C(=O)C,0.2188
OC1CC23CC2(C1)OC3,0.2818
CC1CNCC(=O)C1,0.1981
C1C2CC11COC3C2C13,0.2737
C#CCC1OC11COC1,0.2993
[NH3+]CCC1=C([O-])NN=N1,0.2349
N=C1C2CC2N1C=O,0.2342
CC12OC1C1(OC21)C#N,0.2545
CNC(=O)C1C2CC1C2,0.2663
CC1(CCCC(=O)O1)C,0.2723
C#CC1COC(=N1)C#N,0.2204
C1C=C(CN=CO1)C#N,0.2145
O=COC1CC(C1)C#C,0.275
CN1C2CCC12CC#N,0.2802
CC1(OC2CC12N)C#N,0.2498
CC12CN1C1CC1(O)C2,0.2948
c1cc(n(c1)CC#N)O,0.2133
CCCC12NC1CC2O,0.3018
O=CC12OC3C1C=CC23,0.1847
CC1N(C)C(=N)NC1=O,0.2265
CNC(=NCC#C)CO,0.258
CC(O)C1CCC1C#N,0.3068
CC1(O)COC2CC12,0.2948
CC(=O)C(=O)C(F)(F)F,0.1536
CCOCC1(CC1)CO,0.3222
CC12NC(C3OC13)C2=O,0.2439
c1c([nH]cn1)CCCO,0.2488
CC1(O)C2NC2CC1O,0.3078
O=CCC1CC2CCC12,0.2274
COC1(C)C2NC2C1C,0.3078
OCC(=N)N1CCC1=O,0.2389
C1C2C1C1CC1C1CC21,0.3065
CCCC1OCC1(C)O,0.308
CC12CC(C#N)C1O2,0.2955
O=CC#CC1CC1C#C,0.1987
OC12CC1C1(CCC1)C2,0.3271
C1CC12CC=CNC2=O,0.2127
OCC(=O)C1CC(O)C1,0.213
CC12CC3=CC4C1N4C23,0.1744
CCCC12NC1CC=C2,0.2453
CC1=C(C)CC2OC2C1,0.2556
C(C1CO1)N1C=CC=N1,0.262
O=CC1=CCN2CC1C2,0.1642
Cc1c(cnc(=O)o1)F,0.169
CC12OC3C1C3(O)C2=O,0.2154
O=CC12CCC3OC1C23,0.2126
COCC(O)C(O)C#N,0.2873
CC1CC2(CC2)C1=NO,0.2347
O=CN1CC2(CC12)C#C,0.2499
CCn1c(c(nn1)O)O,0.2194
CCC1OC(CC)C1=O,0.2204
CC1(O)COCC(O)C1,0.3117
OC1(CC#C)COC1=N,0.2743
CN1CC2(C1)OCC2O,0.2731
O=C1NCC2CCC1C2,0.2706
O=C1CCC2OCC2=C1,0.1876
CC1(CC2OC12)OC=N,0.2801
CC12CC1(C)C1CC2O1,0.3248
CC1CC23CC2(CC3)O1,0.296
CC1=CC(C)=NOC1=N,0.1696
CC1OCC(C)N=CO1,0.2593
C#Cc1cc(=O)cno1,0.1736
CC1C(NC1(C)C)C#N,0.2642
CC(C)(CC=O)CC#N,0.2227
CC1CC1C1=NC=NO1,0.2433
OCC1C=CC2(O)CC12,0.2472
Cc1c(n(cc1O)C)C,0.2285
CC1=CC2CC(O2)C1=O,0.1747
OC1CC1C1(O)CCC1,0.2791
OC1CC23NC12CC=C3,0.219
CC12CN3C(CCO1)C23,0.3141
OC12CC3C4C1C2CN34,0.3005
Cc1c(=O)ccoc1F,0.2044
COCCC(O)C(C)C,0.3152
CCC(CC#C)OC=N,0.2807
C1C(CO1)(C(F)(F)F)O,0.3181
CCC1=NCCOCO1,0.2534
CC(=O)NC(=N)C1CC1,0.2338
OC1C2NC2CC2NC12,0.2927
N=C1OC2(CC2)C2CN12,0.2792
O=CNCC1C2COC12,0.2749
CC1CC2C(C#N)C12C,0.3064
O=CC12CC(C1)NC2=O,0.2143
CC12COC1C(O2)C=O,0.2092
OC(C#C)C1C2CN1C2,0.2592
CC1(C)CC(O1)C#C,0.2776
CC12OC3C(=O)C1C23C,0.2242
CCC12CC1OC(C)C2,0.3157
CC1OCC(C)(O)C1=O,0.2137
CC1C2NC2(C)CC1=O,0.2259
CC1CCC(O)C=C1,0.2597
CC(O)(CC#N)C(N)=O,0.2639
Cc1c(coc1NC)O,0.2176
Cc1c(oc(=NC)o1)N,0.2321
CCC12OC(=N)C1C2O,0.265
CC1NC(C=O)C1O,0.1946
C#CCOC(=O)C=O,0.1801
OC1C(=O)C=CC11CN1,0.1895
NC1=NNC=C1OC=N,0.2255
CCCC12C3C4C1N4C23,0.2777
C1c2c(onn2)OCO1,0.2134
COC1CC2NC2C1=O,0.1923
CCCC1(O)CC1(C)C,0.3208
CC12CC(N1)(C#C)C2O,0.2711
OC(C#C)C1=CON=C1,0.2467
CN=C1OCC1NC=O,0.2715
COC(C)C#CCCO,0.2891
CCC1(C)C2C3CC3C12,0.2801
Cc1ncnn1CC#C,0.2603
COC1CC(C)C(C)O1,0.3345
CC1CC(=O)C(C)=C1N,0.2036
CC1CN2CC2C(=N)O1,0.2513
CN=C(C#N)N1CC1C,0.2019
OC1CC2CC1C(=O)N2,0.2629
CC(C)CC(C)(O)C#N,0.3134
CC12CC1(O)CCO2,0.2974
CCC1(O)CNC1=NC,0.2591
O=CC1=CC(OC1)C#N,0.1903
OC12CC3C1N3CCC2,0.2986
OC12CC1N1CC21C=O,0.1909
CCC(O)C#CC(C)=O,0.2084
COC(C)C1CC(C)C1,0.3307
CC1C=CC(C)C11CC1,0.263
OC1CC11CC(N1)C#N,0.2537
N=C1CN=CN1C1CC1,0.2092
CC1CC(O)(C#C)C1=O,0.1982
CCC1=CNC(=O)C1=O,0.1467
CC1(O)COC11CC1,0.2931
CNC(C#C)(C#N)C#N,0.246
N=C1OC(=O)CC2NC12,0.2499
Cc1c(n(nn1)C)CO,0.2391
OCCC12OC1CC=C2,0.2467
Cc1c(c([nH]n1)NC)O,0.2336
CC(C)OC1CCC=C1,0.2626
CC(CNC=O)C(N)=O,0.2699
CC1NC1C1(O)CC1C,0.2901
FC(F)(F)C1CNC=N1,0.2504
CC1CC(C)(C#N)C1C,0.3303
CN1CCc2c1cno2,0.1898
CCC#CC12CCC1O2,0.2582
CC1C2CC3(CCC3)C12,0.3251
OC1C2C3CC1C1C3N21,0.2912
O=C1NCC2NC2C1=O,0.181
CC1(COC1)C(O)C#N,0.2637
CCC1C2OC(=NC)C12,0.2701
CC1(CCCO1)OC=N,0.2865
CCC1OC1C(=O)CO,0.228
CC12CCCC1CO2,0.3217
CC1(CC(C1)OC)C,0.3249
c1c(oc(=O)c(n1)N)N,0.1456
CC1(CC1)C1(CO)CO1,0.3417
CC#CCCCC#C,0.2878
OC1=CC(F)=NC(=N)O1,0.1879
C1N2CC11OCC=CC21,0.2391
OC(CC#N)C1(O)CC1,0.3013
C1COCCC12COC2,0.3162
O1C2C=CC3C4OC23C14,0.1548
CNC(=O)C#CC1CO1,0.2293
CC12CC3(C#N)C1OC23,0.2691
CC(=O)N1CC=CC1=O,0.2052
CC1CC2CC3C2C13C,0.3324
OC1C=CCC1C#N,0.2618
CNC(=O)NC(=O)C=O,0.1619
O=CCC1CCN2CC12,0.2111
CCCCCC#C,0.3166
CC12CCC(C1)C=C2,0.2564
CC1NC(=O)C1C,0.2807
CC1CC(=O)NC1(C)C,0.2727
OCC12CCC(C1)OC2,0.3034
C1C(=O)CNC12COC2,0.2136
CC(=O)C(=O)NC(=N)N,0.1593
COC1(CC1C=O)C=O,0.2074
O=C1N2CC2CC11CO1,0.2214
CC1=NC=C(O)NC1=N,0.1653
CC1CC(C)C(O)C1C,0.318
c1c(=O)c(c[nH]c1F)O,0.198
Cc1cocc(c1=O)F,0.2024
FC1=NNC(=N)C(=N)N1,0.1859
OC12CC(C1)C=C2C#N,0.1985
CC#CC(=O)C(C)C=O,0.1856
N1C2C1C1OC2C2OC12,0.3049
CN=C1OCC1N,0.2651
CC1C2C3(O)CC1C23C,0.311
c1c(c2n(n1)CCN2)O,0.2294
CC1(C)C2CC(C)(O)C12,0.3197
OC1C(NCC1=O)C#N,0.2026
Cc1cc([nH]c1C)CO,0.2261
Cn1cc(nc1O)CO,0.2476
CCC1CC=CC1C#C,0.2617
O=C1CNCC1C#C,0.1994
CC1CC2OC1C2=O,0.2338
COCCC(OC)C#N,0.2775
CCCc1ccc[nH]1,0.2422
CN1CC2(O)C(CO)C12,0.2675
CC(O)C1(C)CC1(C)O,0.3132
CNc1ccn(n1)C=O,0.1785
Cn1cncc1CO,0.2473
NC1=C(F)N=CC(=N)N1,0.1397
CC12CC(C1C=O)C2=O,0.2048
COC(C)C(O)C#C,0.2995
C1OC2C3COCC2C13,0.3115
CCC(CCO)C#CC,0.3002
C1OC1C1=CC=CO1,0.2238
CC12CN3C1CCC23C,0.3019
OCC1=NC(CO1)C=O,0.2161
CC1(CC1O)C1CN1,0.3131
C1COC(=N1)NCC=O,0.2096
NC(=O)C1(O)C(O)C1O,0.2323
CC1=CCC2NC12,0.2482
CC1CC(C)(C1)N1CC1,0.3086
CC1C2CN1C21COC1,0.3081
CN=C1NCC11CO1,0.2409
C1OC2CC3OCC3C12,0.3019
OC1C=CCC1CC#C,0.2591
CC1CC11OCC1C#N,0.2625
C1NC2C1N1C=NC=C21,0.2419
CC12CC1C(O)(CO)C2,0.2979
CC12CN1CC=C2C#C,0.1937
COCC12CC(O1)C=C2,0.2372
C(CC(=O)CC#N)C=O,0.2122
Cc1c(cc([nH]1)O)C=O,0.1764
CC12C3C4N3CC1C24O,0.2895
CCCc1nc(on1)C,0.2606
NC1(CC2NC12)C#N,0.2688
Cc1[nH]c2c(n1)cn[nH]2,0.2247
CC(O)C(O)C1CCC1,0.3059
CCC(=O)CCC#C,0.2317
COC=Nc1c[nH]cn1,0.2025
CC(CC1NC1C)C#N,0.2985
CN(CC1CO1)C(N)=O,0.2931
COCCC12CC(C1)C2,0.3414
[NH3+]CCC1=NOC(=N)[N-]1,0.06
NC1(CCOC1=N)C#C,0.2571
OC12CC1OC2C#C,0.2511
CC1OCC1(C)CC#C,0.2902
CC(C)(CC#N)NC=O,0.2755
CC1C2OC(=N)C=CC12,0.2001
N=COC1(CC1)C#C,0.2713
CC1(CC#CCO)CN1,0.2773
Cc1nc(co1)NC=O,0.2139
C1CC(C1)(C#N)NC=O,0.269
COCC#CCO,0.2814
CC1COCC1N1CC1,0.3146
CC1C(O)CC=C1C=O,0.1928
CC12CC(O)(C1)CO2,0.3015
C1OC11C2C3C1N=CN23,0.2319
NC(=O)C12CN3C1CC23,0.2375
ON=C1CCOC(=N)C1,0.2485
O=C1NC2(CC2)C11CO1,0.2554
CC12CC3(C1)OCC3C2,0.3207
O=C1C2CN2CC11CC1,0.2188
CC(=O)C1(CC1)CC#C,0.2318
CC1CC11CCCCC1,0.3355
OC12COCC1CC=C2,0.2541
C#CC#CCCC1CC1,0.231
C#CC(=O)C(=O)C=O,0.1194
O=CC12N=CN3CC1C23,0.209
OCC1COC11CC1,0.2923
OC1(COC11CC1)C=O,0.1953
CCCOC(CO)CO,0.3218
CCC1(C)COC11CC1,0.2995
OC12CC1CC21CN1,0.2893
C1C2C3CC=CC=C1C23,0.1962
c1c(c(n[nH]c1=O)O)N,0.1766
CN1CCC(=NO)C1=O,0.1969
CC(=O)N(C)C(=O)C,0.2175
CN(CCO)C(=O)N,0.2804
COC(C)CC(O)C=O,0.2223
CC#CC#CCC(C)O,0.226
CC(C#C)C#CC#C,0.229
COC12CC1C1(C)CC21,0.2892
N=C1NC(C#N)C11CN1,0.2627
CCc1c(cco1)O,0.2202
C1CC1CCCC2CC2,0.3587
C1OCC2=C1CC1NC21,0.2361
CCNc1ccc([nH]1)C,0.2305
O=CCC1CC1C=O,0.2177
CC1=NC=CC=NC1=N,0.169
CC1(C)NC(CO)C1=O,0.2135
OC1C=C2COC2C1O,0.2454
CC1C(C)C(C)(C)C1O,0.3052
CCC12OC3C1C(C)C23,0.3117
CC1(CC1C#N)NC=O,0.2725
c1c(nco1)OCC=O,0.1949
CC1C2C3N4C2C1C34C,0.2981
CNc1c(=O)oncn1,0.18
CC(CCO)CC1CO1,0.3412
OC1C2OC3COC2C13,0.3025
OC1C2CC2C11CCC1,0.3176
C1NC11C2CC=CC1O2,0.2319
O=C(CC1CO1)C1CO1,0.2161
N=COCC1COC1=O,0.2623
CC1CCC11CN1C=O,0.2506
CC1CN(C1)C(=O)NC,0.2901
OC12CC3C1C1C2CN31,0.2783
CCC1=CCOC1=N,0.2188
CC1CC(N1)C(=O)C#N,0.1681
CC1N=COC11COC1,0.2694
CCC1OC2(C)C(O)C12,0.2999
CN1CCc2c1[nH]nc2,0.2262
C1CC2C3OC3CC12,0.3382
OC1C2NC3C2C13C#N,0.2624
CC1NC(=O)C(C)C1=O,0.2091
CCC1(O)CC1OC=O,0.271
CCCc1c(nno1)C,0.2253
CC12OC3COC1C23,0.2941
CC(C)(C)C1C2CCN12,0.2951
NC(=O)C1=CCC2CC12,0.2122
OC1CC2(CN2)C=C1,0.2399
CC1N2CC11NC(=O)C21,0.2171
c1c([nH]cn1)C(=O)CO,0.1968
c1c([nH]c(n1)C(=O)N)N,0.1893
COC(=O)C(C#C)C#C,0.2616
OCC1C2C(O)CN12,0.2927
N=COCC12CCC1O2,0.2846
CC1C2C3C2(C)CC13C,0.3271
CC1OC(C)C2CC1O2,0.3173
CCCC(=O)C#CCC,0.2091
O=C1CC23CC(O2)C3O1,0.266
C#CCCc1c[nH]nc1,0.2579
CN1C2C3NC2C(=O)C13,0.2059
CCc1c(cco1)N,0.2155
CCC(=O)C#CCCO,0.2098
C#CC1C2CC3C(C2)N13,0.2867
C#CC#CCCCO,0.2316
OCC1(O)CCCC1O,0.3186
OC(C#N)C1(CN1)C#N,0.2769
O=C1OCC11CCC=C1,0.2508
COC1C(O)CCC1=O,0.1999
Cc1c(cc[nH]1)C(C)C,0.2402
N#CC1COC=NC1,0.2712
COC(=O)C1(CO)CO1,0.2602
CCC(CC)C(=O)N,0.2764
CC1N2C3C(C2=O)C13C,0.2432
OCC#CC(O)C1CN1,0.2704
OC1C2NCC2OC1=O,0.2485
Cn1cc2c(n1)NCC2,0.2154
N=C1OC2COCC2O1,0.3077
CC12CC1CCC(=O)C2,0.2243
CCCC1(O)CC1C#N,0.3075
CC(O)C1(O)CC(C)C1,0.3086
C1C=CC2C=CCC12,0.2519
CC1(CC1(C#N)C#N)C,0.285
C1C(CN1C(=O)C=O)O,0.1734
CC1=NC2COCC2O1,0.2732
N#CC12CN1C1(CC1)C2,0.258
C#CC1CCCO1,0.2888
CC1CC1CN(C)C=O,0.2715
CC(C)(c1ccoc1)O,0.2412
[NH3+]C1C2OC(C12)C([O-])=O,0.1452
CCOc1c(n[nH]n1)O,0.2202
COc1ncccn1,0.2124
O=C1NC2(CC2)C2CN12,0.2715
CN=C1NN=C(C)C=N1,0.1368
n1nnon1,0.2598
C(c1nc(on1)C=O)O,0.1883
c1nc(c(o1)CO)CO,0.2331
CC1OCCC=C1C=O,0.1924
Cc1c2c(cco2)[nH]n1,0.2134
O=C1CNC(C=C1)C#N,0.1644
CC12OC3C1CC2C3O,0.3005
COc1c(cco1)N,0.2151
CC(C)(C)C(C)(C)C,0.3632
CC1(C(=O)NC1(C)C)C,0.2801
CC1(C)COCOC1=N,0.2784
CC1CC2CC1(C)C2O,0.3148
CC1(COC=O)CO1,0.2805
C#CC1CC(C1)C1CC1,0.3043
c1c(oc(n1)N)C#N,0.1957
CC1C(O)C1(C)CO,0.3117
C#Cc1c(cc([nH]1)O)N,0.1889
CN1C=NC(C#C)C1=N,0.222
CC1C2CCC12,0.3413
CC(O)C1OC1CC=O,0.2253
CCC1(CCCO1)CC,0.3179
Cc1c2c(co1)nno2,0.1582
CC1=CC=CC(=N)O1,0.166
CC1CCCC(=O)C1C,0.2221
COC1OC(C)C2OC12,0.334
CC1OC2CC3CC2C13,0.3228
CC1C2N1CC21CC1,0.3031
C1C2NC2C2=C1C=NO2,0.2274
COC1CCC2CC12C,0.3264
CC1(C)CC1C1CO1,0.3431
CCC(O)C(C)(C)CO,0.3263
Cc1cc2n(n1)CCO2,0.2482
CC1C(O)CC1(O)CO,0.298
O=CN1CC2CCC=C12,0.2074
OCC12OC3C4C1N4C23,0.305
O=CC#CC1COC1=O,0.202
CC(C)N1C2CC2C1=O,0.2456
CC12CC3OCC1C23C,0.3184
COC1(CC1)C(=O)C#N,0.1893
C1CC23CC(C2)COC13,0.3299
CC1CC1C12CC1OC2,0.3028
Cc1cn[nH]c(=O)n1,0.1768
OC1C2OC1C(O)C2O,0.2863
c1nc(on1)CC2CC2,0.2609
Cc1[nH]nc(n1)C(C)C,0.2624
CC1(C)CC(O)C(=O)O1,0.2729
CC1C2(C)C3CC2C13C,0.3602
CCCn1nc(nn1)O,0.2351
CC(C)C1(C)COCO1,0.3298
c1cc(oc1)C#N,0.2057
N#CC1C2C3OC1OC23,0.2904
CC1=CCC(=O)N(C1)C,0.2539
COc1ccc([nH]1)C#N,0.196
OC1CN2C1C21CCC1,0.2965
CC(=N)OC1(CC1)C#C,0.2701
CC1OC2CCCCC12,0.3188
CC(O)(C=O)C(O)C=O,0.2117
N#CCC12CC1C1CN21,0.2644
CC1C2OC3CC2(C)C13,0.3277
CNC(=O)C1OC1(C)C,0.2605
c1c(con1)C#N,0.2337
CCC(CC)C#N,0.349
CC12CC(O1)C2CO,0.303
Cn1c(ccn1)CC#C,0.2549
CNC12CN3C(C13)C2=O,0.2224
C#Cc1c[nH]cc1C#C,0.2162
CC1C(C2CO2)C1(C)C,0.3315
CCC(=O)OC1CC1C,0.2817
C1N2C3C4OCOC13C24,0.3143
CCC12C3C4C1C4(O)C23,0.2904
O=CC1CC(=O)C1C#C,0.2124
COC1CC2(C1)OC2C,0.3212
C1C=C(NC(=O)N1)C#N,0.1884
NC(C#C)C1=NON=C1,0.2145
CC(C#N)C1=CON=N1,0.2349
CC1C2C=CC(C#C)C12,0.242
CC12CC1(O)C(=O)CO2,0.2048
C1OC23CC(CCC2)C13,0.29
Cc1c(c(c[nH]1)C#C)O,0.2033
C1CC2C=CCCC2=C1,0.2519
CC(=O)NCCCO,0.2791
CC12CC3CCC1C23,0.3363
CC(=O)C1(CO)CN1,0.2316
CC(C)(C)CC(=O)C=O,0.1542
CCOC1CC1C#CC,0.2838
O=CC1=CN2C3CC1C23,0.1815
OC1CC=C2CC=CC12,0.253
CC12C3C4C1OC2C34O,0.309
CC1(O)C(CO)NC1=O,0.2675
OCC1=CON=NC1=O,0.2031
CC#CCC1NC1C=O,0.2193
C1CCC2(CC1)CO2,0.3373
C#Cc1cnc(nc1)F,0.1999
C(CO)NC(=O)C(=N)N,0.218
CC1OC(C#C)C1C#C,0.276
OC(C#C)C#CC1CO1,0.2569
C1=C2C3C4C1C1C2C3N41,0.1035
CC12CC1C1CC1(O)C2,0.325
OCC1CC2OCC1O2,0.3209
CCC#CC(C)(C)CC,0.301
C1C2C3N4C=NC13C24,0.2125
O=CC12CC(C1)CO2,0.2167
CCC1C2CCC(C)C12,0.3335
C1NC1C1CC2CN12,0.3041
CC(C)CCC(=O)C#C,0.2083
Cc1c2c(cc[nH]2)on1,0.2092
CC1CN1C(C)(C)C#N,0.2705
Cc1ccnc(c1F)N,0.2
COCCCOC=N,0.2805
CCC(OC1CC1)C#C,0.2921
OC1CC2CCCC2C1,0.3255
CC1(CC1C#C)C#N,0.2705
CCOCCC(C)C#N,0.2999
CC(=O)c1c[nH]nc1,0.2092
OC1(CC2COC12)C#C,0.2589
CCN1C2CCC1C2=O,0.2375
C1C2C3CCCC=C1C23,0.2265
CCC1CC2OC2C1,0.3444
COc1c(c[nH]n1)C#C,0.2162
CC12CC1(C)C1(CO1)C2,0.3268
CCC1=CC(C)OC1=O,0.2287
CC1C=CC23CC12OC3,0.2315
NC(C#N)C(O)C1CO1,0.2971
C1CN1C12CC(C1)C=C2,0.2353
CC12COC1C(C2)=NO,0.2365
CCc1c(cncn1)O,0.2087
CC1CC(C)(CC=O)C1,0.2243
C1OC11CC2NC2C1,0.3127
CC1OCC(O)C1C#N,0.2959
CC1C(=N)OCCC1=O,0.2248
CC(=O)C#CC(=O)CO,0.1974
N#CCCC12CC(C1)C2,0.3421
CCC(=O)N(C)C(=N)C,0.2388
CC(C)C1(OC1C)C#N,0.2991
CN=C1CC2C(C#N)N12,0.2401
C1C=CC(=NO)C=CN1,0.1608
CCCN(C)CC#N,0.2585
OC1CC1N1CCC1=O,0.2617
C1CC1(C2(COC2)O)O,0.3102
OC1C(OC1=O)C1CN1,0.2465
CC#CC1NC1C#CC,0.2587
OCC1(O)C2COC12,0.2841
C#CC1CC2COC2C1,0.2889
CC12CCC1(O)C1CN21,0.3005
OC1=C(NC=C1)C1CN1,0.2267
CC1C2(C)C3CC1(C)C23,0.3266
CCNC1(C)COC1=O,0.2449
O=C1COC23CC12OC3,0.2034
CN1C=NC(C)=NC1=N,0.1832
CCC(O)C(C)N1CC1,0.3252
OCC(C=O)C1CO1,0.2272
CCC1CC1(O)C(C)C,0.3168
O=CC1C2CC2C1C#C,0.2137
C1COCOC12COC2,0.3174
CC#CC1OC1C#C,0.2552
CC(C)OC(=O)C1CC1,0.2837
CC1=CC(O)=NNC1=N,0.1547
CCC1CC1(C)CC#C,0.3102
O1C2C3C4C3C3C4C1C23,0.2933
COC1(C)CC(CO)C1,0.3179
CC12CC1OC=N2,0.2607
C1C2CCC3CC3C12,0.3168
CC12NC1C1C(CO)C21,0.2786
CC1(O)C2CCOC12C,0.3044
c1c[nH]c2c1OCCN2,0.2214
COC(C)C1OC1C=O,0.2242
CCC1CC2CC1C2,0.3788
CNc1c(=O)cnon1,0.1557
CNC1C=CC(O)C1=O,0.2003
CC1=CC2CC3(O)C2C13,0.2334
N1C2C=CC=CC=CC12,0.1647
CNC1C(OC)C1C#N,0.2512
COC1CC2(CO2)C1O,0.3101
CC#CC1OCCCO1,0.2983
C1CC1C1CC2CC2C1,0.3429
Cc1cn2c(c1N)CC2,0.2215
CC(=N)OC=O,0.2472
COC1CC(C)CC1C,0.3219
CC1(C(=O)CNC1=O)C,0.2091
CC1CC2(CC12)C#C,0.2708
CC1OC(=N)C(C)=C1N,0.2105
C1CC2CCC3OC2C13,0.3074
OC12CCC1CCCC2,0.3263
C1NC2C3OC1OC23,0.2746
NC1C2CCC1(O2)C#N,0.2539
CC1(CCC2NC12)C#N,0.2919
CC1CC=CCC11CC1,0.2685
OC1=NC(=N)C(F)=CO1,0.2097
COC(C=O)C(C)C,0.2125
CC1C2CC(C)(C=O)C12,0.2185
COCC1NC(=O)C1O,0.2693
NC1C(C#N)C1(N)C#C,0.2404
NC(=O)C1(CCO)CO1,0.2624
CN1C2CCCC12CO,0.2949
OCC12CN1C1CC2C1,0.3242
CC1NC1C1=NCCO1,0.2556
C#CCc1ccn[nH]1,0.2612
OCC1=CCCC11CO1,0.2492
O=C1COC2CC2CN1,0.2655
OC1(CC(C1)C=O)C#N,0.2219
CCN=CN1CCC1=O,0.2235
CCCC(C)(O)C#C,0.3007
CC(O)C1C2CC(C)C12,0.3228
CC1CC(CO1)C1CO1,0.3315
CC1(C)C2OCC12C,0.3033
CC1=CC(O)C2(C)NC12,0.2378
COCC(C)C1OC1C,0.3407
C(C#N)C#N,0.3344
O=CC12CN3C1CC23,0.1925
CCC1(O)COC1=N,0.2847
OC1C2CC1OC=NC2,0.2748
CCC(O)COC(C)=N,0.2945
N=C1N=NON=NC1=N,0.1633
CC#CC12CC1(O)CO2,0.2383
OC1C2CC1C2OC=N,0.279
O=CNC1CC2CC1O2,0.2743
NC1CN2N=C(O)N=C12,0.2394
CCC1(CN1C=O)C=O,0.2128
CC1C(O)C1(O)C(N)=O,0.2689
OC1CN2C1=NOC2=O,0.2398
CC12CC1C1CCC1C2,0.3278
CCC1CC2(CN12)C#N,0.2581
NC1=CNN=C(N)C1=N,0.1566
OCC1CCC(O)C=C1,0.2599
CCOCC1CC1C=O,0.2287
CN1C2C3CN3C2C1=O,0.252
CNC(C#C)(C#C)C#N,0.2445
C#CC#CCC#CC=O,0.1909
C1C2C1C1=CCCOC21,0.2413
Cn1cnc2c1noc2,0.1979
O=C1NC2C1C21CCO1,0.2418
CC12CC3OC(=O)N1C23,0.2813
CC1C2COCC12O,0.3208
C1COC(O1)C(=O)CO,0.2191
O=CC12C3C4C3N1CC24,0.1933
OCCC1CC1CC#N,0.3114
CC1C(CC1=O)OC=O,0.2186
CC(=O)c1[nH]cc(n1)N,0.1561
CC1([NH3+])COC1C([O-])=O,0.2639
O=CC1CN2CC12,0.2098
N#CC12CC1C1OC1C2,0.2923
Cc1cncnc1C#N,0.1891
CC1CCC(=O)N(C)C1,0.265
O=C1NC2(CC2)C11CN1,0.2623
Cc1ncnc(n1)C#C,0.1973
CC#CC1OC(=O)C1N,0.2455
CC12CN3CC1(O)C23,0.2838
OC1C2CC(N2)C1C#N,0.2895
CC1OC(C#N)C11CC1,0.2735
COCC(=O)C1(C)CO1,0.2234
OC12C3OC1C1OC3C21,0.259
CC1CC2CC(O)C12C,0.3137
CC12CNC1C(N2)C#N,0.2626
CN(C)C1C(O)C1C#N,0.2677
CC(CO)C1CC1(C)C,0.3349
CC(C)CC(O)CC#C,0.303
CC12CC1(O)C1NC21,0.3093
Cc1c(cnn1C=O)N,0.1723
C#Cc1ncnc(=O)o1,0.1837
C1CC23COC(C2)OC13,0.3303
CC12CC1OCC(=O)O2,0.2544
CCCNCC(F)(F)F,0.3082
CC12CC1(O)C1CN21,0.3029
CCC(=O)N1CC1C,0.2566
C#Cc1cc([nH]c1)C#C,0.1972
CC1(O)CC(O)C1=O,0.2032
C1C2N1C1C3C4OC23C14,0.2912
OC1C=CC2=C1NC=N2,0.1784
O=CC12CC(C1)C(=O)C2,0.2077
CN1C(CC=O)C1C=O,0.1941
COC12CC(C1)OC2C,0.3153
O=CCCC1CC1C#N,0.2285
CN1C2COC(=O)C12C,0.2457
N=C1N=CNC=NC1=N,0.192
CC1C2CC(C2)C1O,0.3267
OC1C2CCC1C1CC21,0.3165
N=C1ON=CN=CC1=O,0.1553
CCC#CC(C)NC=O,0.2714
CC1C2CC3OCC2C13,0.3213
CCC1=CCCC1C=O,0.2056
CC1C2C(=O)C(C)C12C,0.2252
CC1(C)OC1(CO)C#N,0.2861
NC(C#N)C1CC(=O)N1,0.2699
C(COC=O)O,0.2843
OC12C3CC(CC13)C2=O,0.2257
CN1CCC1(CO)C=O,0.185
Cc1c(cc(o1)N)N,0.2147
OCC1CCC(=O)OC1,0.2707
CCC1C2OC3C2C13O,0.2871
C[NH2+]CC(=O)C(C)=N[O-],0.1278
CC1OCCCC1C=O,0.2157
OC1C2C(C#N)C2C1=O,0.2093
CC12CN1C(C#C)C2=O,0.2123
OC1(CCC1=O)C#N,0.2061
CC1CNC2=CNC=C12,0.2211
CC#CC(O)C#CCO,0.2641
CC(O)C1(C)CCCC1,0.3239
OC1C2OC3CC1(O)C23,0.3022
NC(CC#N)C(N)=O,0.2651
OCC1OC(=O)NC=C1,0.2223
CN=C1C2OC3CN1C23,0.2192
COC1C2CN2C1=N,0.2359
OC1CNC11COC1=O,0.2418
NC1COC1(C#N)C#N,0.2317
NC1=NCC2(OC12)C#N,0.2356
FC1=NC(F)=NC(=N)N1,0.2008
CC1C2CC3C(C2)N13,0.3257
CC#CC(C)(O)C(N)=O,0.2528
N=COC1C2CC1O2,0.2697
O=C1CN2CC12C1CN1,0.2107
CC1=CC2CC1(N2)C=O,0.2002
Cn1ncc(n1)CC#N,0.2501
C1CC2=CCOC=NC12,0.2396
N#CC12CN=C3CC1N23,0.1933
CC1(C=O)C2NC1C2=O,0.2081
CCC#CC(=O)C(=O)C,0.1528
CC1CC(CCC#N)C1,0.336
c1c(c2c(o1)NCC2)N,0.216
c1c[nH]c(c1C#N)CO,0.2197
OC1CNC(C1)C#N,0.2646
O=CC1C(C#C)N1C=O,0.1993
CCc1ccc(=O)on1,0.1829
CC1=C(C[NH3+])C([O-])=CO1,0.2172
O=C1NC23CC4C2NC134,0.231
O=C1CC2(CO2)CN1,0.2751
COC1CC2NC12CO,0.2884
OC1CC(=O)OC1C#N,0.2703
CC1C2CC2C11CC1,0.3345
O=C1C2COC1C=C2,0.2158
CCCCC(C)(C)C#N,0.3519
CC12OCC1OC1CC21,0.3074
N#CC1(CC2CO2)CN1,0.2763
CC(C1CN1)N(C)C=O,0.2679
CC(CCC#N)N1CC1,0.2858
N#CC1CN2C3CC3C12,0.2576
CC1=C(C)OC(=N)N1,0.2219
CC(C)C(C)C(O)C#N,0.308
OC1C2CCOC12C=O,0.2212
CC(C)CC(C)C,0.3784
CC1(O)C2CC2C1O,0.3202
C1C2OC3OCCC3C12,0.3164
O=C(CC1OC1)N1CC1,0.2497
O=C1NC2CC3CN3C12,0.2559
CC1C2NC2(C#N)C1C,0.2628
OC12CN3C(C13)C21CO1,0.3073
c1cncc2c1cn[nH]2,0.1892
CC1OCCC(C)(C)O1,0.3348
CC1(CO1)C1CC=CC1,0.2648
CCC(CNC=O)C#C,0.28
c1nc(nc(=O)o1)C=O,0.1571
OCC1C2CC1CCC2,0.3373
CC12C=CC3N1C2C3=O,0.1914
COCC1(CC1)C1CO1,0.3383
c1cnc(nc1)C(=N)N,0.1706
OCC12NC1C1CC2O1,0.2935
NC(=O)C1OC2CC2O1,0.2601
c1cc(ncc1C#N)N,0.1932
OCC1CC2CC=CC12,0.2575
CCCCC1OCC1O,0.306
CC1OC2CC1C1NC21,0.313
OCC(=N)N1CC(=O)C1,0.1969
CCC(C)OC(=O)CC,0.2857
OC1CC11OC(=N)C1O,0.2538
CC1CN=C(C)O1,0.2719
c1ncnc(n1)NC=O,0.2075
CC(C)N=COC(C)C,0.2724
COCC(=O)C(O)C=O,0.199
CC(C)CC(O)C(N)=O,0.2785
c1nc2c(o1)C=CC2,0.1837
CC(CC=O)C(O)C=O,0.2039
OC1CC2COC12,0.2994
CC(=O)CCOC(=O)C,0.2342
CN=c1[nH]cno1,0.2207
Cc1cnoc(=O)c1N,0.1692
OCC1C2C=CCN12,0.2264
Cn1cnn2c1ncn2,0.2413
CC1OC(C(N)=O)C1=O,0.2024
CCC1NC1COC=O,0.2758
OC12C3C4C1CC2N34,0.2732
COC(C)=NC1CC1C,0.2537
OC1CN2C3C4NC13C24,0.2676
CC1(C#N)C2NC1C2=O,0.2464
CC(C)OC(=O)C(=N)N,0.2126
CC(C)CCCC1CC1,0.3557
Cc1c2ccoc2[nH]n1,0.2259
CC12CC1(O)C(O)CC2,0.2884
C1CN2CCOC(C2)O1,0.2751
OCC(C#N)C(O)C#N,0.2819
c1nc(nnn1)CCO,0.1611
CC12CC(C1)C1CC2C1,0.3625
CC12CC3CN(C13)C2=O,0.225
CC1C(O)CC1NC=O,0.2793
NC(=O)C12C3C4C1N4C23,0.2371
CC(=O)CNC(=O)NC,0.2177
CC1=CCOCC1,0.2619
CNc1[nH]c(=O)[nH]n1,0.2482
c1c(nc[nH]1)CCCO,0.2529
NC(=O)C1NC1C1CN1,0.2641
OC12CC3CC4C(C14)C23,0.3054
CC12OC(CC=C1)C2O,0.2431
OCC#CC1OC1CO,0.2671
CCC1(C)C2OC1C2=O,0.2469
CC(O)C1CCC(C)=C1,0.2536
CC1CC2(CCC2=O)C1,0.2138
CC1COC(CC=O)C1,0.2257
CC12CC3OC1C=CC23,0.2444
CC(=N)NC(=O)C(=N)N,0.2035
OC1CC11C2CC1(O)C2,0.3106
O=C1CNC2C(C#C)C12,0.1974
C1CC2COC3C1C3O2,0.2957
CCC1C=CC2(C)NC12,0.2427
COC1CC1C(N)C#N,0.2921
NC1=C(O)ON=NC1=N,0.0784
C1C2COC11COCC21,0.3188
N#CC1N=CN2CCC12,0.2358
Cc1cocc1C#N,0.2201
C1CC12COC2,0.3106
Cc1c(occ1CO)C,0.2351
c1cc([nH]c1CO)CO,0.2261
CCC(=O)NC1CC1O,0.2683
COC1C2C3CCC1N23,0.3081
NC(C([NH3+])CO)C([O-])=O,0.2695
OC1C(CC#N)NC1=O,0.2685
c1c(nno1)N2CCC2,0.1826
COC12CC1(C)OCC2,0.3109
CC12CC1(O)C(=O)CN2,0.1898
OC(CC=O)C#N,0.2293
C1C(CN1C(=O)N)CO,0.288
OCC1=CC(O)C(=O)N1,0.2074
OC12CC(O)(C1)C21CO1,0.3124
O=C1C2CC2N1CC#C,0.2478
CC(C)OC1COC1=O,0.2521
CCC1CC=C2COC12,0.2416
ON=C1CC(C1)C1CC1,0.2492
CNC(C=O)(C=O)C#C,0.1849
C#CCC1C2C3CC2C13,0.3138
OC12CN=C3OCC1C23,0.2208
O=CC1=CC2CC1C2,0.188
CC1=NC=NC=CC1=N,0.1726
CC1CC2OC1CCO2,0.3217
COC(CCC=O)C#N,0.229
COC1CC1(C#C)C#C,0.2554
CC1CC(O)C(O)C=C1,0.2518
CC(C)C(C)C(=O)CO,0.2374
CCC(OC)C#C,0.3014
CC1=CCC(CC1)C#C,0.2603
OCC1C2COC1CO2,0.3094
CC12CC1C(=O)CCO2,0.2216
O=C1OCC2(CN2)C=C1,0.2137
C1C2C1C1=CCC3C2C13,0.2176
CC(O)C1CC2NC12C,0.2884
CCN=C1OC2CC12,0.2704
CCC(C)C#CCC#N,0.2875
CCC12CC(C1)C2O,0.3214
CC1(CO)C=CNC1=O,0.2162
CC(=O)C12COC1CO2,0.2121
C1CC1N=C1OC2CC12,0.2518
N#CCC1OCCC=C1,0.2643
C1CC12C(=O)COC=N2,0.2085
N=C1OCC2C3CN2C13,0.2528
OC(C#C)C(=O)NC=N,0.2251
CC(O)C1(O)CNC1=O,0.2551
Cc1nc(c(o1)N)CO,0.2136
CC#CC(C)CC1CC1,0.303
C1C(=C(C(=O)O1)CO)N,0.2128
CC1=NC(N)=NNC1=N,0.1407
N=C(NCC1CN1)C=O,0.1718
COC1COC(=O)C1C,0.2775
[NH3+]C1CCC1CC([O-])=O,0.1266
COCC1OC2CC1C2,0.3223
CC#CCC1C2COC12,0.2981
C1NC11C2CC3OC1C23,0.2984
CC(O)(C=O)C(F)(F)F,0.2192
CCOCC1(CC1)C#N,0.3024
C#CCc1c(cc[nH]1)O,0.2195
CC1=CC(=N)N=C(F)N1,0.2001
c1c(con1)C#CC#N,0.1958
CCC1OC1CCC=O,0.229
C1C2CC11CC=CC21,0.257
CC1C2CC3N1CC23O,0.2923
N=C1OC2CC3C(C2)C13,0.2738
CCC1CC(CC)C1,0.3656
OCC(O)CC(=O)CO,0.2374
CC1C2OC(=O)C12C=O,0.223
CCNC1C(C)OC1=N,0.2555
CC12CN1C(CCO)C2,0.3073
Cc1cc[nH]c1NC,0.2385
COC1(CC1)C1(C)CN1,0.3063
CC1CC(=O)C11CN1,0.2073
CCC1COC(C)=NC1,0.2709
OC1C=CCC11COC1,0.2444
COC1OC(=O)C=C1N,0.2171
N=COCCCOC=O,0.2738
OCC1C2COC1OC2,0.3199
COCC(C#C)C(C)=O,0.224
Cc1c2c(c[nH]1)nn[nH]2,0.1743
CCN=C1COC(=N)N1,0.2456
CC1CC2C3OCC3N12,0.2664
OC(C#C)C1NC1C#N,0.2818
OCCCCC1CCO1,0.3221
CC1C2C3C(C#N)C1N23,0.2819
CN(C)CC(=O)C1CO1,0.1943
COC(C)C(O)CC#N,0.3117
CC(=NO)C1(CC1)C#C,0.2377
N#CC1CC2CC3C1N23,0.2802
COCC1NC1(C)C#N,0.2829
CC(C#N)C12CC1CC2,0.2996
CN=C1CCNC(=O)O1,0.2592
CC12NC1C1CC21C=O,0.1955
CC(=O)C12OC1CC2=O,0.2024
C#Cc1ncnnn1,0.1566
CC1OC(C#N)C1O,0.2755
O=CC1CN(C=O)C=N1,0.2054
CC(O)C1C2CCN12,0.3032
CC#CCC(CO)C#N,0.2829
CC1(C)C2CCC2C1=O,0.2135
CCNc1cc(c[nH]1)C,0.2373
OC1C2CC3CN3CC12,0.2867
CCN=CN(CC)C=O,0.223
c1nc(nc(n1)N)C#N,0.1946
C#CCn1cnc(n1)N,0.2303
CCC(OCC=O)C#C,0.2294
C1OC1C12CC1CO2,0.2953
OCC(O)C1OCC=C1,0.2516
c1cc(oc1)CC(=O)N,0.2257
CC(C)C(C)C1CCO1,0.3173
OCC1CC11CC2CN12,0.2947
NC1C2NC(=N)C12C#N,0.2387
C1CC12CCNC(=O)N2,0.2929
OC1CCC(O)CC1,0.3213
CC(=NO)C12CC(C1)C2,0.2482
C#CC12C3CN1C=NC23,0.2204
CC1C=C(C#N)C2OC12,0.2101
CN=COC1CCC1C,0.2715
COC(C)(CO)CC#N,0.3019
CC[NH2+]CC([O-])=O,0.2693
C1C2CCC3CC(O3)C12,0.3219
CC(C)C(CO)C1CC1,0.3371
CC1CCCC1(C)O,0.3248
CN(C=O)c1c[nH]nc1,0.2275
O=C1CN2CC2(C1)C#N,0.2111
C1CC2(C1)C1CC2C=C1,0.2332
OC1CC2C1COC2=O,0.2678
CC1(CC1)C1CCC1O,0.3198
COC1COC2COC12,0.3045
C1CCN=COCC1,0.2584
O=C1NN=NC(=C1)C#N,0.1666
CC(=NO)C1(C)CO1,0.2545
c1c(n2c(n1)onn2)N,0.1778
O=CC12NC1CC1OC21,0.224
OC(C=O)C(O)C=O,0.2229
NC(=O)NC(C=O)C#N,0.2251
CC1(CC1)N(C)C=O,0.2673
CC(O)C1=NC=NC=C1,0.2145
CC(C)CC1COC=N1,0.2693
O=CC1NCC11CN1,0.2061
C(C1CO1)N1N=CC=N1,0.2546
CC1CCC(O1)C#C,0.2883
CCC(O)C1NCC1=O,0.2147
CCC(=O)C1CC1C,0.2312
C1C(=O)COC(O1)C#N,0.2103
C1C=CC(=CC(=O)N1)N,0.1705
CC(=N)OC1CC1C=O,0.2264
OCC12CC3CC1C23O,0.2979
CC12CCC11CCC2O1,0.2923
CC1=CCC2OC2C1,0.2631
CC1C(C#N)C1(N)C#N,0.2528
CC1CC1(C)NC=O,0.2749
c1c(ocn1)CCC=O,0.2122
O=C1CC2CC3CC1C23,0.2168
CCC12CC1C1NC21C,0.2805
CCC1C=CCNC1=O,0.251
CC1=CCCC(=O)C=C1,0.1684
CC12C3CC1C3N2C=O,0.2504
CC(OC=O)C(O)C#C,0.2817
CCCN1CC1CC#C,0.2773
CCC(C)(C)CC,0.373
CC1=CC(=O)NC2CC12,0.2074
N=C1ON=C(O1)C#N,0.1908
OC1C2CC(C=C2)C1O,0.2485
c1c(nn[nH]1)C#CC#N,0.1986
CC#CC1CCOC1C,0.2979
OCCNC(=O)C1CN1,0.2685
CCCC(=NC)OC,0.2756
C(C#CC#N)OC=O,0.2313
NC(=[NH2+])C1(CN1)C([O-])=O,0.2255
CC12CC1(C)C1CCC21,0.3225
CC(=O)C12CC1C=CC2,0.2238
CC(=[NH2+])NC(=N)C([O-])=O,0.1394
C1C2C3C4C=C1C2N34,0.1758
CC12CCC1OCC2O,0.3025
COC(C)C1(C)OC1C,0.331
CN1CC2OC2C1C#C,0.2604
CC12CC(O)(CO1)CO2,0.2991
N#CCC1OC1C1CC1,0.3059
Cn1c2ccoc2nn1,0.2069
CCC#CC(O)CC,0.2887
O=CCC1CC1CC=O,0.2207
CC1OC(CC#C)C1=O,0.2149
CC1CC11OCC1=O,0.2169
CC(O)C(=O)N1CC1C,0.2465
CCC1CC2(C)CC12O,0.3134
OC1CC(C=O)=CC1O,0.1911
CC12OCC1C2(C)C#C,0.2691
OCCC(OC=O)C#N,0.2655
OC1C2OC(=O)C=CC12,0.2097
CC1C(O)C1OC1CC1,0.3025
CC1=CCOCCC=C1,0.2188
C#CCCNC(=O)C#C,0.2256
OC(C#C)C#CC1CN1,0.2448
OC1CCOC(=O)C1,0.2695
CC1(NC=O)C2COC12,0.2597
c1cc(c(c(c1)F)F)N,0.2172
O=C1CC2C3C1CCN23,0.2196
c1cn2c(n1)OCC2=O,0.1897
C#CCCOC=O,0.28
OC1CC2CC3CCC123,0.3202
O=CC1C2CN2C1C=O,0.1983
OC1C2C3C1CC23C#C,0.2733
CC(O)C1COC(C)C1,0.3101
OC1C2OCCOC12,0.2788
OCC1NC2C1OC2=O,0.2442
Cc1ccc(c(c1)C)O,0.2132
CC(C)(O)C12CC(C1)O2,0.3216
OCC1=CC(=N)N=CN1,0.188
CC12NCC1COC2=O,0.2462
OC1C2CC1(C=O)C2=O,0.2101
CCC([NH3+])C(N)C([O-])=O,0.2683
COC1C2CCC1C2=O,0.2202
CC12OCC34CN(C13)C24,0.3089
CN1CC(C([O-])=O)C1=[NH2+],0.2353
O=CNC1C2NC2C1=O,0.2038
OCC#CC1(CO1)C#N,0.2518
OC1CC1CCC1CC1,0.3338
CC12NC=NC1CC2=O,0.1909
CC12C=CC3C1OC23,0.2252
c1cnn(c1O)C2CC2,0.2516
C#CC12CC3CC(O1)C23,0.2634
C1CC(O1)C1CCCC1,0.3191
CC1C(C)C(C)(C)C1C,0.3356
C1CC23C1CC21CC3C1,0.3039
CC12NC(=O)CC1C2O,0.265
O=CNC1CCN2CC12,0.2636
Cc1cc(no1)CCO,0.2481
CC12OC3(C)CC1C2C3,0.3128
CCC(C)C(C)=NO,0.2579
CC1CC2C1N2C=O,0.2442
Cc1c(c[nH]c1N)C#N,0.2209
CC1C2C3C(O)C2N13,0.3158
OC1C2C3NC3C1C2=O,0.2239
CC1CN1CC1CO1,0.3159
O=CC1OC1CCC#C,0.2188
Cc1nccc(n1)N,0.2168
CC1=CC2C3CC2C1C3,0.2443
CC1C(=O)CC1(C)CO,0.2219
CC1C2C(C1=O)C2(C)O,0.2238
CCC1OC2CC2C1O,0.3
CCC1(CN(C1)C=O)C,0.2672
COCC1CC(C)O1,0.3238
NC1=NC2C3C2C(=O)N13,0.2062
C1COC(=N1)NC=O,0.2322
CN=COCC1OC1C,0.2733
CC12OC1C1OCC2O1,0.3219
N=C1OCC11COCO1,0.2749
COc1c(cno1)C#C,0.2159
CC1(CO1)C1OC1C#C,0.2749
NC(=O)C12CC1C1CN21,0.2488
CC1C2CC3CC1OC23,0.3269
OCCCC1C2COC12,0.3103
CC12C3CC=C(C13)C2O,0.1786
C1C2C3OC1CC1C3N21,0.3119
C1CC1(C#N)NCC=O,0.218
OC12CC1OC(=N)C2=O,0.1832
CC12CCC(O1)C1CC21,0.339
C1CC(=O)C=C1NC=O,0.1826
CCC1NC(=NC)C1O,0.2575
CC1CC2(CNC2=O)C1,0.2791
CC1(N)CNC1C#N,0.2645
CC1(CC1CO)N1CC1,0.2955
CC1C=CCC1C1CO1,0.2643
OCCC1COC1=N,0.2861
CC1CC1C1=NC=CN1,0.2463
C#CC1CC2CCC2=C1,0.2442
COC1CC(=O)C2NC12,0.2184
CC1=CC2CCC2(C)C1,0.257
CC1(CNCC(=O)N1)C,0.2488
CC1OC2(CO)CC12O,0.2825
CC12CC3(CCCC13)O2,0.3055
C1C(=O)C=C(C1=O)N,0.1644
CC1=C(C=NN1)C1CO1,0.2479
N=C1OC2C3CN3CC12,0.2587
CC12CC3C1C=CCN23,0.2258
OCC12C3C1N1CC3C21,0.2927
c1c(ocn1)COC=O,0.2377
c1c(cn2c1CC=C2)N,0.1738
O=CCC1=CCC2OC12,0.2105
CC1C2NC(=O)CC12C,0.2644
CC1(C)C2C3C2C2C3C12,0.3047
CCC1(C)CC(C1)=NO,0.249
CN=C(C)OCC1CN1,0.273
CC(=O)C(O)C#CC=O,0.2015
OC1CC11C2C3C1CN23,0.3055
CCC1OC2CC1(O)C2,0.306
CC1OC2CC(CO)C12,0.3007
CC1OCC11NC1C=O,0.2179
CC(=O)CCC1(CC1)O,0.2327
COC1CC2(CN2)C1O,0.3153
N#CC12CC3C(O1)C3O2,0.2701
OC1C2OC1C2(O)C=O,0.2132
CC12OCC3C(C13)C2=O,0.2198
CNc1c[nH]cc1NC,0.2325
OC12CCC3C4C3C1C24,0.2761
CC1(C)NC1(C)C#C,0.2707
COCCC1(CN1)C#N,0.291
[O-]C(=O)C1C2C[NH+]1C2,0.2077
CC1C2(O)CCC12C#N,0.2611
Cc1cnc(c(=O)o1)O,0.1687
CC1(C)COC(CO)O1,0.3263
CCCC1OC1C1CN1,0.3299
CC1C(C)C1CN1CC1,0.3088
NC1COC1(CO)C#N,0.2607
CN1CC(=CC(=O)C1)N,0.1914
CCC1(CC=CC1)C=O,0.2219
O=CCC12CC(=O)C1N2,0.212
Cc1c(nco1)CCO,0.2356
CCC1(CCO)OC1C,0.3335
CC1CC(C1)C(O)C#N,0.3082
CCCC#CC(C)CC,0.2999
CCC1(CO1)C#CC,0.2792
OC1C2CC1C2,0.3278
CC12CC(OC1)C21CC1,0.313
CC(C)CC#CCC#N,0.2865
O=CC1NC2C1CC2=O,0.1882
CCN1C2CC2NC1=O,0.2803
OCC1CC(CO)C1=O,0.2138
O=C1CC=CC2OCC12,0.2211
C1N2CC11N=COC1C2,0.2425
CNC12CC1COC2=O,0.2365
COCC1(C)OC1C#N,0.2675
CC1C(CO)COC1=N,0.2829
CC1(OC2CCC12)C#C,0.279
CCC(C)C(CC)=NO,0.2557
c1c2c(nc([nH]2)N)no1,0.2154
COC(C)C(O)C(C)O,0.304
CCC1(CC1C)C1CO1,0.3389
NCC(N)C#N,0.28
C(=O)c1nnn(n1)C=O,0.175
CNC1(C#N)C(C)C1O,0.2705
C1C2CN1C1=NNC=C21,0.2514
ON=C1CN2C=NCC12,0.2265
C(C(CO)C(F)(F)F)O,0.3501
O=C1NCC2C3CC3C12,0.2606
CC1(OC2CC12)C1CN1,0.3144
OCC1OCCCC=C1,0.2572
CC(C)OCC1CC1C,0.3292
O=CC1CC=CC1C#N,0.2215
CCOC(=N)NC(=O)C,0.2486
CC12CC1C1CCC2O1,0.331
COCC12CC=CC1O2,0.2475
c1c(ocn1)CC#N,0.244
CC(O)(COC=N)C#N,0.2795
CCC(CC)NC(=O)N,0.3008
OC1C2N(C=N)C1C2=O,0.2102
NC1=NC2CC(C2)C1=O,0.1756
CNc1c(c(n[nH]1)N)N,0.2397
O=CC#CC1CCC1=O,0.1926
N=C1OCC2CC1N2,0.2668
CC1C(CNC1=O)C#C,0.2701
CC1=C(C#N)C2CC1N2,0.201
O=C1CC2CC3CC12O3,0.2188
O1C2C3C4C1C1C2C3N41,0.2717
CN1CC(C1)C#CC#C,0.2067
OC12CCC1CC2C#C,0.2833
CN=C(C(=O)CC=O)N,0.1851
NC1=C(N)C(=N)C=NN1,0.1593
NC(=N)C(=O)C(O)C=O,0.1853
O=C1CC2CC(=O)CC12,0.2091
C1c2c(nn[nH]2)OC=N1,0.2218
OC1CC2(CCC2=O)C1,0.2146
CC1COC(=N)C1,0.287
OC12COC(C1)C(=O)C2,0.2096
CC12CCC1C2CCO,0.3222
C1COC1=NCCO,0.2632
CC1(O)C2C3N2CC13O,0.2924
OC1(COC1=O)C1CN1,0.2365
NC=[NH+]C1=COC=C1[O-],0.1905
CC1(C)C2CCCC1O2,0.3134
C1C2CC3CCC=CC123,0.2338
CC(C)(C)C1(O)CC1O,0.3148
CC1CC2(CN2)C11CO1,0.3038
C1CNC(=O)CC1=O,0.2193
C#CC12COC(C1)OC2,0.2925
c1c(con1)C#CC=O,0.1837
CC1=CC2OC3C2C13,0.2288
C1COCC12CCOC2,0.3297
CCC12CC3C4C1N4C23,0.2994
CC1NC1C1CC(=O)O1,0.2811
O=CC1C2CC3C2CC13,0.2215
C1CNC(=O)NC1,0.2962
C#CCCC1(CC1)CO,0.3137
N=C1CNCCO1,0.2502
COC1CC(C)C11CO1,0.3196
CC12CCC1C1(CC1)C2,0.3388
O=C1NC2C3C2N2C3C12,0.2509
CC1CCC2C3CC2C13,0.3615
CC(=O)C1OC1(C)C#C,0.2136
C[NH2+]C(C1CO1)C([O-])=O,0.2644
COC1CC2NC2C=C1,0.2472
C1CN(CC(=O)N1)C=O,0.2601
CC(CO)C1CC(O)C1,0.3288
N=C1NC(=O)C2(CC2)N1,0.2254
N#CC12CN3CCC1C23,0.2604
N=C1NC(=N)NC(=O)N1,0.2495
COC12CC1(CC2)OC,0.3306
OCC1CC1C#CC#N,0.2252
CC1CC2=CC(=O)CC12,0.1948
CC1(CO)CC1CCO,0.3341
CC(C)CN1CC(=O)C1,0.2065
O=C1CNCC2NC2C1,0.1974
OC1(CC2OCC12)C#N,0.2611
CNC1(CC2NC12)C#N,0.2587
N=C1C=CC=NC=N1,0.1607
OCC1OC(=N)C2OC12,0.2598
c1c(cn[nH]1)CCC#N,0.2608
C1C2C3COC2CN13,0.3145
CCOC1C2OCC12C,0.2928
CC12CC(C1)CC2O,0.337
CC1(C2(CC2)OCO1)C,0.3265
CC1=CCC2C1N2C=O,0.2363
O=C1C2CC3OC2CC13,0.2281
CCC(O)C(C)O,0.3192
Cc1c(non1)OC=O,0.2386
CC1C(O)CC1C(C)=O,0.2145
c1c(n2cnnc2[nH]1)O,0.2164
c1c[nH]c2c1[nH]cc2,0.2078
COC(C)C1CC1O,0.2935
OC12CC1CC2(O)C#C,0.2807
CC12CC(O)(C1)C2C#C,0.2972
CC12CC(O)C1C2C=O,0.2053
CC12C3C4C3C3C1C2C43,0.322
CC12C3C1C1CC2CC31,0.3489
CC(C)C1CC2(CO2)C1,0.333
CCOC(=NC)C#C,0.2273
CC1CC(CO)=CC1O,0.2566
CC(=O)C12CC1(O)CO2,0.2115
OC12CC3(C1)OCCC23,0.3074
CC1C(N)C1(C#C)C#N,0.2467
O=C1C2C3C4CN2C1C34,0.2359
CN=C(C#N)NC=N,0.1887
CC12CC1OC(C)(C)C2,0.3093
CC(CCC#N)C1CO1,0.3115
c1c[nH]nc1NCC=O,0.1773
CC(CCO)C1(C)CO1,0.3371
CNc1cc([nH]n1)CO,0.2141
COC(CC=O)CC=O,0.2118
C1CN=COC(=O)CN1,0.2216
CC1CC(=O)C(C)C=C1,0.223
CC1CC(OC1C)C#C,0.2866
CC1(O)COC(CO)C1,0.314
CN1C(C)(C)C1(C)C#N,0.2693
CC1CNCC(=O)N1,0.2466
CC1(C)C2C3C(O)C2C13,0.3224
C1CNC(=O)NCC1=O,0.2111
CC1CCC11CC1C=O,0.2271
O=C1CC2COCC2N1,0.2772
OC12C=CC3C1COC23,0.2302
C1C2OC3COC3C12,0.305
CC1(O)C2CC3CC1N23,0.2907
CC1C2CC(C)=CC12,0.2424
CN1C2CCC1C21CO1,0.3002
CN1C2CNC(C#N)C12,0.2596
CC(=N)Nc1n[nH]nn1,0.2103
CC(C#N)C1C2COC12,0.2916
c1conc-2cncc12,0.1244
CC(O)C1=C(N)C=NN1,0.2324
COCC(O)CN1CC1,0.2884
N=C1C=NON=C1C#N,0.1854
CCOC(=N)C1NC1C,0.2807
OC1CCC(=O)C1C=O,0.2138
C1CC11C2COC1C=C2,0.2432
c1cnc(cn1)CCO,0.1954
CC1=Cc2c(nco2)C1,0.1794
C1CC12C(=O)NC23CC3,0.269
CN1CC(O)C1CC#N,0.2687
N=C1OCC2(CC2)C=C1,0.2087
c1(nnon1)C(=N)N,0.1692
CCNc1cc([nH]c1)C,0.2223
N#CCC12CN1CC=C2,0.2344
CN1C(C#C)C1C(N)=O,0.2301
CCC1(C)CC(O)CO1,0.3139
CC1CCOC(=O)C1=O,0.1799
NC1=C(N=NO1)C#N,0.1687
CC1C2C3C=CC1N23,0.2136
CC1OC11CC2CC2C1,0.3356
N=C1NC=C(CC#C)O1,0.2216
CC(O)C1CC2CN2C1,0.2756
N#CC12CN(C1)CCC2,0.2519
OC1(C#N)C2OC2C1=O,0.1971
CC1COCC(=O)C1=O,0.1537
NC1=CC(=CN1)C1CN1,0.2317
c1nnc2n1nn[nH]2,0.2011
CC12CC3C(C1)C3(O)C2,0.317
C#Cc1c[nH]nn1,0.2288
CC#CC1C2NC2C1O,0.2812
CCN=C1OC2(C)CC12,0.2703
CCC1C2C(C)CC12C,0.3222
CC1OC(=N)CC(=O)O1,0.267
CN(C)C(CO)C=O,0.2144
CC1(COC1)CO,0.3092
CC1C(CC#N)C1C#C,0.2888
c1cc(cnc1)O,0.2118
O=CC1C2CC(=O)CN12,0.1862
CC1=CCC(C)(O)C1=O,0.1905
CC#CCC(C)C(C)O,0.2983
N#CCN1C2C3OC2C13,0.2635
CCOC(=N)C#N,0.2424
O=COC1C=CC2OC12,0.2403
Cc1c(c[nH]c1NC)N,0.2259
c1c[nH]c2c1OCC=C2,0.1656
C1COc2c1[nH]c(=O)o2,0.2305
N=C1OCC2C(C#C)N12,0.255
CC(=N)N1CCNC1=O,0.2551
CC1OC2C3C(O)C2C13,0.3139
OCC1CC(=N)OCO1,0.2783
C(C(=N)NC(=O)N)O,0.2593
OCC1CC2CCC1O2,0.3247
CC12C3C4C=CC1C4N23,0.2418
CCOC1CC=CC1,0.2647
CC(=O)C1C(O)C1C=O,0.2076
C[NH2+]C(CCO)C([O-])=O,0.2642
Cc1c2c(on1)OCC2,0.2298
CC1CCC(C1)C1CC1,0.3505
N=C1OCOC1C1CO1,0.2825
CCNC(=O)C1(CC1)O,0.271
CN1C2CC(O)C1C2O,0.2782
CCCOC1C2CCC12,0.3237
O=CCC12CC1C(=O)O2,0.2226
CC1(COC1=O)C=O,0.2182
CCCC(CO)CC=O,0.2291
OC12C3CC1(C3)OC2=O,0.2503
CN1C2C(C1=O)C2(C)C,0.2466
CC1(O)CC=CC1=O,0.1868
CCC1(CC2CC12)C=O,0.2259
OCC1(C#N)C2CC1C2,0.2996
CCCC12CCC1(C)O2,0.3242
O=C1CC23CC2(CO3)O1,0.2479
CC1(C)OC(=O)N2CC12,0.2903
C1C2C=CC3COC12C3,0.2324
CC1COC1C1(C)CC1,0.3206
O=CCC(=O)C1CN1,0.2117
O=C1CC2CC(C1)O2,0.2228
CN1C2C1C1OC2C1=O,0.2466
CC(O)C1OC(=N)C1N,0.2619
CC12C3C4C(CC14)CN23,0.3122
CCc1cocc1C=O,0.1904
O=CN1CC1C#CC#N,0.2142
N#CCN1C2C3NC3C12,0.2647
CC1(C)CC(O)C(=O)N1,0.2733
CC1OC2C3CC3OC12,0.3135
CC12CC1C1CC2C1O,0.3239
CC1CC2C(C)CC12,0.3406
OC1CC1C1NC1C#C,0.279
C1CC2OCC12,0.3159
Cc1c(non1)C(C)C,0.2551
OC1CC(=O)C=C1C#C,0.1694
COCC#CCC1CO1,0.2827
OCC1NC11C2CC1C2,0.3169
OCC(OC1CC1)C=O,0.2124
CCC1CN1CC#CC,0.2678
COc1c(nc[nH]1)C#N,0.2256
CC1CCC=CN1C=O,0.2138
CN1CC11C2CC2C1O,0.324
C1C(=C(CO1)C#N)C=O,0.163
C#Cc1cc([nH]n1)CO,0.2267
CC1(O)CC2OC12C=O,0.211
CC1OC1CC(C)=O,0.2342
CCC1CCCOC=N1,0.2567
CC(=O)C(O)(CO)C#C,0.2069
CC1CCC(=N)OC1=O,0.2559
Cc1cc(cc(n1)C)O,0.2396
CC1OC2CC1CC2=O,0.2091
CN=C1CNCCO1,0.2447
C1C(=O)C=CNC(=O)O1,0.1878
OC(C=O)(C=O)C1CO1,0.1934
COC1CC=CC1C#C,0.2621
CC1(C)NC(=O)C2CC12,0.266
NC12C3OC3C1OC2=N,0.2558
CC1(O)CC11C2CC1O2,0.2976
CC(=O)CNC(=O)OC,0.2272
CC1(CC(=O)N1C)C,0.2797
CCOCC(NC)C#N,0.2671
C#CC1C2OC3CC3C12,0.272
CCN1CC1(CO)CO,0.281
CC1CC(C1)OC(N)=O,0.3222
C1C2N1CC21C2COC12,0.3003
CC12C3CC1C3C2C#C,0.2996
CC1C2C1C1OC2C1C,0.3309
CC1C2C3CC2(O)C13C,0.3196
CC1C=CC2CCC12C,0.2579
CC12C3N1CC2NC3=O,0.2474
CCC(=O)C1(CC1)C,0.2329
CC1=CC(=O)OC(=N)N1,0.1925
CC(C#N)C(N)CC#N,0.2768
COCC(O)C(O)C#C,0.2905
Cc1nc(no1)CO,0.2527
COC1C=CC2(C)NC12,0.2329
CC#CC(=O)C(=O)N,0.1628
CC(C#N)C1COC1C,0.2851
C1Oc2c(nc([nH]2)N)O1,0.1941
COC1(C)CC2NC2C1,0.312
CC1NC2COC12C#C,0.2455
CC#CC1OCC1(C)C,0.268
N=C(NC=O)C1CO1,0.2385
NC1=CC(=O)C(O)CC1,0.1975
COC1CC(O)C(C)=C1,0.2529
OCC12C3C4CC1N2C34,0.3011
O=COCC1NC1C#N,0.2754
CN=C1COC(=O)O1,0.2675
CNc1ccc(=O)[nH]n1,0.1527
CC#CC1(COC1)O,0.2754
CC1(C)C2OC1C2O,0.3019
CCC12CCC1CC2O,0.3185
COCCC(CO)C#C,0.3015
C1CC(=O)C(=C1)C#N,0.1853
O=CC12CC1OCCN2,0.2004
OC1C2OC2C11CCO1,0.2915
CCc1c[nH]c(=NC)o1,0.2168
CC(C)N=CN(C)C=O,0.2354
CCc1cc(=O)cc[nH]1,0.2022
OCC1=CC2CC(C1)O2,0.2383
c1ccc(=O)cc(c1)O,0.1536
COC12COC1CC2C,0.3103
O=C1NC2CC3C2CC13,0.2605
CC1OCC(=O)CC1O,0.2117
CCc1c(nccn1)O,0.1991
CC(C(O)C=O)C(C)=O,0.1965
CC(=O)C(C)(O)CC=O,0.203
NCC(O)(C#C)C#N,0.2729
OCC1C2CC1OCC2,0.3051
CC(O)C1OCC11CC1,0.2989
CC1CN2CC(C2)O1,0.2912
OC1COC(CC#C)C1,0.2994
OC1=C(OC=N1)C1CN1,0.2024
COC1(CC#C)CC1O,0.2772
CN1C=C(OC1=N)C=O,0.1598
CCC1(CO)CC=CC1,0.2648
c1[nH]c2c(n1)[nH]c(=O)o2,0.2153
CN1CC(C)(C)C1C#N,0.2513
CC12CC(O)(CC1)C2=O,0.2241
Cc1cocnc1=O,0.2089
OC12CC(C1)C2C=O,0.2189
CC(=O)Oc1cc[nH]n1,0.2401
OC(CC1CC1)C#C,0.2932
CC12CC3C(CN13)C=C2,0.2236
CC12C3CN1C(=O)OC23,0.2652
CC1(O)CCC(=C1)C#N,0.2215
C#CC(CO)(CO)C=O,0.2181
CC1CCCCCC1,0.375
CCCC(C)(OC)C#N,0.3032
CNc1c[nH]c(n1)O,0.2362
CC(C)(C1CO1)C(N)=O,0.2717
O=C1CC2OCC2CN1,0.2674
c1cnc([nH]1)C#CC=O,0.1597
CCC(O)C1(C)CC1,0.3287
CC(=O)C(CO)C1CN1,0.2148
CN1CC1C1CC(=N)O1,0.2637
C#CC(CC#N)CC#N,0.2902
CCCc1c[nH]cc1N,0.2319
COC1C(OC1=N)C#C,0.2646
c1noc2n1nc(n2)O,0.22
C1CN2C3C4OC3(C1)C24,0.2824
CC12CCC3C(C1)OC23,0.3176
CCC1OC1C1CCO1,0.3221
CC1CC(C)(O)C11CC1,0.3218
C[NH+]=CN1CC1C([O-])=O,0.2545
CN1CCOC1=O,0.3025
CC1(CN1)C1CC(=N)O1,0.2836
N=CN1C=NCC1C#N,0.2167
N#CC12CC1C1(CO1)C2,0.2891
CCC1(O)C2CC2C1=O,0.2191
O=C1CC=CC2COC12,0.2044
CC1OC(C)=NC1(C)C,0.2705
CCC1C(C)CN1C=O,0.2634
N=C1CC(C#C)C(=O)O1,0.2553
CC1CCOC(C)OC1,0.3299
ON=C1CCC2OC2C1,0.2533
c1cc(c(nc1)CO)O,0.2042
CC12CC1COCCC2,0.327
CC12CCC1(O)C2CO,0.2818
Cc1cnoc1CC=O,0.205
CC12CC1C1CCC1=C2,0.2362
CC(C)C1CCOC1=O,0.2745
CCC1CC2CC1CO2,0.3155
CC1CCC11NC1C=O,0.2185
C1COC(=NCC1=O)N,0.2041
CC1OC11COC1C,0.3279
c1c(c([nH]n1)O)NC=N,0.2174
O=C1C2CC2C11CCO1,0.2066
COC(C)CC1CCC1,0.3304
CC#CC1(O)CC2OC12,0.2753
CC1OCCC(O)C1=O,0.2118
CCC#CCC(=O)OC,0.2622
CCCC1OC1CC,0.3517
CCCC(C#C)C#C,0.2954
CC1CC1(CC#C)C=O,0.2249
O=CN1CC2CC12,0.2588
CC1N=C(C)NC1=N,0.2306
COc1ccc(cc1)N,0.1884
C(C(=O)COC(=O)N)O,0.2343
NC(=O)C1(N)C(O)C1O,0.2317
COC1CC=C(C)C1=O,0.1758
CC1C2N(C)C1C2(C)O,0.2654
Cc1ccoc1CC#C,0.2338
OCC(CC1CO1)C#C,0.3106
CC12C3OC1CC23C#C,0.2592
N=C1NC(=O)C2CC2O1,0.2406
Cn1cncc(c1=O)N,0.1766
NC1=CNN=C1C1CO1,0.2159
CC1(C)C2COC(=O)N12,0.2809
CC1=C(CO)OC(=N)N1,0.2121
CCC(=NO)C#CCO,0.2031
CC(O)C1NC1C1CC1,0.315
OC1CN2CC1(C2)C#N,0.2639
CC1C2C(O)C(C#C)N12,0.2542
CCCc1cc[nH]c1N,0.2458
CC1(COC1=N)C1CO1,0.289
CC1OCC(C)=C1C#N,0.2074
ON=C1CC2CC1C=C2,0.2354
Cc1cc(n(c1)C)O,0.2397
CC1C2COC(C)C12C,0.3231
O=CC12C3CC1C1C3N21,0.2004
c1c(cn[nH]1)C#CC=O,0.1805
CC12C3CC4CC(C14)N23,0.3021
N#CC1CCC(O1)C#N,0.2995
C1C2C3C1CN23,0.3294
CC1(CO1)C(=O)C1CC1,0.2205
CC12CC3CC(CC13)C2,0.3516
C[NH2+]CC1CC1C([O-])=O,0.2687
C1CC(=O)OCC=C1,0.2469
CC12CC1OCC=C2,0.2468
C1NC2=NCCN3C1C23,0.2022
CCC1(CC1C#C)C#C,0.2621
CC1=CC(=O)CCC1=O,0.1641
O=COC1OCC2CC12,0.2795
C1COCC1(CO)CO,0.3033
OCC1CCC(=O)C1O,0.2175
OC1CC2C(C#C)N2C1,0.2552
CC1OC1C(=O)C(N)=O,0.1686
O=C1CC2CCC1OC2,0.2088
CNc1cc([nH]c1)C#C,0.1818
CC12CC3C1N2C3=O,0.2505
CC1CC2CN(C=O)C12,0.2645
Cc1c(oc(=O)[nH]1)N,0.2393
C1C2OC3CC(C3)C12,0.3133
C#Cc1ncoc(=O)n1,0.1849
O=CC1=CCCN2CC12,0.1704
CC(O)C1C2CC1C2O,0.3299
c1c(cn[nH]1)OC2CC2,0.2333
C1C2CC1C1=CN=NN21,0.2506
CN1CC11C2OC1C2=O,0.2259
C1CC12CC(C2)NC=O,0.2801
CC12CC(C1)C2(N)C#N,0.2925
CC1OCCCCO1,0.3287
COC(CO)C(C)=O,0.2198
C1OC11C2C3CCC1C23,0.3315
CC1=C(C[NH3+])OC=C1[O-],0.0772
CCCCC1(C)OC1C,0.3423
CC1NC1C1OCCO1,0.3266
CC1=CC2CC2C1=O,0.1907
CC(O)C12CC1(O)CO2,0.2954
OC1CN=C2OCC2C1,0.2648
CC12CC(O1)C2NC=O,0.2752
CC12CC(C1)C2(O)C=O,0.2157
O=C1CCCC(O1)C#N,0.2677
CC1CC11N2CC2C1=O,0.2211
CC1CC2OC(C1)C2=O,0.2264
CCCC1C(C)C1(C)O,0.3126
CC(CO)C#CC#C,0.2309
OC12CCC1OC2=N,0.2821
OCC1OC2C3CC2C13,0.3353
CC1=CC2OC1C=C2C,0.2018
OC12CC3C(C=C1)C23,0.2411
Cc1c(=O)nnn(n1)C,0.1645
C1C=CC23NC4C2OC134,0.2267
CN1CC11C2C3CN2C13,0.3
OC1C2NC2(C#C)C1O,0.2575
CC1C2CC3(CCC13)C2,0.3493
C#CC12COC1C1NC21,0.2644
CC(O)C1(C)OC1C#N,0.276
CC1C2CN3CC1(O)C23,0.2711
Cc1conc1C(C)C,0.2485
CC(O)C(C)(C)CC#C,0.3078
O=C1C2OC3C4C3N1C24,0.2014
FC1=NC(=N)C(F)=NO1,0.2093
CC1(C)N2CC1(C2)C#C,0.2722
CN1C(=O)OC=CC1=N,0.2135
CCCC1(O)COC1=O,0.2608
c1nc(c(o1)C#N)CO,0.2118
C(=O)c1c(nc(o1)N)N,0.178
C1C2C3C4C3C3C4C3N12,0.2768
O=CCC12CCC1O2,0.2203
O=COC(C=O)C1CN1,0.2072
CC(CO)OCCCO,0.328
CNC(=O)OC,0.3158
[NH3+]C(CC1CO1)C([O-])=O,0.2704
CC(C(C)=O)C1(C)CN1,0.2247
CC1OC(CC=O)C1=O,0.208
CC12CC1(OC2)C=O,0.2097
CC1NC11CC(O)C1O,0.292
CN1CC11COC1CO,0.2942
CC(C)CCC#CCO,0.2776
O=C1NC(=O)C2OC12,0.224
C1OCC2OCCCC12,0.3275
CCC1(COC1)CC=O,0.2269
CCN=C1CCC(C)O1,0.2718
OC1CC2C=CC1C2O,0.2564
C1NC11C2C3CN=C1N23,0.186
c1c(=O)[nH]ncc(=O)n1,0.1699
CC(=O)C1COCO1,0.2204
CC1CC(C)C1=NO,0.2489
[NH3+]C1CCC=C1C([O-])=O,0.2158
Cn1cc(nc1)O,0.229
CN1C(=N)OCC1=O,0.2512
CC1=NNN=C(C)C1=N,0.1792
OCC1CC2C(O)CC12,0.3171
CC1CC1(C)C(N)C#N,0.2811
C#CC(=O)N,0.2352
CN(CC1(CC1)O)C=O,0.2665
OC12C3CC1CC=C2C3,0.2142
OC1(CC1C=O)C1CO1,0.2265
OC1CC1CCCC#C,0.3145
C#CCCCC1CC1,0.3148
CC(CCO)C#CC#C,0.2316
OCC12NC1C(=O)C2O,0.2012
CCC1(O)C2CC1C=C2,0.2393
OC1=CC(=CN1)C1CN1,0.2373
OC1CNC(=O)CC1=O,0.2173
CCc1cnc([nH]1)C#N,0.2037
C1C(CC1=O)CO,0.2227
CC1(OCC1C#C)C=O,0.213
CC(=O)C(C)(CO)C#C,0.2227
CCC(C=O)C1(C)CC1,0.2191
OC1C2CC(O)COC12,0.2863
C1C(=O)NC(=O)OCO1,0.2343
CC12CC1(C)C1(CC1)C2,0.3165
CC12NC1C1C(O)CC21,0.2917
CC1NC(=O)C1(C)C=O,0.2145
CC1CCC=CCC1=O,0.2155
NC(=O)C12CC(O)C1O2,0.2587
CC(=O)C1CC2NC2C1,0.2354
Cc1cc(n[nH]c1=O)N,0.1612
CC1C(C)N1C(=O)C=O,0.1711
CC#CC12CC1CC2C,0.2638
CC(C)C1C(C)CC1C,0.345
CC1CC(C)(CO1)C=O,0.2226
CN1C2CCC1C21CN1,0.2863
COC(C)CCC1CO1,0.3362
Cn1c(cc(=O)nn1)F,0.1741
COCC1=NOC(=N)O1,0.2345
CC12OC3C(CC13)C=C2,0.2388
Cc1c(c([nH]n1)N)C#N,0.2286
CC(C=O)C1CCOC1,0.225
c1cc(ncc1C=O)N,0.1779
Cn1c(=O)oc(n1)OC,0.2573
O=CN1C2CCCC12,0.2563
CC1COC(CO)C=C1,0.261
c1c(ncnc1N)C=O,0.1745
CC1C(NC=O)C1C=O,0.2254
CC#CC12CCCC1O2,0.2724
c1cc2c(nc1)C=CC2,0.1953
CC1CN2C3CC1(C)C23,0.3095
CC(C)(C#N)N(C)C=O,0.2701
COC1COC(=N)C1=O,0.17
CN1CC1C1(CN1)C=O,0.1949
CC1=C(C)C(=N)N=CN1,0.1946
CC12CC3(O)C(O1)C3O2,0.2938
CC12CCC3OC1C23C,0.2985
COCCc1cc[nH]c1,0.2503
CC12CCC(CC1)C2O,0.3083
CC1CC11CC(C1)=NO,0.2469
CC1C2CC3OC1C23,0.3142
N=C1OC2CCC2C=C1,0.2112
OCC1N2CCC12C=O,0.2111
C1C2OC3=NCCN1C23,0.2236
COC1OCC2CC1O2,0.3213
CC1CC2(CO)CC2O1,0.3148
C1C(CC1(C#N)C#N)O,0.2838
CCC1C=CCC1C#C,0.2609
CC12CCN1C2C#N,0.2636
CC1C2OC3(C)C2CC13,0.3273
Cc1cc[nH]c1C=O,0.185
C#CCC1CCCCO1,0.3045
CCOC(=O)C(O)C#C,0.2615
OC1CCC2=CCCC12,0.2495
COCC1(O)CC1C=O,0.2241
CC1=C2C(O)CN2C=C1,0.2389
CC#CCc1cocn1,0.2455
Cc1nn2c(o1)ncn2,0.2352
CC(=O)N(CC#C)C=O,0.2334
C#CC(=N)N(C=N)C=O,0.2
c1cn[nH]c1C2CC2,0.2455
CC1=NC2(CC2)CCO1,0.2575
O=C1NC=C2CCOC12,0.1995
CCC(C)OCC1CC1,0.3325
COC(CNC=O)C#C,0.2725
OCC1C(O)C(=O)C1O,0.2144
C(C1CO1)C12CC(C1)O2,0.3223
COCC1C2NC(=O)C12,0.2535
CC1(CC1C#N)C=O,0.2271
CC(=O)C1OCCCO1,0.2275
OC1C2CC1(O)C2,0.3275
CC1=CC2N=COC2C1,0.2539
CCC1C2CC1C(=O)O2,0.2751
CC1CC2=C(O)N=CN12,0.2297
OC12CC3C(C1)C3OC2,0.2916
CC(=O)NC1CCC1O,0.2755
CCOC(C)CN1CC1,0.3143
CC(C#C)C(=O)C(N)=N,0.1902
CCOC1CC2NC2C1,0.3094
CC12C3CC1CC23CO,0.3077
CC1C2NC(=O)NC12,0.2822
CCC1C2COC1C2C,0.3214
NC1C(OC1=O)C1CN1,0.2429
COC(CC#N)C1CN1,0.297
CC12C3C(=O)N1CC23O,0.2394
C(COCC#N)NC=O,0.2581
COC(=N)C(CN)C#N,0.2665
N=C1OC(=O)CC1C#C,0.2596
CCC(C)(O)C(N)C#N,0.289
CC12CC3(C)OC1C3N2,0.3063
CNC(=O)NC1CC1O,0.2862
c1cc(n2c1CC2)C#N,0.2084
CC1CC2(O)C1C2(C)C,0.313
CC1C2CC=CC12C#C,0.235
CCc1[nH]c(=O)ccn1,0.1963
C1CC(=O)C2(C1)CC2,0.2231
c1coc(=O)cn1,0.1722
C1CN1C12CCC1OC2,0.3003
OC1C2CNC(=O)OC12,0.3039
COC1CC2CC12C#C,0.2711
CC#CC1C2CC1(C)O2,0.2744
O=C1CC23CC12OC=N3,0.2187
CC1CC2NC3COC123,0.2735
OC1CC1(NC=O)C#C,0.2492
c1c(onn1)NC2CC2,0.2105
CC1CC1N=C(N)C=O,0.1691
CC1CC2=NC(C)=CN12,0.2488
CC1C2C=CCC(O)C12,0.2485
CCOC1CC2CCC12,0.3195
CC12OC3C(C13)C21CN1,0.2922
O=CC12C3CC1CN23,0.2179
CC(C)(C)C1CC(=N)O1,0.2879
CC(=O)C1COC11CC1,0.2094
CC12OCC11OC2C=C1,0.2247
c1c(c2c(o1)[nH]cn2)N,0.2144
CNC12C(N)C1OC2=N,0.2448
c1cc-2ncnc2[nH]c1,0.1762
CC1(CN1)C1OCC1O,0.3125
CC1=CC([O-])=CC(=[NH2+])N1,0.2017
CCC(C)COC(C)C,0.331
CNC1C2OC1C2C#N,0.2458
CC1CC2(CCO2)C1C,0.3068
N=COC(C#C)C1CC1,0.2811
C1CN(C1=O)CCC=O,0.2151
CC(O)C1=CON=N1,0.2312
CCC1CC2CN2C1=O,0.2372
FC(F)(F)C1CC1C=O,0.2277
C1CC23C4C5N4C2CC135,0.2771
CC1C2CC2C1N1CC1,0.3119
CC(=O)Oc1ccco1,0.2193
CC1N2CC11CC(=O)C21,0.1887
C#CC1=CC2C3OC1C23,0.188
Cc1cc(=NO)cno1,0.1618
CC(=N)OC(=O)CCO,0.2436
CC12CCOC3C(O1)C23,0.2888
CCC1CN1C1CC1C,0.3094
CC(=O)NC(=N)N,0.2272
OC1COCC2CC1O2,0.317
C1C2C=C3CCOC3C12,0.2374
CC(C#C)N(C=N)C=O,0.2324
C#CC1C2NC1C2C#N,0.2721
C#CC1=CC2CC(C1)O2,0.1986
CC1(C)CC11CC2CC12,0.3205
CC1(O)CC(=O)C1(C)O,0.2057
CC1C(=O)CC1(C)C#C,0.2194
CC1=CC2(NC2C1)C#C,0.2312
O=CN1CC(C=C1)C#C,0.2095
CC(C)(CO)C(O)C#C,0.294
CC#CC(C)(O)CC#C,0.2837
c1cnn(c1O)CC#N,0.2415
CC1C2CC(O2)C1(C)O,0.3069
C(=N)NC(=O)C#CC#N,0.1767
COC(=O)N1CC1C#C,0.2718
OC1C(OC1=N)C1CO1,0.2833
CC1CCC1CCO,0.3427
COC(C)C(OC)C=O,0.2155
CCC1=NC(=N)OC=N1,0.1909
CC1OC2CC(=O)C12,0.2167
O=C1CC=C2CCC2N1,0.2415
CC1OC(C#N)C1(C)O,0.2718
[NH3+]C(COC=N)C([O-])=O,0.2442
CC(=O)C1=NCCCO1,0.1913
CC1COCC2CC1O2,0.3212
[NH3+]C12COC1C2C([O-])=O,0.2359
CCC1=CCCN1C=O,0.2103
CC12C3CCC1C1C3N21,0.3148
CC1NC(=O)C1C1CN1,0.2711
CCC1(CCC1)NC=O,0.2752
COCC(O)C1CO1,0.3401
CC1OC(C1O)C(C)=O,0.2188
COC1C=CC2C1N2C,0.2207
CN1CC2OCCCC12,0.2958
Cc1c(cc([nH]1)O)O,0.2306
Cc1c(c(c[nH]1)N)O,0.222
OC(C=O)(C#N)C1CO1,0.2207
CN1C2CC3(C)CC2C13,0.294
CC(C=O)(C=O)C=O,0.2049
CC1=C(C)C(=N)ON=N1,0.1636
C1CC1C#CC#CC=O,0.1709
CC(=O)c1cnoc1,0.2059
CNC1=CN(C)C(=N)O1,0.215
CC1CC2CC(=O)C2O1,0.1943
CC#CCC(O)C1CC1,0.2947
CC#CC1CC(=O)N1C,0.2731
CC1OCC=C(C)C=C1,0.1916
N=C1OC2C3COC1C23,0.2649
C1CC1(C#N)C#N,0.2924
N=C1OCCCC1C=O,0.2289
CC1C2C1C(=O)CN2C,0.1936
COC(C)C1(C)CCO1,0.3185
COCC(O)C1NC1C,0.321
CC(CC=O)(CO)CO,0.2087
CC(=NO)C#CC=O,0.1711
CCCc1c(con1)C,0.2482
O=C1CNC1C#C,0.2135
CC1C(C)C1C(C)=O,0.2276
CN1CCOC2CC12,0.2883
CCOC(=O)CO,0.2869
CCC1(CC1)CC1OC1,0.3377
CC(O)CC1CC(C)O1,0.3101
OC1(CC#C)CC=CC1,0.2642
Cc1ccc([nH]1)C=O,0.1798
CCC1(CO)CC1C#C,0.2869
C#CCC1C2C3CC1N23,0.2933
N=C1NC=CC(=O)N1,0.1974
OCC1CC2OC2C=C1,0.2469
CCN1C(C#N)C1C#N,0.2528
C1OC1C1CN=CO1,0.2724
CC(C#N)C1CN=CO1,0.2724
c1cnc-2cnn[nH]c12,0.1533
CC1OCC(O1)C#N,0.293
Cc1ccc(cc1C)O,0.2151
OC1CN2C3CC3C12,0.2707
N=C1CC(O1)(C#C)C#C,0.2541
O=CC12CC3C=CC1N23,0.1883
CC1=C(C)C2OC1C2=O,0.2433
N#CC1=CC2C3CC1C23,0.1996
COC1C2CN3C2C13C,0.3157
CCN=C1C(=O)CCO1,0.1843
CC12CC3OC1C2CO3,0.3169
CC1CC(=NO)C1C,0.2495
CCC1(CCC1)OC=O,0.2767
OCC1CN=C2OCC12,0.2652
N=C1OC(=O)C=NC=C1,0.1613
[NH3+]CC1=NC=NC=C1[O-],0.1989
CC1CCC2=C1NN=N2,0.2379
CC#Cc1[nH]cc(n1)O,0.1844
CC12CNC(=O)C1CO2,0.2682
CC1C(O)CCN1C=O,0.2655
CC1C2C3C1OC23C#C,0.2433
CC(O)CC(C)(C)CO,0.3175
CN1C2C3OC3(C#C)C12,0.2439
CC12COC1CC=CC2,0.2567
CC1OC1C1CCCO1,0.3284
CN1C2CC(N)(C#N)C12,0.2697
COc1c(=O)ncon1,0.1959
O=C1C2OCC11COC21,0.2101
COCc1[nH]c(cn1)N,0.2339
CCC(C)C1CC(=O)C1,0.2231
OCC1CCCCOC1,0.3143
COCCCC(O)CO,0.3152
COC1CN2CC2C1C,0.294
Cc1nccnn1,0.1633
OC1CC2CC(C2)C1O,0.3062
CC(C)C1=CC2NC2C1,0.2434
NC1=CC(O)=NOC1=N,0.1705
OC1CN=COC1C#C,0.2636
CCC(=O)C1CN=CO1,0.2225
CC1OC(C#N)C2NC12,0.2819
CN1C2C3NC2(CO)C13,0.2676
CC12CC1(C)C(C2)C#C,0.2953
OC1CC11CC2OC2C1,0.3274
OC1CNC(C#C)C1=O,0.1991
N=C1CC(=O)COCO1,0.2138
CC1CC=CC1C=O,0.2088
c1nc2c(o1)nc([nH]2)N,0.1956
CN1CC1C#CC#N,0.2032
N=C1OCC11NC1C#C,0.2549
N#CC1=NC2CC2CO1,0.2087
Cc1cnc([nH]1)CC#C,0.2436
NC(=O)OCC1CCO1,0.3066
c1c(nc(=O)on1)CO,0.1704
OCC1C2C3CC2(O)C13,0.328
Cc1cn(nc1C=O)C,0.1978
CC1CC(=N)OC2CC12,0.27
CC1OC(C)(CO)C1C,0.3164
C1OC23CC(C2)C=CC13,0.2418
CC12CC(=O)C(CO1)O2,0.217
CNc1c([nH]c(=O)o1)N,0.2369
CCOC(=N)COC=O,0.27
OC1=NC(=N)NC=N1,0.186
COCCC1CC1C#N,0.2895
OCC1C2CCC12C=O,0.2258
Cc1cc(c(=O)[nH]n1)N,0.1777
CC1C(O)C1C(O)CO,0.2944
c1cnc(cc1C#N)N,0.1724
C(#N)C(=O)C(=O)C(=O)N,0.1419
CC1C2CCC(=O)NC12,0.2671
CC1=CC2(CC2)NC1=O,0.2105
CCOC1CCC1CC,0.3263
COC(C)C(=O)C#N,0.1931
OCC1CC2CC3C2C13,0.3298
O=CC1CC11COC1,0.2247
COC=NCC(C)C#N,0.2677
C1OC23CC4C(CC124)C3,0.3147
OC12CC1C1CC2C1,0.3266
OC1CCC2=C1ON=N2,0.2111
CC1(C)CC2C3CC3C12,0.3111
CC1CCC(C)=CCO1,0.2488
c1c([nH]c(=O)o1)N2CC2,0.2375
C1COCC(CO1)O,0.3107
COC1C(NC1=N)C#C,0.2631
O=C1CC(N1)C1CO1,0.2834
C1CC1OC(=O)CCO,0.2817
Cc1ncnc(=O)o1,0.203
C#CCCC(F)(F)F,0.3188
C1CC2=C(C1)C(=O)NC2,0.2219
O=C1COC11C2CC1O2,0.1947
C#CC1(CN1)C1COC1,0.2692
CNC1(CC2CC12)C#N,0.2661
CN1CCC1(C#C)C#N,0.2382
CC1C2C=CC1(C)C2O,0.2397
C1OC2C3OC1C2C=C3,0.2342
CC1C2CC3CC3OC12,0.3275
OCCCCCC1CO1,0.3426
CC1(C)C2CC1O2,0.3264
Cc1cc(c([nH]1)N)C#C,0.2049
O=CNC12CC1OCC2,0.2567
CN1C=NC(=C1)C1CO1,0.2423
COC12C(C)C3C1CC23,0.3333
CC1(OC=N)C2COC12,0.2626
NC1=CN=C(O)C(=N)O1,0.1545
CNC(=O)C12CCC1O2,0.2603
c1c(c[nH]c1C#N)C=O,0.198
COCC1C(C)OC1=O,0.2743
CC12COCC(=O)C1N2,0.2093
O=CCC1C2OC2C1=O,0.2049
CC1(CC=O)C2CCN12,0.2116
CC1CC1C1OCC1C,0.3228
OC1CC(=O)C1C#N,0.2234
CCCC(C)OCCO,0.3322
C1N=C2OC3C=CC1C23,0.2225
CC12C=CC3CC1N23,0.2166
CC1C2CC(O)C1C=C2,0.2536
N#CC1OCC(=C1)C#N,0.2155
CCCC1COC11CC1,0.3019
c1nc(nc(=O)o1)O,0.2197
CC12C3NC1C3OC2=N,0.2659
c1cocc1CO,0.2415
CC(O)COCC=O,0.2283
CC1CC2OC=NCC12,0.2705
C1CN(C1)CCC#N,0.2686
CC(C1CC1)C(C)(C)C,0.3478
OC12CC1C1CC2C=C1,0.2475
CC12OC1C1NC2C=C1,0.2365
CC1CC2C1C(C)C2=O,0.2174
CC1=CC(OC=N)=NN1,0.2366
c1c(c[nH]c1CC=O)O,0.1641
CC1OC2CC(O)C1C2,0.3011
c1(=O)[nH]c(=O)[nH]c(=O)[nH]1,0.2681
CC1OC2C3C1C2N3C,0.3019
CC1C2C(C)C1C2=O,0.2494
CC12C3CN1C3C21CN1,0.2938
CCn1cncn1,0.2717
O=CC1C2CC(=O)OC12,0.2203
C1C(=O)COC(O1)C=O,0.2077
CC1CC11N=COC1=O,0.2365
CCC(C)N1N=CN=N1,0.265
CC(O)C12NC3C1OC23,0.2872
C#CCN1C2CC=CC12,0.2327
CC(O)C1=CNN=C1N,0.2378
CC#CC12CN3CC1C23,0.2581
Cc1ccc(cc1F)N,0.2074
CC(=O)C12CC1CCO2,0.2248
OCC1CC2(CO2)C1O,0.3073
c1c(c(=O)c(n[nH]1)N)O,0.1647
C#CC1C2CC1CCC2,0.3014
CCC1C(C)C=CC1=O,0.1897
CC1OC2(CC2)C2OC12,0.3221
C1CCC(C1)CC=O,0.2288
CC12CC(=O)C(O1)C=C2,0.1999
CCC1(CCO1)C(C)=O,0.2159
CC1OCCN=CO1,0.26
c1c(cnc(c1N)F)N,0.187
CNC(=O)C(C)CO,0.2765
CC1C=CC2NC12C=O,0.2092
CC12C3CN1C(C#C)C23,0.2668
NC1=C(C[NH3+])OC=C1[O-],0.1132
C1OC2C1C1=CCOC21,0.2208
CC1(C)CC1CCC=O,0.227
CC1CC=C(C)CC1C,0.2618
CCc1c([nH]nn1)OC,0.2374
C(C=O)C(CO)(CO)O,0.2053
CCCCC(O)CCC,0.3321
CCCC(C=O)C1CC1,0.2244
CN1CC1C#CC=O,0.1829
CNC(C)C(=O)C#N,0.1673
CC1(C)OCC1N1CC1,0.3181
CC(O)C(C)OCC#N,0.274
C1C2C3CCCOC1C23,0.3181
C#Cc1c(cc[nH]1)CO,0.1992
CC1OC=NC1CC=O,0.2234
CCc1c(nc[nH]1)C=O,0.2038
OC12CNC1C(=O)CC2,0.2025
CC1CC(O)(C#C)C1O,0.2752
CC1OC(=O)C1CO,0.2781
CN1CC(=O)C1C1CN1,0.2068
CC1C2(O)C3CC3C12O,0.2796
CC1(C)C2C(=O)NC12C,0.2506
CC1(C)CC(O)C1C#N,0.2984
CC1CCC(C)OC1,0.3224
CC1C2OC2C(=O)C1O,0.2106
OCC1C2C3C4C3N1C24,0.2902
CC12CC1OCC(=O)C2,0.2107
OC12CN(C1)C2CC=O,0.2274
CC12C=CC3C1CCN23,0.2242
CC(O)CC1(O)CCC1,0.2978
C#CC1C2OC2C11CC1,0.2886
C#Cc1ncc(cn1)O,0.1933
C#CC12OC1CC=C2,0.2365
CN1CC2(CC2C#N)C1,0.2505
CC(=O)C1OCC1C=O,0.1976
CC1C2C(C)C1C2(C)C,0.3653
C1C2CC1CC2,0.3879
O=CCC1CC=CC1,0.2237
O=C1CC2(OCC12)C#C,0.2161
c1cocc-2ncnc12,0.1764
Cc1c[nH]cc1C(=O)N,0.2149
CC1=C(CO)C2CC1C2,0.2341
CCC#CC#CC(C)O,0.2205
N=C1NN=CC(=N1)C#C,0.1353
OC1CC11COC1,0.3113
COC1(COC1)CCO,0.3197
[O-]C(=O)C1CCC(=[NH2+])N1,0.2489
OCC12C3CC(C13)C2O,0.3054
O=COCC1(CO1)C#N,0.277
OC12CC1N1C=CC=C21,0.2166
CC1C[NH2+]C1(C)C([O-])=O,0.2639
Cc1c(nn(c1O)C)N,0.2399
C1CN=C(NC=C1)C=O,0.1501
CN=COCCC#C,0.2733
CCC(C#C)C(N)C#N,0.2914
CNC(=O)CC1OC1C,0.2736
CCN=C1OCC(C)=C1,0.2057
CC(C)(O)C1CO1,0.3459
C(#N)c1nc(=O)onn1,0.1453
C1C2OC2C2=CNC=C12,0.2442
O=CC12C3C1C1OC3C21,0.2184
CC12CC1C=CC2=O,0.187
C#Cc1c(nno1)N,0.1683
c1c(c(on1)C(=N)N)N,0.1747
CC1C2NC2C1(C)C=O,0.2136
CC1(CC(=O)C=C1)C=O,0.1936
CC1C2(C)OC1(C)C2C,0.3145
CC1(C)CN=C(N1)C=O,0.1648
CN1CC(C#C)C1C#N,0.2481
CC12CC1(O)CCC2=O,0.2255
O=CC1CC(=O)CCN1,0.2003
c1cc(oc1)OC2CC2,0.2308
C(C=O)N(C=N)C(=O)N,0.2227
CC12NC1C1CC(=O)C21,0.2059
OCC1CC(CC#C)C1,0.3118
C1CC2OC=NC2C=C1,0.2516
COC1CC(O)CC1O,0.3015
CCC12COC3C(O1)C23,0.2887
CCC#CC1CCC1=O,0.209
CN=CNC(=O)COC,0.2307
CCC1OC1C(=O)C=O,0.1503
OC(C#N)C1CC(O)C1,0.2888
OC1(CC2OC12)C#N,0.2779
O=C1C2CC3C2CC13,0.2269
C1C23COCC12COC3,0.3413
c1cnn(c1)CCC#N,0.2575
OC12C3C1C1=NC2C3O1,0.1377
CC1C=CC2C1C2(C)C,0.2435
CC(=NO)C1CN1C=O,0.2325
O=C1OC2CC3(CO3)C12,0.2746
COCCC1COC1C,0.324
CC(O)C1(C)C(C)N1C,0.2825
CC(O)C1(O)CC1O,0.3066
N#CC1CC2CN12,0.2653
CC12CC3=CCC1C23,0.177
OCC1CC2CC1C2O,0.3159
CC(=N)OC1CC1O,0.2696
CC(=O)C1COC1,0.2302
CCC(C)NCC#N,0.2675
OC1COCC11CCC1,0.3124
O=C1CC2NC2C=C1,0.1849
N#CC12C3NC1C1C3N21,0.2433
O=CN1C=NC2CCC12,0.218
C(#N)c1nc(on1)C#N,0.2161
N=C1OC(=O)C2CCC12,0.2594
CCC1CC(=O)C11CO1,0.2046
O=C1NC23CC(C2)C3O1,0.2984
C1C2C3OCC4C3C2N14,0.2914
CC#CCCCCCO,0.3041
CC1=C(C(=O)CCC1)C,0.1926
CC1CC2(CO2)C(C)=C1,0.2486
C#CCC(=O)C(=O)C#N,0.1406
CCCN1CC(O)C1=O,0.267
CCCC#CCC1CN1,0.2922
O=C1NCCCC2NC12,0.2539
CN1C2C1C1C2N1C,0.2548
COCCC1CC2CC12,0.3369
CC1C2COC1(C)C=C2,0.2485
ON=C1CN2C3CC3C12,0.2211
N#CC1CC2=NC=NN12,0.2579
O=C1NC2CC2OCO1,0.2914
C#CC12NC1CC2C#N,0.2513
Cc1c(nc(o1)N)C#C,0.199
C1C2C=C3CC4C1C2C34,0.1988
C1OC23CCN4C2C1C34,0.3138
C1OC1C1=CC2CC1C2,0.2224
Cn1c(=O)[nH]c(n1)OC,0.2528
COC1(CCC1)C(=O)N,0.2604
CC1C2C3C(O)C2C13C,0.3133
CC1OC1(CO)C1CO1,0.3388
COC(C)(C)C(O)CO,0.3157
CC12NC1C1NC21C,0.2696
CC1CN1C1(C)COC1,0.2979
[NH3+]CCN=C1[N-]N=NO1,0.1996
CCC1CC2OC1C2O,0.3344
c1c(c(cnc1F)F)F,0.2225
CCC12CC1C(O2)=NC,0.2719
OCC1C2NC1C21CO1,0.313
CCC(O)C1(C)CO1,0.3458
NC(=[NH2+])C1=NC=N[N-]1,0.177
CC(C)C(O)C1CC1C,0.3258
C1C2C3C=C4CCC13C24,0.1564
O=CCCC1C2CCN12,0.2099
CCC(=O)CCOC,0.2353
CC1C2N1CCCC2=O,0.2041
c1cnccc1CCO,0.2297
C(C(=O)N)OC(=O)N,0.2752
CC12CCN1C(C2)C#N,0.2521
CC(C)C1CC1(O)C=O,0.221
CC1=CC2COCC1O2,0.2423
CC1C2OC(=N)C12C#C,0.2561
CC1=CC(CC1O)=NO,0.1918
CC1(C=O)C2OC=NC12,0.2253
CC(CC(C)=O)C(C)=O,0.231
CC1(C)C2C3C(N13)C2=O,0.2287
CN1C2CC(O)C2C1=O,0.2654
CCC1=C2CCC2OC1,0.2329
CC12CC1C1=NC=CN21,0.2247
CC1C2C(O)CC(=O)N12,0.2381
CC1=CC2NC2C1=NO,0.1893
CC1COC1(C)C1CN1,0.3123
CC(=NO)COCC=O,0.216
CN1CC12CN(C2)C=O,0.2636
CC1C2NC3(C)C2OC13,0.2974
CC1C2C=CCN2C1=O,0.2431
CC12CC1OC2(C)C,0.3088
CN1CC2COC(=O)C12,0.2226
[O-]C(=O)CC1CC[NH2+]1,0.2734
CC1OC(=O)C11COC1,0.2603
OCC1CCC1CC#N,0.3109
CCCN=C(C)OC,0.2765
CCC12CC1C(=N)OC2,0.2783
O=CC1C2OC2C1C#C,0.2143
CC1CC2(CC2O1)C#C,0.2821
CC1OC11CCC=C1,0.2508
CC1(CN1)C#CCC=O,0.2178
CC1CC(=O)C(C)(O)C1,0.2172
OC(CC=O)C1(O)CC1,0.2286
N=C1OCC2C3CC2C13,0.2768
CCn1cnnn1,0.2672
C#CC1CC1CN1CC1,0.2804
CN1CCC(C)(O)C1=O,0.2736
CC1C2OC3C2N1C3=O,0.2083
OC1C=CC2NC2C=C1,0.2359
O=C1CCC(CO1)C#C,0.2704
CCC(C)C12CC1CC2,0.3254
CC(C#N)N1N=CC=N1,0.2564
COC12CCC1CC2C,0.3128
CC(=N)OC1CC2NC12,0.2656
C1COCCC=C1,0.2529
ON=C(C#C)C1CC1O,0.1879
C#CCC1NC11CCC1,0.2975
CN(C)Cc1nc[nH]n1,0.2134
CCC1CC1OC(C)C,0.3134
CC#CCn1cccc1,0.2358
CC(O)C(C)C#C,0.305
CN1CC2NC(=O)C12C,0.2326
CCCC1(CO)CC1C,0.3284
CCC1CCC1C1CC1,0.3447
c1nnnn1CC(=O)N,0.2627
CC1=CCC2CC1C2,0.251
CN1CC1C1CC2OC12,0.3028
CCC12CCC(OC1)O2,0.3246
OCC(=O)C1CC(=O)O1,0.2301
N=C1NC2=C(COC2)O1,0.2272
CC(=O)C1OC1CC=O,0.2082
OCC(=O)C1OCC1=O,0.2077
CC(=N)OCC(O)C#N,0.2769
CCOC=NC1CC1,0.2512
CCC12CCC1CC2,0.3352
COC1(CO)C2CC1N2,0.2759
CCc1nccn1C,0.245
CC1(C)OC1CO,0.3399
[O-]N=C(C=O)C1C[NH2+]C1,0.122
CN1C2COC3CC2C13,0.2822
CC(O)(CC#C)C#N,0.2893
CC1=CCc2c1c[nH]c2,0.2033
O=C1OC2C3NC2C13,0.2386
CC(C)CC1(CC1)C=O,0.2321
CC12CC3(CCC13)OC2,0.3
N=C1OCC2OC1C=C2,0.2363
COCCCCCC#C,0.3103
CN=c1c(cnco1)N,0.1663
CC(=O)C(C#C)C(=O)C,0.2111
CC1=CC2CC(C)(C1)O2,0.2405
O=COC1COC1=O,0.2635
CC(C)C1CCC(O)C1,0.3337
CC#CC1OC(=O)C1O,0.2544
CC1CC(=O)C2CC12,0.2266
CC1CC(O)C(C1)=NO,0.248
CC(COC)(COC)O,0.3342
CCC1N=COC2CC12,0.2684
OC1CCOC(=N)C1,0.2774
CCC12CC(=O)CC1O2,0.2269
CC1(CN1)C1OC1C#C,0.2617
FC1=NOC(=O)C(=N)O1,0.2057
CC12CC1OC1CC21O,0.294
ON=C1CC2CC(C1)O2,0.2473
CC(C)(O)C(N)C#N,0.2837
O=CCCC1CCC1=O,0.2147
OC12C3CC1NC23C#N,0.2503
CCC1=C(COC1)CO,0.2382
CC1C2C(O)C3CC3N12,0.2726
OC(C#C)C#N,0.2821
CCN1CC(OC)C1=O,0.256
COC1(CC1C)C(C)C,0.3277
CCCCCNCC#N,0.2701
C1CC12CC(C2)O,0.3356
CC(C)C(C(C)C)O,0.3261
CC12CC3(C#C)C1CN23,0.256
CC12CC(C1)OCC2O,0.3052
CCCC1COCC=C1,0.2639
O=C1C2C3C4C3N2CC14,0.2135
N=C1N=NON=C1C=O,0.1558
CC12NC1CC1(O)CC21,0.3056
COCC1(CN1)C1CN1,0.3054
CC12CC1(O)CC2C#C,0.2946
CC1NC1(C=O)C=O,0.2078
NC(=O)C1OC1C1CO1,0.2623
CC(O)C(O)CC(C)=O,0.235
OC1CC1CC(=O)C#C,0.2051
OC(C=O)C(=O)NC=N,0.2078
CCc1c(c(n[nH]1)N)C,0.2318
CC1NC2C1=CNC2=O,0.1942
N=CN1C2CC2OC1=O,0.2408
CC1C2CCC=CC12C,0.2491
CC1=CC23CC4C2C1C34,0.2196
CN=CNC(=O)N(C)C,0.2458
c1c(nc2n1CC=C2)N,0.1548
CC1=CC2COC1CO2,0.2497
NCC1=NC(=N)NN=N1,0.1594
C1NC1C1=CNC=N1,0.2465
CC1CC2OC2C=C1C,0.2415
CC1C2CC(C)(CO)N12,0.2838
CC1C2N1C(=N)NC2=O,0.2379
OC12CC(C=C1)C21CC1,0.2362
O=C1C=CNCC2CN12,0.2032
c1([nH]c(=O)[nH]n1)C(=O)N,0.1915
COC(C)C1CC(O)C1,0.3066
N#CC1N=COC11CC1,0.2582
COCCC1OC1(C)C,0.3433
OCCC1C2CC(=O)N12,0.2335
CC1C2OC(C=C2)C1=O,0.1979
CNC1=CC(=N)NN=N1,0.1463
O=C1CCN2CC12C#N,0.2209
O=C1OC2CCC2=C1,0.2212
CC1[NH2+]CC1(O)C([O-])=O,0.2758
CC(=N)OC1OCC=C1,0.2522
CCn1cc(cc1O)N,0.2282
OC1C(O)C1(O)C1CO1,0.2941
CC(O)CC(C)C#C,0.3138
COCC1CCOCO1,0.3411
Cc1cncn1CCO,0.2455
CC1(C)CC1(O)C(N)=O,0.2637
CC(=O)NC1COC1,0.2745
COc1cc[nH]n1,0.2458
CCC12CC1C(O)C2C,0.3122
CC1CC1C(C#C)C#C,0.2955
CC1=CCCC1O,0.2615
CC#CC1(C)C(C)N1C,0.2581
O=C1C2C3CNC1CN23,0.1971
CC1OC1C(C)(C)CO,0.3235
c1cnc(=O)oc1C#N,0.1658
CN1C(CNC1=O)C=O,0.1951
C#Cc1cc(cnc1)N,0.1807
CC1CCC11COC1C,0.3139
C#Cc1[nH]ccn1,0.2049
CN1CCOCC1C=O,0.2005
CN1CC2C3OC2(C)C13,0.2857
O=CC1NC1CC1CO1,0.2212
OC1COC1=NCC#C,0.2619
CC1CN1CC(=O)C#N,0.1696
CCOC(CO)CC#N,0.3035
CC(C)(C)CC#CC=O,0.2055
OC1C(CC11CO1)C#N,0.2975
CN1C2CC(C=C2)C1=O,0.2186
c1c[nH]cnccnc1,0.1636
CC1=CNN=C(O)C1=N,0.1751
CC12OC3(C)C1C2C3O,0.2893
CCCC1CCC1O,0.3274
COC1COC(C)=NC1,0.2679
c1nc(nn1C=O)C=O,0.1783
C1C(=CC(=O)N1)NC=O,0.2038
C[NH2+]C(C)C(N)C([O-])=O,0.264
COC1CC1C(O)CO,0.3036
CC1(CCC1O)OC=N,0.2802
OC1CN2CC2C1C#N,0.2672
CNC(=N)NC(=O)CO,0.2103
CC1COC(C#C)C1C,0.2928
CC1C2CN1C2C1CO1,0.312
CCC1CC(C)(O1)C#N,0.2866
NC(CO)(C#N)C1CC1,0.2803
NC1=C(F)C(=N)NC=C1,0.1688
CCC1(N)CNC1C#N,0.2614
OC1C(O)C2(O)CCC12,0.2924
O=C1C=CCC2OC12,0.188
c1cc(ncc1N)F,0.1876
c1(c(c([nH]c1N)O)O)O,0.2123
CCC1NC1(C)C#CC,0.2703
CC1C2OC1C=CC=C2,0.1728
CC1CCC(N)=C1C=O,0.1823
C#CC1NC23CN(C2)C13,0.2368
O=CCC12CN3C1CC23,0.2083
OC1CCC(O)C1C=O,0.2239
CN=C1N=NON=N1,0.1584
CCC(C)C12CC(C1)O2,0.3155
OC1CCCC1C#C,0.2942
O=C1CC(CC#C)O1,0.28
CC1N(C2CC2)C1(C)C,0.2969
O=CC12CC3OC3C1N2,0.2181
O=C1C=CC2C3C1CN23,0.168
[NH3+]CCC1=COC([O-])=C1,0.2247
OC1COC2C3OC2C13,0.2961
C1OC11C2C3OC1C23,0.3015
CCC1CC2(C1)CCC2,0.3505
O=C1OCC1OCC#N,0.2514
c1coc(n1)OC(=N)N,0.2491
N=C1OC(=O)N=CC=C1,0.1679
CCC#CC1COC1C,0.2887
CC1CC2CCC(=O)C12,0.2144
NC1=CC(=O)CC2OC12,0.1881
C1COCCC(=O)C=C1,0.2011
N#CC12CCC1C1NC21,0.2667
CC(C)C1OC2COC12,0.3026
C1C2C3C4OC1OC2C34,0.3167
CCC1(C)C2OCC12C,0.302
OCCC1NC1C#C,0.2789
O=CC12CC(C1)C(=O)O2,0.2151
C1OCC2C3NC3C2O1,0.3003
OC(C#CC=O)C1CC1,0.2049
CC1CC(O)C11CC1,0.3291
O=C1C2CCC3OC1C23,0.2009
CN1CC(C1)(C#N)OC,0.246
C1CC(C1)C2(CC2)CO,0.3237
CC(=NO)C1OC2CC12,0.2432
C1C=CN2C1=NCC2=O,0.2066
C#CC1(CCC1)OC=O,0.2715
COC(C)C1CC1(C)C,0.3216
CC(C)(O)C(C)(O)C#C,0.2965
CC12CC(C1)C=CC2=O,0.1874
CC(C)(C)c1cnno1,0.2347
CC1C(O)C11CC2CN12,0.2939
CC1OCCNC(=O)O1,0.2868
O=C1OC2CC1CCO2,0.2719
CC1(CC=O)C(O)C1O,0.2184
OCC1(CO)CC1C#C,0.2823
CC1(CN1)C1OC1C=O,0.2062
N=C1OCC2CC1O2,0.268
CN1C2CN3C4C3C1C24,0.2728
COC1(C)CC2(C)OC12,0.329
CCCNc1conn1,0.1886
CC(=O)c1nc(co1)N,0.158
OCC12CC(C1)C2C#N,0.303
CN=C1NCC1(O)C=O,0.189
CC(C)C1CC1CC=O,0.2252
c1coc2c1C=CCO2,0.1766
CC#CC1C(O)C1C#N,0.2692
NC12CC1(OC2)C#N,0.2378
c1c([nH]c(n1)NC=O)N,0.1826
c1nc2c(o1)CCO2,0.2045
N#CC1(CCO1)C1CO1,0.2764
CCOC1(C)CCC=C1,0.2582
CC1CCC1(C)C#C,0.3035
CC1CN2C3CC1(O)C23,0.293
COC12C=CCC1C2C,0.2447
CC(=O)C(=N)NCC#C,0.1919
OCC1OCC1=NO,0.2414
O=CC(C#N)C#CC#C,0.1969
NC1=NC=NC(=N)C=N1,0.1725
NC(=O)CC1NC1CO,0.2692
CCC1N=COC1C,0.2681
CC1=CC(CCO)OC1,0.2489
CC(=O)N1C2CC1C2=O,0.2312
CCC1=CON=NC1=N,0.165
OC1(CCC11CN1)C#N,0.2623
CCC1CC1C1OC1C,0.3369
CCC12COCC1O2,0.3342
CCC1(C)COC1=N,0.293
CC1CC1C1CCC1O,0.3227
OC1=CN(C=O)C(=N)N1,0.1836
C1CC(C1)NCC#N,0.2654
COCC1C=CC2NC12,0.2459
CCc1cc(cnc1)N,0.1977
CN1CCC(=O)C=CC1,0.1748
C#CCNC1C2CC1O2,0.2638
NC(=O)CC1OCC=C1,0.2362
c1coc2c1C(=O)CC2,0.2127
CC1(CC1)CCC2CC2,0.3442
CC1C=CC2C3CC1C23,0.2448
CCOC1=NCCC1C,0.2794
C(COC=O)C(=O)N,0.2712
c1c(nc[nH]1)O,0.2321
OC1C2C3OCC1(O)C23,0.3024
CCC1C(C)C1C,0.338
C1OCC2=CC3OC3C12,0.2319
OCC1(CC2NC12)C#N,0.2844
N#CC12CCC(C1)OC2,0.289
CCN=C1NCC2OC12,0.2415
C#CC12CC1CCCO2,0.2647
CC(C#N)C(C=O)C#C,0.2168
CCCC12CC1OCO2,0.3139
CCc1nnc(o1)CC,0.2595
OC(CC#N)CN1CC1,0.2915
CC1(C)CC2OCCC12,0.3142
CCOCC#C,0.2893
Cc1c(cc([nH]1)NC)N,0.2179
CC(O)(CO)CC=O,0.2254
CCN1CCC1C=O,0.1988
CC(C#C)C1COC1,0.2948
COC(=O)NCC#N,0.2943
CN1CC23CC(C)(C2)C13,0.2823
CC1OC11CC2OC2C1,0.3457
C1CC23OC2C=CC3=C1,0.19
O=C1C2C3C(CC2=O)N13,0.2085
c1(nc2n(n1)nno2)O,0.1927
c1nc2c(o1)OCCO2,0.2084
CC12CC1(OC=N2)C#N,0.2595
OC12CC1(O)C1NC1C2,0.292
CC(C#C)C(O)C1CO1,0.3079
Cc1[nH]c(cn1)NC=O,0.1998
CC1(C)C2COCC12C,0.3243
O=C1CC2OC2C2CC12,0.221
CC(C)Nc1conn1,0.1858
O=C1C2CC2C2CC1C2,0.2225
CCC1CC1OCC#N,0.2773
OC1C2C1C1=CCCC21,0.2358
C1CCC(CC1)C#N,0.3476
CC1OCCC1C(C)=O,0.2289
Cc1c(nc(o1)C#N)O,0.1736
CC(O)CC(=O)C(C)O,0.2307
C1CC2C3CC4C(C13)N24,0.3243
CCCC1(COC)CN1,0.3152
CC1CC2OC1C2(C)C,0.3238
CC#CC1OCC1O,0.2706
CC1C2CCC2(C)C1=O,0.2146
c1c(c(oc1N)O)CO,0.2265
CCOC(CO)C#C,0.2886
C#CC1NC1CC1CC1,0.28
OC12CC1CC1COC21,0.3127
CCc1cc(cn1C)O,0.222
COC1C(O)C1CCO,0.2948
CC12C3C4C1C4(C)C23,0.3028
CC(C#N)(C#N)C#N,0.3282
CC1OCCCC2CC12,0.3194
CCC1OCCC2NC12,0.3097
CCC12CC1N1CC1C2,0.3095
CN1CC2(CCO2)C1=O,0.2487
N#CC12CC1C1CN2C1,0.2704
O=COC1C2OC=NC12,0.2526
OC1C=CC2C1C1CN21,0.225
CCC12C3CC1C(C)C23,0.3238
OC12CC1C1(CC1)CC2,0.3215
OC1C2CC3C2C13C=O,0.2186
CNC1COC1=NC,0.2556
CN1C2C1C1(O)CC2C1,0.2918
Cc1cncnc1,0.2099
c1cc(oc(=O)c1N)O,0.154
CC(=O)CC(=O)CCO,0.2072
N=C1OC23CC12CCC3,0.2736
CC(=O)N1CCC1=O,0.2288
NC(C(O)C#N)C1CN1,0.2482
C#CCC1CCCCC1,0.3136
CC(C)CC(C)C(C)O,0.3265
C1CC11CC2C3CC1N23,0.3138
CC12OCC1(O)C2C#N,0.2571
C#CC1NC1CCC#N,0.2832
CCOCC(=O)CC#N,0.2364
CC1(CC#N)CC1C#C,0.2717
NC1COC(=N)C1C#N,0.2663
COC(=O)n1cccc1,0.207
OC1CC(=N)OC1C=O,0.2042
COC1CN(C)C(=O)C1,0.2718
OC1C2OC3CN(C3)C12,0.2846
CC1C2CC(O)C1O2,0.3088
C1CC23OC4C(CC24)C13,0.3072
OC12CC1C(CC#N)C2,0.302
OCC12NC3C1NC23,0.2852
C1CC1NC(=O)C(=O)N,0.2109
CC1=CC(=O)CCN1C,0.1827
CC1=NC(=N)C(C)=CO1,0.2073
OC12CC3C1N3C2=N,0.273
CN1C(=O)CN=C1CO,0.2334
c1nc(no1)CC#N,0.2697
CC1C2C3CC2(C#C)C13,0.2923
CC(O)CN(C=N)C=O,0.219
CCCC#CC#CC,0.227
OCC12CC1OCC2O,0.2856
CC12CC1(C)C1C(O)C21,0.3061
C(#N)c1[nH]nc(n1)N,0.1825
CC1CCCCC1,0.374
CC1C(O)C11OCC1C,0.2906
CC1CC11COC(=N)O1,0.3031
NC1=C(F)N=NOC1=O,0.1605
O=CNC1CCC11CO1,0.2737
C1OC2C3CCC12OC3,0.3162
OCC1OC2C(O)C12O,0.2832
CC#CC(=O)NC=N,0.2057
Cc1cn[nH]c(=O)c1F,0.1838
C#CCOc1n[nH]nn1,0.2308
c1c[nH]c2c1cc[nH]2,0.225
O=CC1CC(=O)C2OC12,0.2037
CC1(O)CC11CC2NC12,0.2962
OC1C2CC1C21CC1,0.3248
CC1(CC1)C(O)CO,0.3121
CC1N2CC2CC11CN1,0.3002
CN1CC2(O)C3CC3C12,0.2727
CC1C2OCC(C)C12C,0.3003
Cc1cnn2c1C=CC2,0.1846
CC(C)(CCC#N)CO,0.3176
NC(C#N)C(=N)NC=O,0.2275
c1c[nH]cc1CC#N,0.2483
CC(C)C(=O)C(=O)C,0.1555
COC12C=CC3C1NC23,0.2243
Cc1cc(=O)cccn1,0.1522
CC(C)CC#CC1CO1,0.2739
CCCC1NC1(C)C=O,0.2215
OC1C2OC(C#N)C12O,0.2385
COC1C2NC1C2=O,0.2431
CCOC1CCC2NC12,0.3074
CC1C2C(C#N)C2N1C,0.2435
CC#CC(O)C1(O)CC1,0.2938
CCCNC(C)C#N,0.2713
CC1OC2C3COC1C23,0.3159
COC1C(=O)NC=C1C,0.2014
N=COC(CC#N)C#N,0.2768
OC1CCOC(=N)CC1,0.269
OCC(O)CC=O,0.2288
Cc1cnc([nH]c1=O)F,0.2011
CC(N)C1=NC(C)=NO1,0.2388
N=COC(=O)NCC=O,0.2214
C1C2CC3C4C=C1C2C34,0.211
C#CCc1c[nH]cc1N,0.2234
CC1CC2N3CC3C12O,0.2841
CC(C)COCCOC,0.3356
O=CC1(COC=N1)C#N,0.2127
C1C2OC3COC2C13,0.3205
CC12CC1(CC2)C#C,0.2656
CC12CCC3C(CO1)C23,0.3176
C#CC1=CC2CC1C2,0.1916
Cn1ccc(c1)N(=O)=O,0.181
O=CN1C2CC1(C2)C#C,0.2401
CC1C2OCC3CN3C12,0.2804
O=C1OCC11CN=CO1,0.25
c1c(n(c(n1)O)C=O)N,0.1724
CC1(C)OC2CCC2=C1,0.2366
C1C2CC3CC(CC13)O2,0.3153
CC1(CC(=N)O1)C#N,0.2809
Cc1conc1CO,0.245
c1c2c(c[nH]1)OC=NC2,0.2271
O=C1NCC2(NC12)C#N,0.2417
O=C1NC2C3OC3C12,0.2638
CC12NC(CC=C1)C2=O,0.2203
c1c(c(c([nH]1)O)CO)N,0.2217
CN=C(C(=O)C1CC1)N,0.1905
COc1ccc[nH]1,0.2411
NC1=NC(CO1)C1CN1,0.2766
N#CC1C2CC1C21CC1,0.314
OCC1OC1CC1CO1,0.3386
CNC1(CCCC1)C#N,0.2661
C1C2C3C4C5C4C(C15)N23,0.3016
CC(C)(C)CCNC=O,0.2836
CC(OCC#N)C#N,0.3046
Cc1cocc1CC=O,0.1986
CC12C(O)C(C1O)C2=O,0.2258
CCC12CC3(CN3)C1O2,0.3132
CC1OC1CC(N)=O,0.2714
CC1N(CC1=O)C=O,0.2123
CC1(C)CC2NC12C=O,0.2044
CC1(O)CC1(C)OC=O,0.2684
CCCC(CO)OC=O,0.2766
CC1(CN1C=O)C#N,0.2506
CC(C)N=C1CCO1,0.271
CCCCCC(=O)OC,0.2867
OC1CCC2OC12C=O,0.2169
CC1(CCC(=O)O1)C=O,0.2204
CC(C#N)C1=NC=NN1,0.269
OC12CC3C1CCCC23,0.3307
Cn1cc(nn1)CC#C,0.2497
CC1C(CC1(C)C)C#N,0.3286
CC12CC3(C)C1C=CC23,0.2256
CC(C#N)(C#N)N=CN,0.2499
CN1CC=CC1C=O,0.1859
OC12CC1CC(=O)CC2,0.2238
CC12C3C1C1OC3C21O,0.2947
CCC1=CC(=O)OC1C,0.2251
N=C1CC(CC2CO2)O1,0.2895
CCCCC(=O)CC,0.2349
C#CC1NC1C1CCC1,0.2808
O=C1CC2C1OC21CC1,0.196
O=C(CC1CN1)C#N,0.1715
CC1=CC2(CN2)C2CC12,0.2246
O=CC1C=CCC2NC12,0.2038
CC1(OCC11CO1)C#C,0.2815
CCC#CC(O)CCO,0.2879
OC1C=CCC1OC=N,0.2603
C1C2OC=NC1C1NC21,0.2673
CC1CC1(C)OC1CC1,0.3275
CC(C)CC(C)(C)C#N,0.3457
[NH3+]C1(CC1C#C)C([O-])=O,0.2504
[NH3+]CC1=C([O-])C(O)=CO1,0.1469
COC1C(C)C(C)C1=O,0.2021
CC#CCc1c[nH]cn1,0.2526
C1CC23OC4CC2C4C13,0.3117
CC(O)COC(=O)CN,0.2542
CN(C)c1c[nH]nc1O,0.2411
C(CO)C#CC(=O)C#N,0.1871
CC1(C)CC2CC12O,0.3186
OC1C2CC3OCC13O2,0.297
CC(C)(C)C(=O)CCO,0.229
C1C2CC11OCOCC21,0.3444
CCC(=O)NC(C)C=O,0.2181
CC1CCC2OC2CO1,0.3276
C#Cc1c(n[nH]n1)CO,0.2186
CN1C(CC=O)CC1=O,0.2109
CC12OC1CC2CC#N,0.3009
c1cc(nc(=O)nc1)N,0.1621
Cc1cc(c(nc1)C)N,0.1975
CC(CNC=O)OC=O,0.2693
c1c(=O)cnc(cn1)N,0.1324
COCC(C)C(C)C#C,0.3091
OC12C3COC1OCC23,0.322
C#CCc1c(cn[nH]1)N,0.2169
N#CCC1OC2CC1C2,0.2893
Cc1c(nco1)COC,0.238
CC1C2C3N1C3(C)C2O,0.3024
OC(C1CO1)C(=O)C=O,0.1562
C1OC1C12C3CN1CC23,0.3075
CC(CO)C1OCCO1,0.3319
CC12OC3=NCC1C23O,0.1593
CC(O)C(O)CN1CC1,0.3116
Cc1cc(co1)NC,0.2182
NC1CC1(N)C#N,0.2705
COCCC#N,0.3075
CCC(C#N)C(C)=O,0.232
C1OC2C3OC2C3C=C1,0.2362
COC1(CC1)C(O)CO,0.294
COC12CC(C1)OCC2,0.3237
N#CCN1C2CC=CC12,0.2367
CC1COC(=O)CCO1,0.2709
OC1CC2C(C#C)C12O,0.2725
CC1CC11COCOC1,0.3394
CCOC12CC1N1CC21,0.29
OCC[NH2+]CCC([O-])=O,0.2762
c1c(c(c([nH]1)N)O)N,0.2288
Cc1nc(nc(n1)O)O,0.2384
COCC(O)CC=O,0.231
COC12CC1CC21CO1,0.3203
CC12CCOCC1(C)O2,0.3332
C(C1CC1)C12CN(C1)C2,0.3044
OC(COCC#C)C#C,0.2715
CC(C)C(C)CCC#N,0.3476
O=C1NCC2CCN12,0.2872
CC1C=CCCC11CC1,0.268
CC1OCC1C(C)=O,0.2244
NC1=NCC2OC12,0.2466
OC12CN3C1C(C#C)C23,0.2935
OC(C#N)C1CC1C#C,0.2697
CCC12C3CC1OC2C3,0.3116
c1c(c[nH]c1O)CCO,0.2428
CC(N)C(O)(C#C)C#N,0.2695
CC12C3C4C3C(=O)C1N24,0.2084
CC1C(C)C1(C)C,0.3324
OC1C2OCOC=NC12,0.2407
c1c(cncn1)N2CC2,0.1951
C1CC23COC2C=CC13,0.2453
CC1C2C(O)C2C1(C)O,0.3062
O=CC1CCCC2CN12,0.2105
CC1=CCNC(=O)OC1,0.258
CC12CN3C(CCC1)C23,0.3003
CC(=O)C(C)(CO)CO,0.2314
C1C(=O)C=CC(=O)CN1,0.1302
CCCC1(CC#C)CO1,0.3053
CN(C)C1CCC1C#N,0.2555
CC1OCOCC1C#N,0.3109
CC(C)C1OC1C(C)C,0.3302
O=CC1C2CN1CC=C2,0.1978
NC1=CC(=N)NN=N1,0.1542
COC1OC(=N)NC1=N,0.244
O=C1NC2C(CC12)C#C,0.2706
OC1CC2C3C4C(C13)N24,0.3047
c1c(nco1)CC2CC2,0.2463
CC(CO)N(C)C(C)=O,0.2668
[O-]C(=O)C#CC1CC[NH2+]1,0.2112
CC1C=CC2C3OC2C13,0.238
CC1=C(C)C(CC1)C#C,0.2533
CC1C2OC1(C=C2)C#N,0.2371
CC#CC12CC(=O)C1N2,0.2145
C1NC11C2NC2C11CN1,0.2769
CC12OC3CC1C(O)C23,0.3069
C(C#N)C(=O)C(=N)N,0.1764
OC1CC11CCOC1,0.3155
CC1CCOC11CCC1,0.3078
c1c(nno1)C(=O)C#N,0.1976
CCCC#CCCC#N,0.2851
NC(=O)CC(O)CC#N,0.2609
c1cc2n(c1)C(=O)CN2,0.1713
CC1(CC2CN12)C1CO1,0.3218
C1NC11CC=CC11CN1,0.2455
COc1cc(c(o1)N)N,0.2207
c1nnno1,0.2667
CC(C)OC(C)(C)C=O,0.2258
CCn1c(ccn1)C,0.2545
CNc1c[nH]nc1C#N,0.1885
CCC1C2CC1C2,0.3839
CCC#CCC1(CC1)C,0.2977
N#CC1CN2N=NC=C12,0.2598
CC1CC(=O)OC1CO,0.2771
CCC1CC(C)C(C)=C1,0.2569
CN1C=CC(=N1)C1CN1,0.2313
CC(C)Cn1ccnc1,0.2514
O=C1CCC2C=CCN12,0.2452
CC#CC1=C(COC1)C,0.2026
CCCOc1ccon1,0.2493
C1CC12CC(=O)C23CC3,0.2185
CC1OC23CC4C2C1C34,0.3197
O=C1NC2COC1C=C2,0.2106
O=C1NCC2OC3C2C13,0.2594
O=C1C2CC=CC1N2,0.221
CC1CC(O1)C1(C)CO1,0.3266
CCC1COC1(C)C#N,0.2841
C1NC1C1CC2CC2O1,0.299
c1cc(nnc1O)F,0.1909
c1ncn(n1)C2COC2,0.2651
C1C(CO1)OCCO,0.3178
OCC1OC=NC1C=O,0.2122
OC1C2C3CC4C1C2N34,0.2711
C1CC2CC1C1OC21,0.3436
OC1CC=CCC1O,0.2671
Cc1cc(=O)nc(o1)F,0.2127
C1C23CN=COC12CO3,0.2602
C1OC2C3NC12CC=C3,0.2265
CC12OC1C(O)C=C2,0.2403
C#CCC(=O)OCCO,0.2681
CC1NC2(CC2)C1C#N,0.2546
CCC(C)C(=O)N1CC1,0.2484
O=CNC1CN2CCC12,0.2457
OC1C2COCC1C=C2,0.246
O=C1CC2CC(C2)C1,0.2192
CC(COC(N)=O)C#C,0.316
C(c1c([nH]c(n1)O)O)O,0.2334
CC1=CCC2C(O)C12C,0.2358
CCN1CCNC(=O)C1,0.2492
CC1C(CC2CN12)C=O,0.2129
CCOC1CCC1(C)C,0.3279
N#CC12COC1CO2,0.2578
CC12CCC1NC2=O,0.2709
CC12CC(CO1)CC2=O,0.2098
CC1N=CN2CC12C#N,0.2444
CC12COCC=C1CO2,0.2486
O=CC1CC2C1OC2=O,0.2289
CC1OC11CN2CCC12,0.2833
COC12CC1(O)CC=C2,0.2449
N=C1CCC(=O)OCO1,0.2641
N=C1OC2CC3OC3C12,0.2869
c1cc2c[nH]nc2nc1,0.1761
CC1OCC2=C1NC=C2,0.2401
O=C1NC=C2NC=NC12,0.1839
CCC1=CCCC1O,0.2575
OC1=C(NC=N1)C1CO1,0.2176
CC1C(O)C1OCC#N,0.2737
C1C2CC3OCC=C3C12,0.238
CC12CC3C=CC1C23C,0.2345
O=CC12CN1CCOC2,0.2064
CC1=CC2CC1C1OC21,0.2367
CCC12OC1C1OC21,0.2917
CCC(CC)(C#N)O,0.3124
CN1CC(CC#N)C1=O,0.275
CNC(=[NH2+])C1=CN=N[N-]1,0.1842
C1COCC2OC2CO1,0.317
OCC1(CO1)C1CC1O,0.3079
CC1OC2(COC2)C1C,0.3136
O=C1CC2C=CCC2O1,0.2592
CC1=CCC2COC1O2,0.2494
Cc1ccc(o1)COC,0.226
CC(O)C1NCC1=O,0.2097
OC12CC1(O)C1(CO1)C2,0.2956
CC1(O)CCC1C#C,0.2993
CC1=CCOCC2OC12,0.2385
CC1(CO)OC11COC1,0.3183
N=C1CN(CCO1)C=O,0.2579
CC1=CCC2C1CC2=O,0.2199
CN=C1CC(O1)C=O,0.2154
CC12C3CN1C(CO)C23,0.3171
CC1C2(C)NC2C1(C)O,0.3004
Cn1c2cc[nH]c2cn1,0.2119
CC#CCC1(O)CC1O,0.2936
CC(O)C1N=COC1C,0.2636
COC(=O)c1ncco1,0.2071
CCCN(C=O)C(C)C,0.2697
OC1CC2COCC2C1,0.3145
C#CCn1c(ccn1)O,0.2464
COc1cc(n[nH]1)N,0.2466
N#CC1C=CCCC=C1,0.2527
c1c(onc1OC=O)N,0.2183
O=CCCC1C2CC1O2,0.2164
C1CC1CCCNC=O,0.2834
C#CC(=O)CCO,0.2086
CCOC(=N)C(=O)C=O,0.149
N#CC1OC2C3CC3C12,0.264
CC12OC3C(O1)C3C=C2,0.2397
CC12C3N1CC2C31CO1,0.325
CC1C2COCOC12C,0.3071
c1c2c([nH]n1)NC=NC2,0.2073
CN=C1C=CNN=C1C,0.1796
N=C1OC2CC3CC12C3,0.2831
CC1=CC2CC11CCC21,0.2283
C1COC(O1)CC#N,0.3045
CC(C)N=CNC(=O)N,0.2491
CC(C)CC1NC1C#C,0.2821
CC(C[NH3+])CC([O-])=O,0.2736
CCC(C)C1(CC1)C#N,0.3187
CC1=CC(O)=NOC1=N,0.1655
C#Cc1nc(no1)CO,0.212
C1C2CC3OCC=CC123,0.2337
CCC1CC=CN1C=O,0.2093
C#CC1CC1C1CCC1,0.2895
CC1NC1(CC#C)C#N,0.2805
OC1CC2C1C1CC21O,0.3079
CC1=CNC(=N)N=C1F,0.1664
CCC(CC1CN1)C#N,0.2791
COC1(C)CC2COC12,0.3132
CN=C1OC2CC1C2,0.278
CCC1(C)CN1CC=O,0.2147
CCCc1nc(co1)C,0.2404
CC1(O)CC1(C=O)C=O,0.1948
CC1C2COC(=N)CC12,0.2793
CC12OCC3C1C2C3O,0.3031
CC1CCC(CC#C)=C1,0.2555
CN1CC11CNC1=O,0.2563
C1C2CC3(CCC=C3)C12,0.2576
CC(O)C1=COC(=N)O1,0.2352
CC(=O)C1CC1CC#N,0.2298
CC(=O)CCCO,0.2352
OCC1C2NCC12C#N,0.2572
OC1CC(C2CO2)C1=O,0.2177
CNC1=NON=CC1=N,0.1589
CCC(C#N)C1CC1,0.3336
CC12NC1C(=O)C21CN1,0.2083
O=C1OCC2(CN2)C1=O,0.1638
COC(C)C#CC1CC1,0.2759
O=CC1=CC2CC(C1)O2,0.1849
CC(O)C(=O)C1(C)CO1,0.2226
CC12CC3(O)C(C=C1)C23,0.2285
C1C2NC3=C(OC=C3)C12,0.2015
CCCOC1C2COC12,0.2974
CCC(C)(O)C(C)CO,0.3246
C#CC#Cc1ccoc1,0.185
c1c(nn[nH]1)CCO,0.2469
CCNc1ncn(n1)C,0.2194
CN1C2CC3C2C13C#C,0.2405
CN1C2CC11CC(=O)C21,0.1903
CC12CC(C1)CC2C#C,0.3062
Cc1c2c(co1)onn2,0.1608
O=C(C1CO1)C1COC1,0.2077
C(=O)C(=O)N,0.177
CC1CC(C)(CO)CO1,0.3048
CCC12C(C)C3C1CN23,0.3072
CC1(CC1)C12CN1CC2,0.3152
OC1COC2COC1C2,0.306
CC1OC1C1=CC=NO1,0.2288
CC1(N)COCOC1=O,0.2459
COCCC12CC1CO2,0.3111
OC12CC(C1)CC2,0.3279
O=C1C2N3CC2(C#C)C13,0.2359
CC1(CC(O1)C#C)C=O,0.2154
CC1(C)OC(=O)C2CC12,0.2723
[NH3+]C1(CO)CC1C([O-])=O,0.2713
CCOC(=N)OC(C)C,0.3093
CC1CCC2CC2O1,0.3216
C1CC(O1)C1=CNC=N1,0.2511
CN1CC1C1=NON=C1,0.1922
C1CC1C2=CC(=O)NC2,0.2159
CC12CC3OC1C1C3C21,0.3418
CC1(N)CN2CC12C#N,0.2444
Cc1[nH]c2ccoc2n1,0.2016
CC1CC(C)=C2COC12,0.2388
N=C1OC=COC1=O,0.1844
ON=C1C2NC1C2C#N,0.2624
C[NH2+]C1(CC1C)C([O-])=O,0.2637
CC(=O)C1(C)CC=CC1,0.2288
c1c[nH]cc-2cncc12,0.1395
COC12CC(O)(C1)C=C2,0.239
CC(C)C1(COC1)C,0.3082
CC12CCC(CC1)O2,0.3243
CC1C2CC1C1OC1C2,0.3483
C1OC2C3C4CC12C3O4,0.2964
CC1(C)CCC1N1CC1,0.3108
C1CC11C2CC3CN2C13,0.3097
CCC(=O)COC(C)=N,0.2353
CN1C2C3(C)CC3C12C,0.2791
OCC1(O)COC1C#N,0.2726
c1coc(cc1=O)C#N,0.174
c1c(oc(=O)c(=O)o1)N,0.1803
OC12C=CC3=CCC1C23,0.1756
CC1CN(C(C)=N)C1=O,0.2352
N=C1OC2=C(CNC2)O1,0.2396
CC1N=COC1CC#N,0.2704
CC1OC=NC1CO,0.2616
C1CC2(CO1)CC=CC2,0.2649
CCC1CCC1(C)C=O,0.2242
N=C1CN=CNC(=O)N1,0.2389
Cc1cc2c(o1)NCC2,0.208
CC1=C(NC=N1)C1CN1,0.2424
COC(CC1CO1)C#N,0.2928
O=C1C2C3CN1C23C#C,0.2411
O=C1NCC(N1)C#C,0.2788
OC12CC1C=CCC2=O,0.2092
CC12CC3OC1C23C=O,0.2088
CC1COC1C(F)(F)F,0.3272
CC1OC2C1N1CC21C,0.2877
CC1(CO)COCCO1,0.3153
CC12CC1CNCC2=O,0.2021
c1cnc(nc1CO)O,0.2145
O=CC1CCN=CO1,0.2146
C#CC1(CCC=C1)C#N,0.2597
Cc1ccc(oc1=O)N,0.1678
c1c(nn2c1NCC2)O,0.2397
OC12CC1C1CC21C=O,0.1932
CCC1=CCCC2OC12,0.2439
Cc1c(nc([nH]1)CO)C,0.2346
CC1=CC(O)(CC1)C=O,0.2106
CN1CCN=C1C1CO1,0.2263
OCC1NC11CCC1,0.3174
CC1CC11CC2CC1O2,0.3325
CCC12CC(O1)C2OC,0.3203
OC12CCN(CC1=O)C2,0.1983
C#CC1C2CC3CN2C13,0.2745
N=C(CC1CN1)NC=O,0.228
CNc1c(c[nH]n1)N,0.2218
CC(O)CC1=CNN=C1,0.259
Cc1cc(oc1)N(C)C,0.2174
Cc1c[nH]c(c1O)CO,0.2253
CCC1(CO)NCC1=O,0.213
OCC1C2C3C=CC2N13,0.2108
c1cocc1N,0.2237
COCC12CC(C1)OC2,0.3136
CC(C)C1(O)CC=CC1,0.2661
O=COC1CCC=C1,0.2585
CCNC(C#N)C(C)C,0.2778
NCC(OCC#C)C#N,0.254
c1c(nc([nH]1)C2CC2)N,0.2166
CCc1ccncn1,0.2119
CC1CC1(O)C(=O)C#N,0.1954
CC12C3CC(C1O)C23C,0.3146
Cn1cc(nn1)CCO,0.2453
C1CC1C(=O)NCC#N,0.2737
COCC(O)C(O)C=O,0.2324
OC1C2COC2C11CO1,0.2831
CCc1cc(oc1)C#C,0.1952
CC12C=CC3N=CN1C23,0.2246
CCC1C2OC(C)OC12,0.3312
CN=CN(C=O)C1CC1,0.2139
CC(=O)COCC1CO1,0.2159
CN=C1OC=NC(F)=N1,0.1838
CC1C2OC(=N)C12O,0.2568
CCC1CCC(OC)O1,0.3407
CCN(C)C(=O)C(C)C,0.2634
OC1C2CN2C(=N)C1=O,0.1596
CC#CCCC(=O)C=O,0.1477
OC1CN2C3CC3(O)C12,0.2475
N#CC1=CC2C3OC2C13,0.1896
CC1=C(C#N)C2CC1C2,0.198
C1CC1(CC#N)C=O,0.2262
CC1OC1(C)C(O)C#N,0.2832
CC1(O)CC(=O)C2NC12,0.2174
N#CC1CC2OC12,0.2993
COC=NC1(CC1)CO,0.2497
OC1C2CC(O)(C#C)C12,0.2785
CC1=C(C=CO1)C1CN1,0.2331
CC1(CCO)COCO1,0.3312
N=C(CC#N)OC=O,0.261
CCNc1[nH]cc(n1)O,0.2299
CCC12CCC1C2OC,0.3237
COC1C2CC1COC2,0.3355
OCC12OC3COC1C23,0.2785
CN1CC(=CC1=O)C#C,0.1831
OC1CC(O)(CC#C)C1,0.2946
CC1(O)C2C(O)CC12O,0.2854
CC1OC(=N)C11CO1,0.2712
Cn1cc(cc1N)N,0.2221
C(C(=O)c1nnon1)O,0.1846
CCN1CC1C(C)O,0.2888
OC(COC=N)CC=O,0.2264
CCCCCCC(=O)N,0.2787
CC1OCC2(CO2)C=C1,0.2437
c1cc(oc1N)NC=O,0.1814
C1C2CC11OCC3C1N23,0.2139
CC1CC2(C1)CN=CO2,0.2695
N=C1OC2COCC1O2,0.2756
CC#CC(C)(CO)C#N,0.2799
COCC1CC2OC2C1,0.3403
CC(NC(C)=O)C=O,0.2186
CC#CC12CC(O1)C2O,0.2578
C#Cc1cc([nH]c1N)N,0.2024
COC(=O)NCCCO,0.3126
CC1OCC=C2COC12,0.2491
COC1CC1CNC=O,0.2756
N=C1OCC(=O)C2CN12,0.2097
N#CC1OC2CC(C2)O1,0.2935
CC1=CCC(O)C1,0.2628
CC1(CO1)C(=O)CC=O,0.1998
O=C1C2C3COC1C23,0.22
CC1CC=CC1C(N)=O,0.2613
CC(C)C(=NO)C,0.2581
COC1C2C(C)C1N2C,0.2999
COC1CCC11OC1C,0.3155
c1cocc1C=O,0.1956
CC1COC1COC=O,0.273
CC1OCCCC11CN1,0.3116
CCCCC(C)OC=O,0.2848
CCN(C)C(=O)CC#C,0.2661
CC1(C)OC1(C)C#N,0.2977
CC(N)C(=O)OCCO,0.2558
CCC1CCC1OC,0.3269
C1N2C3C4=CCC13C24,0.1451
C1NC1C1=NNC=C1,0.2561
OC1=COC(=N)C=N1,0.1384
C#CCC1=CC2NC2C1,0.2409
CCOC1C2CCC12O,0.3182
CC1C2CC1(C)CCO2,0.311
CCCC(=O)NC=O,0.2214
OCCCC1CC1C#C,0.291
CC12CCC1(OC2)C=O,0.2052
c1c(noc1N)C(=O)N,0.1977
COC1OC2CC1C2C,0.3412
COCC1COC(C)O1,0.3417
CCc1c(cc([nH]1)C)N,0.217
OC1CC11CNC(=O)C1,0.274
C1C2NC2C2=C1NC=N2,0.2367
NC12CC(OC1=O)C=C2,0.2135
O=CC1OC1(C=O)C=O,0.1739
CC12CCC1(OC2)C#C,0.2626
CC1COC(=N)C11CC1,0.2787
O=C1COCC2CC1O2,0.206
Cc1c(con1)C(=O)C,0.2057
CC1CCCC=C1C,0.2589
CCOc1cnc(o1)O,0.2408
CNC(=O)C1COC1,0.2641
CCC1=NC(=O)N=NO1,0.2365
CCC(OC=O)C1CC1,0.2841
OCC#CC(C#C)C#N,0.2783
C(C(=N)N(C=O)C=O)O,0.2156
CC1COC1=O,0.2825
CCOc1c[nH]nc1O,0.2307
OCC#CC1NCC1=O,0.2114
N#CC12CC1NCCO2,0.2555
c1cn2c(n1)[nH]nn2,0.1968
Cc1cc([nH]c1O)O,0.2333
COC1(C)C2C3CC3C12,0.2748
N#CC1NC1C1COC1,0.2645
CC12OC1C1(CC21)C#N,0.2602
OC12CC1C(=O)C=CC2,0.1888
OCC1C2CC1C2CO,0.3267
O=C1CC=C2CNC12,0.2053
CC12COCC3C(O1)C23,0.3096
CC1(O)C2CN2C1C=O,0.2053
OC1(CC1)CC1OC1,0.3165
CC(=O)c1cc(c[nH]1)O,0.1708
CC1C=C(CO)C2NC12,0.2465
OC1C2OC(=O)OC12,0.3163
C1OCC1C1CCC=C1,0.2628
CC12CC1(O)C1OC1C2,0.3136
COC(=O)C1OCCO1,0.25
C#CC1=NCC(O1)C#N,0.2217
C1CC12COCOC2=O,0.2739
COC(C#C)C1CC1,0.2994
CC12CC1CN2CC=O,0.1989
CC1C2N(C)C2(C)C1O,0.2846
NC1=NC(CC1O)C=O,0.2083
[O-]C(=O)C1C[NH2+]C1C=O,0.2682
N=C1OC2CCC1C2,0.2863
CC12CC3CC1C23,0.3407
ON=C1C(O)COC1=N,0.2035
Cc1c([nH]nc1N)N,0.2374
CC(=O)CC(O)CO,0.2295
Cc1c([nH]cn1)N(=O)=O,0.1757
C(#N)C(=O)C(=O)C(=N)N,0.1697
OC1C=CC2(CO2)C1O,0.2341
Cn1c(=O)cc(cn1)F,0.1792
OC12C3C1C1OC2CC31,0.3081
CN1C2C=CCC2C1=O,0.2401
CC12C=CCC3C1CC23,0.2499
Cc1c(nnn1C)OC,0.2176
CCc1ccnoc1=O,0.1831
OCC1OC2CC1C2O,0.3008
C1C=CC2OC1C1NC21,0.2495
O=C1CC2OC3C(O1)C23,0.2604
CC(=NCCO)NC=O,0.2259
COC12CN(C)C1C2C,0.2763
CC(C#N)C1=NC=NO1,0.2615
C1NC1C12COCC1N2,0.3101
N#CC1CNC2CN1C2,0.2382
OCC12CN1C1C(O)C21,0.2821
OC1CC11OCC2CC12,0.3072
CC(C)(C)CC1COC1,0.3037
OC1C(O)C11OCC=C1,0.2152
Cn1c(nc(n1)N)C#N,0.1811
CC1CCOCC1C=O,0.2152
CCC(C)(O)C1(C)CN1,0.2913
CCC1C2C3N1CC23O,0.2881
CC12COC1COCC2,0.3146
CC1OCC2(OC12)C#C,0.2745
CCCC12CC1C=CC2,0.2475
c1noc2n1c(nn2)N,0.1926
OC1CC1C(C#C)C#C,0.2944
[NH3+]CC(C#C)C([O-])=O,0.2746
C#CCc1cccnc1,0.2287
CN1CC1C12CCC1N2,0.293
CC1C2C3CC2(C)C13O,0.3228
OC1COC1C(=O)C#N,0.1853
CC12CC(=O)C1C2O,0.2311
CC1CC2C(CC2=O)O1,0.2117
COC(C)CC#CC#C,0.2299
CC(O)C1CC2NC12,0.2973
CC1CC11C(O)CC1O,0.3137
CC1C(O)C=CN1C=O,0.2101
CN1C(=N)CN=C1C=O,0.1515
O=C1CNC11CC2CC12,0.2055
OCC1OC2CC12C#N,0.2753
OCC1=CC2COC1C2,0.2493
O=CC1CC2NC2C=C1,0.2215
CC1CC=C(CO)C1O,0.2587
COC(CC=O)C1CN1,0.2254
COC1C2NC2C2NC12,0.2805
CC1(CO1)C([NH3+])C([O-])=O,0.2706
OC12CC3=CCOC1C23,0.2037
CC1C(=O)CC1(O)C#C,0.22
CC(C)(CN(C)C=O)O,0.2707
CCOC(C)C(=O)C#N,0.191
CCC(=O)C1COC=N1,0.2215
CC1CC1(C)C(=O)C#N,0.2046
C#CC1=CCOC=NC1,0.1948
OCCC12C3C4C3C1C24,0.2986
OCCC12NC1C1CC21,0.2771
CC1C2CC3N2C13C#N,0.269
CC(N)C(=O)NC=O,0.2091
O=C1COC23CN(C2)C13,0.1993
CC1OCC(C)C(C)O1,0.3365
C1CC2(C1)CC(=O)OC2,0.2763
CCc1c(nn[nH]1)NC,0.2036
CC1OCCCC1=NO,0.2518
CC(=O)NC(=O)CCO,0.2233
CC1OCC1(O)CO,0.2958
OCC1(O)CC2NC2C1,0.3055
CCC1OCCCC=C1,0.2547
CC1NC1(C)C1CN1C,0.2987
CC#CCc1cnno1,0.2286
CCCOc1cnon1,0.2302
CC1C(C#C)N1CCO,0.2614
CCC1C(O)CC1CO,0.3191
CCC(O)C(O)CC,0.3171
Cc1cc(c([nH]1)C#C)N,0.1849
CC#CC1CC(=O)CO1,0.2179
CC1CCC(=O)OC=N1,0.237
OC1C2CC11OC(=O)C21,0.2544
FC1=CNN=NC1=N,0.171
CC1(CC1O)C(N)=O,0.2758
OC1CC2C1OCC2O,0.2988
CCc1cc([nH]c1C)O,0.2337
CC(CCCO)C=O,0.2269
CC#CC(=NO)CC#C,0.2018
CC1C(C)C1(C)CC=O,0.2218
OC12C3CC1=CCCC23,0.2147
c1[nH]c(c(n1)N)C=O,0.1724
C1C(=O)C(=O)CNC1=O,0.1518
CC12NC3(COC13)C=C2,0.2132
CNC(C#N)C1CCC1,0.2767
c1c[nH]c2c1CCC2,0.238
OC1=NC=C(N1)C1CN1,0.2435
CCC1=CC=NOC1=N,0.167
CC(C=O)C(=NO)C#C,0.193
CN1CC1COCC#C,0.2564
O=COC1CCC=CC1,0.2648
CC(C#N)C1(CC1)C#N,0.3121
CC1C2C=CC(=O)C12C,0.1843
CC#CC1OC1(C)C=O,0.2025
C1CNC(=O)C(=O)OC1,0.2083
OCC1=CC2C(O)C2C1,0.2245
CCCC#CC(=O)CC,0.2096
CN1CC(O)C1CCO,0.2979
OC1C=CN2C=NC=C12,0.1971
CCCC(=O)C(C)OC,0.2292
COCC1(C)NC1C#C,0.2804
C1CC2COCC22NC12,0.3031
c1c(c(cnc1F)N)O,0.1947
O=C1NCC(O1)C#C,0.278
CC1C2OC1C1OCC21,0.3139
N=C1OC2C3NC3C12,0.2691
C1C=CC=CC=CC#C1,0.1435
COCC1CN1,0.3228
CC1OC2COC12C,0.3055
CCC12CC3CC1(C)N23,0.3246
C#CCC12CC1C1CC21,0.2616
N=C1OCOC1CC#N,0.2865
Cc1c(ncn1C)O,0.2234
C1CC23OCC2COC13,0.3031
C(=O)C(=N)NC(=N)C#N,0.1836
CNc1cocc1OC,0.2262
OC1=CC(F)=CC(=N)O1,0.1767
CC12CC(=O)C1(CO)O2,0.2137
c1c(n[nH]n1)C(=O)N,0.2242
Cc1cc2c(o1)nco2,0.1958
CC12CCCC=CC1O2,0.2351
OCC1NC1COC=O,0.274
CC1C=C2CC3CC1C23,0.2172
OC1CC2C1C21COC1,0.3092
CCN1CC2CC1C2=O,0.2033
CC12NC(C1O)C21CN1,0.296
NC(=O)C1OCC1CO,0.2637
CC12CCC1(CO)O2,0.3235
CC(CC#N)OCCO,0.2995
OC1C2C3C4CC4C2C13,0.3211
CCCCCC1(C)CO1,0.3457
CC12CC1C1CC21CO,0.2705
CC12COC1C(CO)O2,0.301
O=C1C2CC3CC2OC13,0.2195
CC(=O)C1(CC1)C1CN1,0.2247
CC1=CC2(C)CC1O2,0.2342
c1(c(=O)onc(n1)F)F,0.1799
c1cn(nnc1=O)C=O,0.1551
CC1C2CCOC=NC12,0.2493
CC1(CC2CC12)N1CC1,0.31
CC1CC2(O)C1CC2=O,0.2164
CC12CC3C1C2C3C#N,0.3001
CCC(=O)C(O)CO,0.2263
OC12CC1CC2CC=O,0.2226
CC1C(=O)OCC11CC1,0.2736
CN1CCN=C1C=O,0.1541
ON=C1C2NC2C1C=O,0.2091
C1C2(CO1)COC(=O)O2,0.3059
COc1cc[nH]c1OC,0.2252
C#CC12CC1COCC2,0.2881
CC1C(O)C(=N)NC1=O,0.2452
COC1COCOC1,0.3249
CC1CC2CCC12C=O,0.2191
CCc1nc(on1)CO,0.2537
Cc1c(n(cn1)C)C,0.2435
CC1CCC(CC1)=NO,0.252
OCC(CCC#C)C#C,0.2992
C1CC1C2=NCC(=O)O2,0.2459
OCC1C2C3C1C2C3=O,0.2474
c1(nc(=O)nc(o1)O)N,0.2356
CNc1c(=O)cc[nH]n1,0.1761
N#CC12CC3C(CC13)O2,0.2778
CN(C)C1=NCC(=O)N1,0.2252
CCC(=NO)C#CC,0.2039
CC1OCC2(C)CCC12,0.329
C1CC2C3OC3C=C2C1,0.2369
OC1CN2CC3OCC123,0.271
CC12CCCC3OC1C23,0.3084
FC1=CC(=N)N=CN1,0.1929
OC1CC2C3C4C1C4N23,0.2817
CC(=O)c1c[nH]nn1,0.2073
CC(C)(CNC(=O)N)O,0.2957
C1COc2c1nn[nH]2,0.2271
N#CC12CN=C3NC1C23,0.1706
CC1CC2C(C)OC12,0.3176
OC12C3N=CN(C13)C2=O,0.198
C1CC2CCC1C2,0.3619
CN=c1cc([nH]cn1)O,0.1825
COCC(C#C)C1CO1,0.3043
N#CCC1(CN1)C1CC1,0.2786
N#CC1OCOC2CC12,0.281
CC1C2OC(=O)C(N)C12,0.2496
O=C1C=CN2C3CC1C23,0.182
O=C1C2COC1C2C#C,0.2061
CC12C3CC1(O)CC2O3,0.3075
C#CC12CN=C3OC1C23,0.1608
CCC1CC(O)CO1,0.3114
C1CN1CC2CC(=O)C2,0.2218
OCC1=CNC(=N)C1=O,0.1487
COCCC12CCC1O2,0.3329
CC1(O)CC(=O)C2CC12,0.2269
OC1C(CC=O)C1C=O,0.2136
CNC1C(O)C1(C)C#N,0.261
CC1COC11C2CC1O2,0.3043
OC12CN3CC(C13)C2=O,0.1994
CC12C(CO)C1C1NC21,0.2793
O=C1NC23CC4C2C1C34,0.2414
CN(C)C(=O)C#CCO,0.2228
CC(OC1CC1C)C#N,0.2871
CC1(C(C1(C)C)C#N)C,0.3071
CC(=O)C1(CCO1)C=O,0.1944
CC1C2C3C1C1(CC1)N23,0.3168
CN(C)C(=O)CN1CC1,0.2591
Cn1c2cnoc2nn1,0.2093
N=C1NN=CC=C1C=O,0.1319
COC1C(=O)N2CC12C,0.2163
N#CC1C2CNC12C#N,0.24
CC#CC1CCO1,0.2717
OC1(CC#C)CC2CC12,0.2929
O=C1CN2CC12,0.225
c1coc2c1cn[nH]2,0.2266
CC1=C(N)N=CC(=N)O1,0.1321
NC1=CN=NNC1=N,0.1676
O=C1NC2CC3CC3C12,0.2725
O=COC1C2OC(=O)C12,0.2658
C1C2OC22CCCC=C12,0.2531
CC1(C=CCC1=O)C,0.2213
CCC1(C)C2OC1C2C,0.3101
C1C2C3C4C3N1CCN24,0.2779
CC1=NC(=N)OC(N)=C1,0.1752
CC12CC3C1C(=O)CN23,0.2041
COC1CCCOC1C,0.3103
O=CNC1CCC2CC12,0.279
CC1(C)OCCCC1O,0.3175
CCC(C)N1N=CC=N1,0.2581
C1CC23OC4(COC24)C13,0.2072
CC1(O)C2CC1C2O,0.3031
CC1(O)C2CC(C#C)C12,0.2889
NC1=NC2CC=CC2O1,0.2329
CCC(O)C(C)OC,0.3289
CC1COC(=O)C2CN12,0.2388
CCOC1(C)C2CCC12,0.3228
N=COCCCCC#N,0.2839
NC12CC1(CO)NC2=O,0.2325
OC1(CC2COC12)C#N,0.2608
C1C=CCNC=CC1=O,0.1863
CCN=CNC(=O)C=O,0.1642
C1OC11CCC11CCO1,0.2921
C(C=O)NCC#CC=O,0.191
c1cc(c(nc1)N)C#N,0.1767
CNc1nc(c(o1)N)O,0.2215
OCC1C2COC12C=O,0.2182
CC1=NC(=NO1)C1CN1,0.2222
c1cnoc1CC(=O)N,0.2225
OCC(C=O)C(O)C#N,0.2236
OC1CCC11COC=N1,0.2644
C#CC(C=O)(C=O)O,0.1923
C1CC2CC1OCCO2,0.3055
NC(=O)C12CNC1CN2,0.2461
C1C2CC3OCCC3C12,0.3224
O=CC12CCOCC1N2,0.2222
C1CC(C1=O)(C=O)C=O,0.2012
O=C1CNCCC1C#N,0.1889
CC(=O)C1C2COCC12,0.228
CCC(C)(O)C(C)(C)O,0.3034
N=C1OCC=C1C=O,0.1792
CC1CC(C)(O)C(=N)O1,0.2803
CC1OCC(C)=C1CO,0.2462
CC1(O)CN2CC(O)C12,0.2635
C1C2CN3C=CC=C3N12,0.23
OC1(CC1C=O)C1CC1,0.2257
OC12CN3C(CC13)C2,0.2951
CC1C2CC(CC=O)N12,0.2107
CC1(C)OC1CC1CO1,0.3441
OC1C2OC3C2C13C=O,0.2186
OCC1=CON=CC1=N,0.1817
CC1=CC2OC2C1C#C,0.2418
c1cocc1C#CC#N,0.1881
CC1C=CCOC1(C)C,0.265
c1nc(nn1C=O)C#N,0.2107
CC1NC(=O)NC1=O,0.2546
CN=C1ON=C(F)C=N1,0.1497
N#CC1CC=C(C1)C#N,0.2214
CC1CC2C(CCO)N12,0.2964
C1C2C3CC3N3CC3C12,0.2858
CC1C2OCC2CC1O,0.2987
C1C2C3COCC2N13,0.3125
CC(=O)C(C=O)C1CN1,0.189
CC1NC1(CCO)C#C,0.2739
c1c([nH]nn1)NC2CC2,0.2303
COC1OC(=N)C2NC12,0.2682
CC1CC2CC3CC12C3,0.3456
OC12CC1(O)C=CC2,0.2435
Cn1cnc(c1N)C#C,0.2118
CCC12C3C1N1CC3C21,0.2964
CC#CC(O)C(N)C#N,0.2843
c1c(c(no1)NC=N)N,0.1907
Cc1c[nH]nc1N(=O)=O,0.1951
CC(C)(C#CC1CC1)O,0.2767
OC1C2OC3C2CCC13,0.3115
C#CC12OC(C=C1)C=C2,0.2018
CN1CC1C(C)(C)O,0.2873
CN1CC23NC(C12)C3=O,0.2122
OCC1(CNC1=O)C#C,0.2623
CCC1(CC(=O)C1)O,0.2206
CC12OC1C1CC=CC21,0.2616
CC12CC(O1)(C=C2)C#N,0.235
CC1CC1C1(O)CCC1,0.3118
CC12C3C4C3C1(O)CN24,0.2785
C#CC1(COC1)CC#N,0.2852
CN1C2C=CC1C2(C)C,0.2042
O=C1CC23OCC2OC13,0.1873
CC1(C)CC1C#C,0.2888
O=C1CC2NC3C2OC13,0.2082
CC#CC1=NC2CC2O1,0.2099
OCC(CC=O)OC=N,0.224
OC1(CC1)C12CC1CC2,0.3172
CCCC1C2COCC12,0.3233
CCC(C)(O)C1CC1C,0.3236
NC1=CC=C(O)C(=N)O1,0.1568
CC(C#C)C(=NO)C#C,0.2087
CCOCCC(C)C,0.3315
CC1C2CN2C11CC1O,0.3015
CC12CC(NC1=O)C2O,0.2556
COC1=CC(=N)OC=N1,0.169
CC1=CC2CC2C2NC12,0.2414
N#CC#CC1CC2NC12,0.2158
OCC1OC(=N)C1C=O,0.2225
OCC1CC(=NO)C1O,0.2454
CC1C=CC2NC(=O)C12,0.2464
Cn1cc(cc1N)O,0.2262
CC(CO)(OC=N)C#C,0.2677
CC#CC1COC(N)=N1,0.2738
Cn1cnc(cc1=O)N,0.1933
CC1C2C3N1C(=O)C23C,0.2446
COC1C2CC3CN3C12,0.2944
CC12COC(CC=C1)O2,0.2554
CC(=O)c1cnnnn1,0.1461
CC#CC1CCCC1C,0.2947
CC(C)C(CO)N1CC1,0.3252
OC1C2NCC(=O)NC12,0.248
CCC(C)(O)C1CCC1,0.3223
CCCCC1OC1C,0.349
OCC1COC(=N)OC1,0.2872
CCCC1OCOC1C,0.3374
CC(C)C(=O)N1CC1C,0.2485
OC1CC11COCC=C1,0.2493
CC12CC(C1)NC2C#N,0.2735
CCC(=O)C12CCC1N2,0.2222
O=C1COC2CCC2=C1,0.1781
CN1CC1CC(=O)C#N,0.1524
CC1CC2OC(C)C12O,0.2975
CC12C3CN4C(C13)C24C,0.2988
CC(=O)C12CC(C)(C1)C2,0.2217
C(C#N)OC(=O)N,0.2974
CCNC(=N)C(=O)CO,0.1661
CC1CC2CCC12C#C,0.2831
OC12C(C=O)C1N1CC21,0.1972
CC1C2OC=NCC12C,0.2715
CCOC1CC(C1)C#C,0.2959
CN=COCCCCO,0.273
CC(=O)C1(COC1)O,0.2174
OCC1NC(=O)CC=C1,0.2446
CC1(O)C2NC1C=C2,0.2208
c1coc(=NCC=O)o1,0.2116
CC(C)C1COC(=O)O1,0.3336
CC1OCC11CN=CO1,0.2706
c1c(onn1)C2(CC2)O,0.2198
CC12CN3CC4C3C1N24,0.2733
COC=NC1CC2NC12,0.2529
CC1OCOC1(C)CO,0.3258
CC1CC(=NO)C1CO,0.2442
CC1OC2OC1CC2O,0.3179
CCC1(C)OCC1C=O,0.2176
CC1CC2COC2C1,0.32
CC1(C)CC1(C=O)C#N,0.2239
CCC1C(O)C1(C)C=O,0.2268
O=CC12C3C1C1C3CN21,0.2085
C1C2OC3=NCCNC123,0.2454
CCCOCC(C)C,0.3366
C(C1CO1)C1CCCO1,0.3316
O=C1C=CC2CC12,0.1876
OC1(CC2CC1O2)C=O,0.2049
OC1CCC(O)C11CN1,0.303
COC12CC1(C)N1CC21,0.3152
COC1CC=C2CCC12,0.2477
OC1(CC=CC1=O)C=O,0.1764
CN=C1CNC(=O)CO1,0.2589
CC12CC3C4CC4N1C23,0.3178
OCC1CCNC(=O)C1,0.2676
CC#CC1NCC1=NO,0.2356
CC(C)Oc1cnco1,0.2341
NC(=O)C(O)C1(O)CC1,0.258
CCc1c(ocn1)C#C,0.2
CC1CC(C)(C)O1,0.3219
CC1CC(CO1)C(N)=O,0.2721
COc1c([nH]nn1)CO,0.2201
CC1C2C1N1CC(=O)C21,0.2017
C1CC12CCNCC2=O,0.1955
NC(=O)OC1CC2OC12,0.3129
CC1CC11CNC1=O,0.2801
O=C1C2CC1C1(CC1)O2,0.2003
CC#CC1=C(N)ON=N1,0.1526
COC1C2CC1(C2)C#N,0.2881
CC1OC11CN(C)C1=N,0.2463
CCC(C1CO1)C(C)=O,0.2267
CCc1ccn(c1O)C,0.2302
CN1C2C(=O)C1C2(C)C,0.2295
O=C1CC(=CN1)C1CO1,0.2032
CC(C)C1CC1C=O,0.2278
CC(=O)C1OC1(C)C=O,0.2048
C#CC1(COC1)CCO,0.29
OCC(C#C)C(=O)C#N,0.1853
CCOC(=N)C#CC#N,0.2032
C(c1nc(no1)CO)N,0.2308
CC1CCCC2CC2O1,0.3159
N#CC1C2CCN=CN12,0.2275
CN1C2C=CC1(C)C2=O,0.2371
C#CCc1c(cno1)N,0.2057
CC12CC3C1C2(O)C3O,0.2917
CC1(C)CCC(=N)OC1,0.2754
O1C2C=CC1C=C2,0.2019
CN=c1c(=O)[nH]nc[nH]1,0.192
OCC1C(O)C(O)C1O,0.2824
N=COC1C=CCC1=O,0.2018
CCC1=CC(CC1)(C)C,0.2579
[NH2+]=C1OC(=O)O[C-]1C=O,0.184
CN(C)C1(CC1)C#N,0.268
CCC1CCOCC=C1,0.251
CN1CCc2c1[nH]nn2,0.2124
OCC(COC=N)C#N,0.278
CC#CC1C2CN2C1=O,0.2238
NC1=NC(=N)NC(F)=N1,0.2026
CCC12C(C)C1C1CN21,0.2817
CCC1(C)OCCC1O,0.3112
CC1OC(=N)C1C,0.2888
CC1(CN1)C1=CON=N1,0.2172
Cc1nc2[nH]ncn2n1,0.2339
c1coc(n1)NCC#N,0.2319
CC1N=CNC1(C)C#N,0.2525
Cc1cn(nn1)CCO,0.2473
CC1N(C)C1(C#N)C#N,0.2476
CC(=O)OC1(CC1)C#C,0.2608
c1ccc(cc1)N2CC2,0.2103
C1CC2(CC2)C=C1CO,0.2439
c1nc(no1)CCC#N,0.2674
C1CC2(C1)CC3(C2)CO3,0.3333
C1NC11C2C3CC1CN23,0.3147
OCC(O)CCC#N,0.3104
O=C1CC2N1CC21CC1,0.2371
COCc1cc(no1)O,0.2469
C1OC2C3C=CC(=C1)C23,0.1778
COC1(CC1)CNC=O,0.2825
CNC(=O)CC1NC1C,0.2724
C#CC12CN1CC2,0.2526
CC(C)OC,0.3336
CC1C(C)C1CCCO,0.3357
CC1N=C(CO)NC1=O,0.2369
CC12CC(C1)C2CO,0.3352
CC(C)CC(=O)C(=O)N,0.1777
CC(C#CC#C)N1CC1,0.2241
CC1C2CC(O)C12C,0.316
CC(O)C(=O)N1CC1,0.2462
C1CC2COCCC12,0.3211
O=C1C2C3N1CC23C#C,0.2288
CC1OC(=N)C2OCC12,0.2601
O=CC1(OCC1=O)C#N,0.1938
CC1CC2(C)C1OC2=O,0.2786
O=C1CC2(CO2)C2CN12,0.2372
CC(N)(CC#N)C(N)=O,0.254
OCC12CCN1C2C#C,0.2598
c1nc(oc(=O)n1)CO,0.1977
CNC(=O)CCCCO,0.2795
CCC1(O)C2CC2C1O,0.2877
CC1C(=O)N2CC12C#C,0.2278
O=C1NC2CCNC2=C1,0.215
CC1CCC1=O,0.2211
Cc1c([nH]nnc1=O)N,0.1749
CC(C)(CNC=O)C=O,0.2232
O=CC1(CC2CO2)CO1,0.2176
c1c[nH]nc1N2CC2,0.2373
OCC#CC12CC1CC2,0.2553
CCCC#CCC=O,0.2186
CC12CC1OCOCC2,0.3242
CCC(O)C1CC1CO,0.3259
OC1CC1(O)CNC=O,0.2721
CNc1cncc(n1)O,0.18
O=C1CC(NC1=O)C#C,0.1728
CC1N2CC2C1(O)CO,0.2815
CN(C)C(CC=O)C#N,0.2136
CC1(C)C2CC1(C2)C#N,0.3224
CC(O)C(=O)CC1CN1,0.2241
N#CC12COC(C1)OC2,0.2894
CC1OC1C1CC1,0.3418
NC1=CC(=[NH2+])C([O-])=CO1,0.1386
CN=COC(C)CCO,0.2724
COC1C(O)C1(C)OC,0.2924
CC12CC1(CC2=O)C#C,0.224
CC1C=CC2=C1N=CO2,0.1817
CC1OC(=O)C1(C)N,0.268
CCC1(O)CCC1C=O,0.2187
COCC(OC)C(C)C,0.3285
C1CC(C1)OC(=O)C=O,0.18
CC1NC11CC2(C)NC12,0.299
CC1=CC=CCCC1,0.1877
OC(CC1CN1)C=O,0.2052
C#CC1C2CC2C2OC12,0.3062
OCC1=CCC2C(O)C12,0.2386
CCC(C)C#CCO,0.2762
O=C1OC2C(OC12)C#N,0.2459
CC1CNC(=O)NC1,0.2927
OC12CC1CCC21CC1,0.3098
O=C1COC2C3CN1C23,0.2273
CC1C(O)C1CC#N,0.3107
C(=O)n1c(nnc1O)O,0.1739
CC12C3CCC11OC2C31,0.306
OC12CNC1C(=O)C=C2,0.166
OC1CC(O)(C=O)C1=O,0.1871
CC1OC2C1C2(C)C=O,0.2216
COC1C(C)OC1=O,0.2518
OC12CCN3C1CC23,0.2969
CN(C)CC1OC1C#N,0.2208
O=CC1CNC(=O)C=C1,0.1966
CNC(=O)CCC=O,0.2301
OC12C3CC1N1CC2C31,0.2795
COC12CC1OC2C,0.3065
C(C(=O)N)N=CNC=O,0.2172
NC(=O)N1CC2CCC12,0.284
COC1C2C3C2C1C3O,0.3178
CC1C2CC3CC(C3)C12,0.3256
CN1C2COC2C11CC1,0.2775
OC12C3NC1C1OC3C21,0.2613
OC1C(O)C1(O)CC#N,0.2868
CC(C)CCCCCO,0.3428
OCCC12CNC1CO2,0.2899
CCCC1(C)COC1C,0.316
CC12CC1(C#N)C(=N)O2,0.2742
OCCC12CN1C(=O)C2,0.2374
OC12CC1CCC1CC21,0.3098
CC1CC(=O)OC11CC1,0.2758
CC1NC1C(O)CO,0.3025
C(=O)C(=O)c1nnon1,0.1449
c1c(ncc(n1)F)N,0.1758
CC1CC(CO)C2OC12,0.3329
N#CCC12CC(C1)N2,0.2812
OC1CC11C2NC1C2=O,0.251
CC#CC1CC(C)C1,0.2953
COC1C2CC1(C)C2,0.3468
O=C1NC2C3NC2C3N1,0.2953
CCC12C=CC3C1CN23,0.2072
OC1CCC2OC1C2=O,0.2282
OC1C2CC1(O)C2O,0.3028
N=C1NC=NC(=O)C=N1,0.171
CCOC(=O)CNC,0.2403
CC(=O)CC1CC1O,0.234
C1OC11CN2C=NC=C12,0.2485
CC1OC2(CC2)C(C)=C1,0.2289
CN1CC2N=COCC12,0.2455
CC1OC(CC=O)C=C1,0.2203
CC1COCCC(O)C1,0.3155
CC12COC3(CC3)C1O2,0.322
O=C1C=CC23CN(C2)C13,0.1675
CC(O)C(=O)OCC#C,0.2669
CC12C3C(CN13)C2C#C,0.281
c1c(onc1N)C#N,0.1914
CN1C2CC3(C)NC3C12,0.2722
CC12C3CC1CC2(O)C3,0.317
CN=C(CO)NC=O,0.2214
CC1C(O)C(C)C1=O,0.2201
CC(O)C1CCCO1,0.3275
CC(O)C1CNC(=O)C1,0.2734
C#Cc1c(=O)occn1,0.1514
c1c(noc(=O)n1)F,0.1696
CCC(O)(CC=O)C#C,0.2213
NC(=O)CC1NC1C#C,0.2544
CC(=O)C12CC1CC2O,0.2255
NCC(C#N)N1CCC1,0.2668
CCC1(CC1)C(=O)C#N,0.2057
C1OC1C1CC2(CC2)C1,0.3432
C#Cc1ccno1,0.2043
CC(C#N)C1(CO1)C=O,0.2201
CC#CCCC(C)(C)C,0.302
OCC(=O)C1CC1O,0.2184
CN1CC(=O)C1(C)CO,0.1963
NC1=NOC([O-])=C1C[NH3+],0.1481
O=CNC1C2C=CC1N2,0.2318
CCC12OC3C1C(O)C23,0.298
CC(C)C1CC(O1)C=O,0.2125
Cc1coc2n1nnn2,0.2308
N=C1NN=CN=C1C#N,0.1365
NC(=O)OC1CC1C#N,0.3009
CC12CCC(CC1O)C2,0.3313
Cn1cc(c(n1)OC)N,0.2156
OCC(CC1CO1)C=O,0.2234
CC1(CC2CC2C1)C#C,0.315
CC1NC1CNC=O,0.2803
CCC1CC(=O)C=CN1,0.1878
CC1OCC11CC1,0.3179
CN(C=O)C(=O)CC#N,0.2281
c1c(c(c([nH]1)O)N)C#N,0.2005
CCC1=CC=CCOC1,0.1874
OC1CC=CC2CCC12,0.2642
CC1CC11CC2CCC12,0.3317
CC1(CN=CO1)C,0.2729
OCC12NC1C1OCC21,0.2868
CC12N=COC1C1OC21,0.2705
CNc1ccc[nH]c1=O,0.168
CCC(O)C#CCO,0.2869
CCC1=C(C(=O)OC1)C,0.2311
CC1(O)C2C3CC1(C)C23,0.3174
CC1OC2C3CC2C13C,0.3202
OC12C3OC3C3C1OC23,0.2927
[NH3+]C12CC1OC2C([O-])=O,0.2527
CC12OC1C1CC1C=C2,0.2407
NC12C3NC(=O)C1OC23,0.2317
CC12C3CC1C(CO)N23,0.3303
CC12C3C1C(=O)C2C3O,0.2414
N=C1NC=NC(=O)O1,0.2115
NC(=O)C(O)C#CC#C,0.2175
CCC(C)NC(=O)NC,0.3019
COC1C(C)C1(C)CO,0.3052
OCC12CC1CC21CO1,0.3336
N#CC1OC11CC2CC12,0.2738
CC1(CC1)c2ccoc2,0.2409
OC1C2NC2CC1C#C,0.2959
C1C2C=CC3C4C2C4N13,0.2384
CC1C2OCC(=O)C12,0.2198
OCC1NC=NC1C#N,0.2472
CC1(CO)N=CNC1=N,0.2263
O=CC12CC1C1COC21,0.2199
CC12C3C4C(C4N13)C2O,0.2928
CCN1CC1(C)C,0.3063
CCN1N=C(O)NC1=N,0.2339
O=CCC1C=CC2CC12,0.2147
CN=c1cnn(nc1)C,0.167
CNc1ncc(cn1)N,0.1626
OC12COC1CCC2=O,0.2166
CCC1(C)OC1C,0.3443
OCC1OCOC1C#N,0.2724
CC(=O)C1C2OC2C1O,0.2271
C1CC2(C1)C3(N2)COC3,0.3023
O=C1CCCCC1C#N,0.2203
CC1CC(C=C1C)C#C,0.2572
CC1(C)OCC11CCO1,0.3148
CC1(CC1)C1CC1C#C,0.2814
CC12CC3OC4C1N2C34,0.2924
OC1CCC11OC1C#N,0.2643
CC12OC1C(=O)C2C#C,0.2039
CC1=CCCC12CC2,0.2465
CC1CC(O)(CC#N)C1,0.2977
c1coc2c1occ2N,0.1935
CC1(C)CC1C1CC1O,0.3173
CC1NC1(C#C)C#C,0.2534
COC(C)C1CC1(C)O,0.3167
CNc1nc(co1)CO,0.2332
Cc1c(noc1N)C#N,0.1906
OCC12CC1CC2C#C,0.2973
O=COC1CC2OC12,0.2726
C1C2C1C1OC3C(O1)C23,0.3106
COCC(NC=O)C=O,0.2184
c1c(c[nH]c1C(=O)N)O,0.1848
CCC1CC2C3OC2C13,0.2999
C1C2(CO1)COC=N2,0.263
C1C2CCC3OC3CN12,0.3071
CC1=CC2C3C4C1C2N34,0.2428
CC1(OC2CC12)C=O,0.2082
CC1=C2CN3C(C1)C23C,0.1673
Cc1ccc2n1CC2,0.2432
CCc1cn[nH]c1N,0.2376
O=C1NCC2OC=NC12,0.2448
OCC1C2CC(O2)C1O,0.3163
CC1(CC1)C(C)(C)C#N,0.3296
CC#CC1C2CC1(O)C2,0.2897
CCCC1C2NC2C1=O,0.2157
C1OC2CCOC3C1C23,0.3014
CCOC(C)C1CCC1,0.3307
OCC1CC1(O)C1CN1,0.2881
CC12CC3C1C3(O2)C#N,0.2514
OC1C2C3CC4C1N2C34,0.2645
OC1C2C3C4N3C2C14O,0.2938
CCC1(O)C2C3NC3C12,0.2707
COC1=NCC(O)CN1,0.2779
C#CC1(CN1)C1CO1,0.272
N=C1NC=CC1=O,0.1557
CC(C)C1CC1C1CC1,0.3302
OC12CC1CC(C=O)=C2,0.1879
CC1(C)C2CCOC12C,0.3064
CC1CC(C1)C1COC1,0.3156
CNC(CC(N)=O)C#N,0.241
CC1(CC1)CNCC#N,0.262
N#CC1CC2CCN12,0.2395
CCC1(C)CC1N1CC1,0.3212
CC1C(C#C)C1(O)C=O,0.2123
CC1C(N1C)C(N)=O,0.2585
N#CCC1COC=NC1,0.2705
C(C(=O)NC(=O)CN)N,0.2129
CCC1C2OC(=O)C12N,0.2456
OCC(O)C1=CC=NN1,0.2586
c1nc(c(o1)N=CN)N,0.1616
NC(=O)C1OC(=N)C1O,0.2517
CC1NC1COC1CC1,0.3214
O=CCC1OCOC1=O,0.2242
CC1(C)CC=CC1(C)O,0.2575
C#Cc1cocc1C#C,0.2141
CCc1c(nno1)C=O,0.2033
c1coc(c1N)CC#N,0.2125
N#CCCC1CO1,0.3179
CC1(COC1)OCC=O,0.2234
CCN=C1NCC1O,0.2575
O=C1CCOC(C1)C#N,0.2212
O=CC1(C=O)C2COC12,0.211
CC(C)C1CCOCC1,0.3263
N=C1N=CNN=NC1=N,0.1753
O=C1NC=NC2CC12,0.2258
C#Cc1c([nH]cn1)CO,0.215
OCC(=O)N1CC1C#C,0.2526
CC1CC(O1)(C#C)C#N,0.2599
N#CCCC1CC2OC12,0.3017
CC1OCC2OCC1O2,0.3241
CC1NC(=O)C2CC1O2,0.2489
O=C1CCNC1C1CN1,0.1963
CCC12NC1CC2C=O,0.2056
CC1C2C3C1C(=O)N23,0.25
Cn1ccc(c1O)OC,0.2302
Cc1cnc(o1)C(=O)N,0.2064
C#CC1CN1CC1CO1,0.265
CCC12CC1(C)OC2=N,0.278
O=CC1C2NC1C1OC21,0.2155
CC12CC(CO)(C1)C2,0.3379
OC1CCC2OCOC12,0.3035
CC1(C)CC=CC1O,0.2563
NC(C#N)C1OCCO1,0.2947
CC1(O)CC1C#CCO,0.2693
C1CC1OC=NCCO,0.2574
C1CNC(=O)OCC=C1,0.2525
CC1=CNC(=O)C(=N)O1,0.1771
COC1CCC11CC1C,0.3224
CC1C2C3CC(C23)C1O,0.3133
CN=C1CC2OC2CO1,0.2691
CC(=O)CN(C)C(=O)C,0.2157
OC1CN(C=O)C1=O,0.2085
CCC1CC(C)=CC1=O,0.1907
O=C1C2C3C(CN23)C1=O,0.1489
C1OC23C1OC1C2CC31,0.2978
CCC1=CC=NC(=N)O1,0.1655
CC1CCCC(C)C1,0.3715
CCCCC(C)C#CC,0.3033
C1C=CCC(=O)CC1=O,0.219
COC1CCC(O)C1,0.3166
CCc1nc(no1)C#C,0.2235
CC(OC=N)C#C,0.2826
CC1C2OC2C1(C)CO,0.3172
CC12CN3C1C2NC3=O,0.2511
C(CC#CCO)C=O,0.2206
CC1(CO)N=CNC1=O,0.2295
C#CCC1NC11COC1,0.2936
OCCC1OCC1O,0.3057
C1CC2(C1)C=CC1NC21,0.2412
CC1CCC=C(C)C1C,0.2619
N#CC#CC1COCO1,0.228
O=CC12CN(C1)C2,0.1905
C1CC11OC2CN3C2C13,0.3013
c1cn(nn1)C(=O)CO,0.2133
c1c[nH]c2c1c(c[nH]2)N,0.2177
CC1(CO1)C(CO)CO,0.3144
COC1C=CCCC1O,0.2556
CCN=COCC(C)O,0.2724
CC1(C)CCC(C1)C#C,0.3052
CC1C2CC3(C)CC1N23,0.2969
CCC(=O)C1(CC)CN1,0.2257
OCC1OCCC2CC12,0.327
CC(C)(CC#C)C1CC1,0.3093
CN=C1COCC(=O)O1,0.2457
CC1CC11COC2CC12,0.311
O=CC12CC3C(C1)C23,0.2195
CC1COC(=N1)C(C)=O,0.1968
CC12CCC1(CO2)C#C,0.2742
CCC1(C)OCCC=C1,0.2658
CC1OCC(=NO)C1=O,0.1591
OC1C2OC1C2(O)C#N,0.2805
CC1OCC2(CC12)C#N,0.2989
Cc1c(cno1)CCO,0.2385
c1[nH]c(c(n1)O)NC=O,0.1874
CC([NH3+])C(N)C([O-])=O,0.2682
ON=C1CC(O)C(O)C1,0.2458
CC1CCC1C1CCO1,0.3197
CC1C2OC(C)C12,0.3213
CCOc1cn[nH]c1N,0.2261
OC1CC2=CC(=O)CC12,0.194
C1COC(=O)OC1,0.3207
COCC1(CO1)C(C)=O,0.2246
OC12CC3C1C1C2N31,0.2896
CC12CCC(CC1)C=C2,0.2644
CNc1c(n(cn1)C)N,0.2187
CC(O)CC(=O)CC=O,0.2136
CC1C2CCC12C(N)=O,0.2654
N#CC1=CCC2CC1N2,0.1976
CCC1NC1(CC)C=O,0.222
C1OC11C2C3C4C3N2C14,0.288
CC12CC3CN3C1CO2,0.3083
CNC(C#N)C(C)O,0.2826
c1c(nc(o1)N)NC=N,0.2067
CC(CC#C)C=O,0.2243
CC1C2OC1(CO)C=C2,0.2385
COC1C2CC2C1C#C,0.2829
C[NH2+][C-](C=O)C(=O)C=O,0.1271
C#CC1C2CC2C1C#N,0.2865
CCC1CC(O1)C(N)=O,0.2648
C#CC1=CC2OCC1O2,0.1966
OC12CC3CC(=CC1)C23,0.2197
OC12CNC1C(=O)C2,0.2015
C#Cc1nc[nH]n1,0.2292
CC1CNC(=O)C11CO1,0.2505
c1[nH]c2c(n1)oc(=O)[nH]2,0.2119
COc1cc(n[nH]1)C#C,0.22
c1c([nH]nc1O)N,0.2441
OC1CC2C3C4C3N2C14,0.2873
CC12OCC1NC21CC1,0.2926
CN=C1NC(CO1)C#N,0.245
Cn1ccc(c1C#C)O,0.1926
COC1CC=C(C)C1O,0.2622
CCC1C2C3NC3C12,0.2766
c1nc(=O)[nH]nn1,0.1594
OC1C2C=CC3(CN3)C12,0.2216
OCCCC(O)C1CO1,0.3412
O=CC12CCC3CN1C23,0.2155
N=COC1COC2CC12,0.2622
OC12CC1C1CCC21O,0.2747
CC(=O)Oc1ccon1,0.2432
CC1C2N1C1CC21C#C,0.2446
Cc1cnc(o1)CO,0.2377
OC1CC1OC(=O)C=O,0.1641
C(=O)c1[nH]nc(n1)N,0.155
CCOC(C)CO,0.334
CCC1N2C3CC2C13O,0.3101
CCC12CC1CC(=O)N2,0.264
CC1CC2CC1C2=O,0.2298
CCC1=CC2COC2C1,0.2562
CC1C2OC2CN2CC12,0.3048
C#CC1(CC1)NC(=O)N,0.2834
C(COC=O)OCC=O,0.2295
CC12C3N1C(C2O)C3=O,0.2346
CNc1cnccn1,0.1793
CC1(CN1)C1=CNC=N1,0.246
CC1CC(OC=N)C1=O,0.2027
COC1CC1C(=O)C=O,0.1575
O=C1NC2CCC2N1,0.3014
C1CC23CCN4C(C24)C13,0.3225
CC(CCCC=O)C=O,0.219
C1OC11CC2CC1C=C2,0.2474
CC12CCN1CC2C#N,0.2504
CC(=O)C12OCC1C2O,0.2139
CC1C2CC1(CO)C2,0.3381
CCC(C#CC)C1CC1,0.3001
CCOCCC(C)CO,0.3251
O=COC1C2C3CC1N23,0.2666
CC1=CC2(O)CC2OC1,0.2422
C1C2CC3CC12OC=N3,0.2534
CC12NC1COC2C=O,0.2142
Cn1ccoc(=O)c1=O,0.1765
CC(C)C1(CN1)C1CO1,0.3115
CCC1C(CC1=O)OC,0.2182
C(CN=C(C#N)N)CO,0.2165
OC1CC1NC(=O)C=O,0.1736
CC(O)C(C)C(=O)CO,0.2382
CC(=O)CCC(=O)CO,0.2341
N#CCOC1CC2OC12,0.2692
CCN(CC#C)CC#N,0.2448
OC12CC(C1)(C2)OC=N,0.2758
C#CC12C3CN1CC2O3,0.232
CC12CC(OC1)C2=O,0.2071
O=CN1CC23CC(C2)C13,0.2646
OCCC(CO)CC=O,0.2294
CC12COC(OC1)C2=O,0.2053
OC1C2C3C1CC23O,0.317
C1C2C1C1OC=NCC21,0.2743
CCOC1(CCCC1)C,0.3235
CCC1C2OC1(C)C2C,0.3205
CC1CCC23CC12CO3,0.2874
CC1C(OC1(C)C)C#N,0.2782
CC12C3C4C3C3C4C1N23,0.284
N#CC1C2C1C1CCC21,0.2938
CCC(CO)C#CC#N,0.2353
COC(=O)C1(CC1)C#N,0.2807
CC1(CO)CC2CN2C1,0.2915
CCC1(O)CC1(O)C#N,0.2818
CCC(C)OCCC#N,0.3026
Cc1cnoc1NC=N,0.2019
OC1C2OC3(CCC3)C12,0.294
CC1(O)CCC2CC2C1,0.3177
CC1C2OCC(CO)C12,0.2965
N=CN1C2C=CC1C2=O,0.2295
CC(O)CCC#N,0.3237
CCCC1CC(CC)O1,0.3282
CCC(C)CCOC=O,0.2866
OC1CC2COCCC12,0.3118
CC1C2CC(C3CO3)C12,0.3305
CC1(O)C2CCC12,0.3175
Cn1ncc(n1)CCO,0.2447
CC1C2CCC(C)C12O,0.3168
CC1(C)C=CCC11CO1,0.2666
N#CC1C2CC2C1C#N,0.3051
N=COC1CCC(=O)O1,0.2766
CC12CC(C)(O1)C2CO,0.3009
C#CC1OC11CCCC1,0.2764
C1OC2CC1CCCC2,0.3076
O=CCCC1C2CN1C2,0.2171
CC1(CC#N)C2CN1C2,0.274
CN1C2CC1C(C=O)=C2,0.1584
CC1OC2CC2CC1=O,0.2097
CCN(C=N)C(=O)OC,0.2492
N=COC1CCC1C#C,0.272
CC12CC(C1)(O2)C=O,0.2081
COC1OC(C=C1)C#C,0.263
C(CCO)CC#N,0.3105
ON=C1C2C3CCC1C23,0.2476
O=C1CC2C3CC1C2O3,0.2223
CC(C)(C)N=C(C#N)N,0.2201
C1CC12CN=CN2C=O,0.2122
NC1=NCC(=O)NC1=N,0.1922
CC(C)c1ncccn1,0.2084
CC1CN(C=O)C(N)=N1,0.2105
C1C=CC(O1)(C=O)C=O,0.185
CC1(NC1(C)C#C)C#C,0.2586
N=C1OC2C3CCC12O3,0.2582
Cc1cn(c(n1)N)C=O,0.1759
CC(=O)C1C=CNC1=O,0.2043
CNc1nc(on1)N,0.2411
CN1CC(=O)NC2CC12,0.2412
COc1c(nc[nH]1)CO,0.2416
COC12CC3CCC1C23,0.327
O=C(C#N)C1C2CCN12,0.1686
CC(C)(C)C1(CO1)C#C,0.2867
CCOc1ncco1,0.2458
N#CC12CCC1CCN2,0.2767
O=CC1=CCCC2OC12,0.1917
COC(=N)NC(=N)CO,0.2452
c1c[nH]c(=O)c(c1N)F,0.1831
OC1C(=O)C2C3CC12C3,0.2061
CC1CC2OC12C1CO1,0.3157
CC(O)C1COC(=O)C1,0.2792
C1NC1C12OC3C1OC23,0.2855
COC1(CO)CCOC1,0.3308
CC1COCCC=CC1,0.2579
CN(C)c1nc(co1)O,0.2222
CCC1C2OC1C21CN1,0.3135
CC1(C(OCO1)(C)C)C,0.3167
CCC1C(C)COC1C,0.3109
O=C1NC2COC3C2C13,0.2634
CC1CC(O)C1O,0.3031
c1c(nc[nH]1)CC2CC2,0.2524
OC1COCC(=C1)C#N,0.2216
CC#CC(O)CC1CO1,0.2861
CC(C#N)C1CCOC1,0.2948
CC1COCC2C1N2C,0.3033
CC1C2C1C1C2OC1=O,0.2613
CC1=CCCNCC1=O,0.1658
Cc1c(nc[nH]1)C=O,0.2044
C(CO)c1c(n[nH]n1)N,0.2141
OC1CC2OC2CC1O,0.331
CC(C=O)C#N,0.2256
CCOC1CC(CO)C1,0.3193
C1CC12COC(=O)N2,0.2978
C1COC(=O)C=CN1,0.2016
C1C2CC3C4CC3C2C14,0.3576
c1c([nH]cn1)C(F)(F)F,0.2499
Cc1cc(no1)NC=O,0.228
O=C1CC2(CN2)C11CO1,0.1978
C#CC(C#C)NC(=O)N,0.2731
CC1C2COC(CO)C12,0.3198
CC1CC(C1)C(N)=O,0.2737
CC1C2CC3(C2)OCC13,0.3205
OC12CC3CC(C1)OC23,0.323
OCC12CC(O1)C2C=O,0.2077
CC12CC(CO)(O1)C2=O,0.2422
CC(=O)C1OCC1(C)C,0.2151
C1C2OC3C4OC3C4C12,0.3132
C1C2C3OC1C1C3N21,0.3238
COC1CCC(O1)C#N,0.2981
O=COC1OCC=C1,0.2554
CC1CN=C2OC3C1C23,0.2034
N=COCCOC1CC1,0.2854
CC1COC(O1)C(N)=O,0.2544
c1c(noc1NC=O)N,0.2066
CC12CC1C(C)(O)C=C2,0.2424
CC12OCC1C1OCC21,0.3047
CC(C)N1CC12COC2,0.2966
CC1CC2CC2(O1)C#N,0.2796
CCNc1cc([nH]n1)C,0.2218
Cn1nc(nn1)OC=O,0.243
CC1=CCC(CO)C1O,0.2593
CC1(O)CNC=CC1=O,0.1858
OC1C(=O)NCC11CC1,0.2733
CNc1cn(cc1N)C,0.2215
OC1=C2CCN2C(=N)O1,0.2195
CC1=CCc2n1ncc2,0.2056
CC1CNC(=O)CN1C,0.2566
NC(=O)CC1CN2CC12,0.2561
CCCC1(CC(=O)C1)C,0.2219
CC1CC11OCOC1=N,0.2664
CC1(CO)C2C3CC3N12,0.2789
COC(C)(C#N)C1CN1,0.2668
c1cnc([nH]1)OCCO,0.2525
CC1OCC2=NNC=C12,0.2451
CC1C2N1CC2(C)CO,0.286
CC1CN(C)C(=O)O1,0.3018
CN=c1occ(o1)C#N,0.1841
CC1(CO1)C#CC(N)=O,0.2301
C1C2CC3C4OC1C2C34,0.303
C1OC1C1CC2NC12,0.3098
OC12C3CC4C1N4CC23,0.3008
OCC(O)C1(CO)CN1,0.3102
CN=C1ON=C(F)C=C1,0.1581
CC1=NCC(=N)OCO1,0.2623
CC1=Cc2ccoc2C1,0.1889
OC1CC1(C#C)C#C,0.2587
OC1C2NC1(C=O)C2O,0.2068
NC(=O)N1C2CC1C2=O,0.2366
NC(=O)C12CC1N1CC21,0.2436
CC(=O)C1CCC1CO,0.2271
C#CCc1cnncn1,0.1646
OC12CC1COC2=O,0.2624
CC12CC3N1C3(C2)C#C,0.2648
CC(=N)OC1(C)CC1,0.2877
CN1N=NC(=N)N=C1N,0.1698
CNC1=C(O)OC(=N)O1,0.2452
OCC1CC(C1)N1CC1,0.3056
C#Cc1c(ocn1)C#C,0.1785
OCC1CC=CC11CN1,0.2483
Cn1nc(c(n1)O)C#C,0.2039
CN(C=N)C(=O)C#C,0.203
CC1(O)C2C3CC3(C)C12,0.3183
COCC(C)C(C)C#N,0.3016
c1cc-2ccocc2c1,0.1461
CC#CC1C2CC(C)C12,0.2828
c1nc2c(o1)COCC2,0.2359
CCCc1cncn1C,0.2457
CN=C1OCC2CC12O,0.2608
CCNc1c[nH]nc1,0.2174
COC1(C)C(C)C1(C)O,0.3062
CC1NC1C(C#C)C#N,0.2841
CC1(C)OC(=N)C2OC12,0.267
CC1(C#C)C2NC(=O)C12,0.233
CC1OCCC2COC12,0.3161
CN1C2CC3OC2(C)C13,0.2968
OCC(CO)CC1CN1,0.3066
CC(=O)C(=O)CC1CC1,0.154
COC1CC2(CC2)C1=O,0.1947
CC1CC1(C)C1(C)CC1,0.3332
CC1CC2(CCC2)C1C,0.3375
CC1(C#N)C2C3CN2C13,0.2755
OCC12CC1OC(=O)N2,0.3007
CC(CO)N=CNC=O,0.229
CC1(O)C2C(O)CC12C,0.3131
CC12CC(CO1)C=C2,0.247
CCC1C2C1C(=O)C2C,0.2259
CC(CC=O)NC(C)=O,0.229
CC(=O)NC=NCC=O,0.2147
CC(NC=O)C(N)=O,0.2476
O=CC1CCOC1=O,0.2287
CC1=CN(C=O)C(=N)O1,0.1952
CCC1(C)CC1COC,0.3325
NC1(C#C)C2CN2C1=O,0.2214
N=C1OCC2OCCC12,0.2762
c1cnn(n1)CC(=O)N,0.2509
CC1(OC(=N)C=C1)C#C,0.2134
CC12C3C1C1(C)CN3C21,0.2944
OCC12CC3CC1C2O3,0.2959
N=C1NC(CO1)C=O,0.1926
COC(C=O)C(C)C#C,0.2107
O=CC12CC(CO1)CO2,0.2246
CN1C(=N)N=CN=C1C,0.179
N#CC12CC3C1N3C=N2,0.2365
O=C1NC2(CCC12)C#C,0.2611
CCCC1CC1(C)C,0.3427
CC1CCC1C,0.3663
C1C2(N1C(=O)N)COC2,0.2758
N#CCNC1=CN=NO1,0.1783
CCC(C)OCC(C)=O,0.2335
CC1=CC=NNC1=N,0.1618
[O-]C(=O)C1=CCNC1=[NH2+],0.1956
CC1C2CC=CC1(C)O2,0.2398
C(C(CO)C(=O)C#N)O,0.182
CC(C)OCC#CC=O,0.2057
CC1CC1(CO)CO,0.3146
CCc1c(cncn1)N,0.1947
CC1=CON=C1C1CN1,0.2289
OC1CC2OC3CC2C13,0.323
Cc1c(c([nH]n1)N)N,0.2413
C1CN1CCC(=O)N,0.2633
CC1CC(C)(O1)C#C,0.2839
C1C=C(C(=O)N1)C#N,0.197
O=C1OC2=NCC3C1C23,0.2173
CC1(O)CC2(O)CCC12,0.3053
CC1OC(=O)C1CCO,0.278
CCNc1ccc([nH]1)N,0.2313
c1cnc(nc1O)CO,0.215
NC1=NCC2(CO2)C1=O,0.1692
CC12CC1C=CCC2=O,0.2152
CCC1=C(CCC1)C#N,0.2155
CC(=O)NC12CN(C1)C2,0.2592
CC1CCC(C)C(=O)O1,0.2698
C#CC(=O)c1cnoc1,0.1975
CCC1(CC1C#C)C=O,0.2219
CC12CN1CC1(CN1)C2,0.3042
CC12C3C1C1(C)C3CC21,0.3284
C1C=CC23CN=CN2C13,0.231
CC1CC1CCC1CC1,0.3503
CC#CC(CO)CC#C,0.2768
CC(O)C1(CO)CCO1,0.3042
CC1C2CC(CC1=O)O2,0.2222
CC(C)C(C=O)C(N)=O,0.208
Cc1cc(oc1N)NC,0.216
CC1C2CC2C(C)C1C,0.3345
CC1(CC([O-])=O)C[NH2+]C1,0.2723
OC12CC1C(=O)CC2,0.2255
CC1(CC2CCO2)CC1,0.3221
C1C(=O)OC(=N1)CCO,0.2496
C(CNC(=O)N)CO,0.303
OCC12CC1CC(=O)C2,0.2232
CC1C2CC(O2)C1C#C,0.2937
CC(OCCO)C1CN1,0.3009
c1ccc(c(c1)C#N)F,0.2088
CC12NC1CC1NC21C,0.2875
CC1C=CC2CC12C,0.246
N#CC1NC2COC12,0.2653
CNC(C#N)C(=O)NC,0.2391
CC1CC=C(CC=O)C1,0.2088
OC1C2CC3OC1CC23,0.3241
OC(C1CC1)C(=O)C#N,0.1884
CC1(OC1C1CO1)C=O,0.2182
O=C1C2CCC22COC12,0.1989
C#CCCC1OC2CC12,0.2965
Cc1cc(no1)N2CC2,0.2344
N#CC1CCC2CCC12,0.3368
CC1CCCCC(=N)O1,0.2766
OC1CC2OC(=N)C2C1,0.2881
OC1=NOC(=N)O1,0.2668
CCOC=NCC1CC1,0.2726
C1C(CO1)CC#N,0.2864
CCC1C(C)CC1O,0.3247
N=C1CC(N1)(C#C)C#N,0.2466
CC12C3N1C1(C)C2C31O,0.2682
CC12CCC1(C=O)C2O,0.2176
OC1CC=CC11CCO1,0.2343
CCC1N2CC3C2C13C,0.3014
CC(=O)C12OC1CC2O,0.2182
CC12C3CCC1(C)OC23,0.3033
OC1C2C(O)C1N2C=O,0.2521
CC1CC=CC1CO,0.2628
O=C1CC2CC2C1,0.2233
C1CC(O1)C1C2CC1C2,0.3193
NC1=NC2CC2(CO)O1,0.2694
CC(O)C1=NNC=C1N,0.2173
CCC1=CCC(=O)N1,0.2145
CCC#CC#CC#C,0.1858
OC1CC(=O)C(O)C1=O,0.1965
CC1CCC(C)C1CO,0.3341
C1C(=CC(=NO)C1=O)N,0.155
C1NC23COC2COC13,0.2855
CC1CC=C(C)C1,0.2596
CC1OC2CCCC1O2,0.324
CC(=N)N(C)C(=O)NC,0.2514
CC1N2C=NCC12C=O,0.212
Cc1[nH]cc(n1)COC,0.2459
COCC1(CC1)C=O,0.2271
CCC12CN1C(=O)C=C2,0.1975
C#CCC(=O)C1CCC1,0.2211
N=C1CC23CC2(CC3)O1,0.2577
CC1OCC11CC1C#C,0.2842
C1CC(=NO)C(=NC1)N,0.1879
CCC12NC1COC2=N,0.2652
CC1(CN(C1)C=O)OC,0.2666
N#CC12CC(C=C1)C=C2,0.2188
CCCC1C=CCC1=O,0.2224
CC1OCC(C)(C)C1=O,0.2142
CC(N1CC1)C(C)=NO,0.2507
CC(O)C1OCCCO1,0.3437
c1c2c(on1)CCOC2,0.2379
CC1CC2CCC=CC12,0.2597
C#CC1=CCC2OCC12,0.2097
CC1C2CCC=C(C)C12,0.2474
C1C2CC3COCC1N23,0.2732
CC1C2C3C1C2(C)N3C,0.2975
CCCCOC(C)CO,0.3341
C1C2OC34C=CC(C13)C24,0.2179
Cc1cn2cnoc2n1,0.2057
Cc1c[nH]c(c1NC)C,0.2347
CC1=CC(=O)NC1(C)C,0.2169
CCC(CC#CC)C=O,0.2241
C1C23CCOC12C1OC31,0.2672
C1CC1C2COCOC2,0.3404
CC(C)NC(=[NH2+])C([O-])=O,0.1991
CC12COC3(C)C1NC23,0.3162
Cc1c[nH]c(n1)CC#C,0.2468
OC(C=O)C12CCC1N2,0.2195
C#CCC(=O)C#N,0.1953
OC1C(=O)C2NC12C#N,0.1979
O=C1CN2C=NCC12,0.2061
CC1OC1CC(=O)C=O,0.156
CC1(C)C2CC(C2)C1=O,0.2244
Cc1c[nH]c(c1CO)O,0.2321
OCC1C2NC2C2OC12,0.3033
CC(O)C1CC1CCO,0.3326
C1C(=O)C(=O)OCO1,0.1744
OC1C=CCC1OC=O,0.2622
CC1CCCC2(O)CC12,0.3261
c1c2c([nH]n1)[nH]nc2O,0.2259
CC12CC1CC2CC=O,0.2254
c1cn[nH]c1C2(CC2)O,0.2451
CCC1CCCC1C#C,0.3053
CCOC1(CC1)CC=O,0.2251
OC1C2CC2C2CCC12,0.3148
OCC12CC3CC1C3O2,0.3139
CN1CC2(C#C)C(O)C12,0.2369
CC(=O)C1(O)CC2OC12,0.2245
C1CC1C12CC3C(O1)C23,0.3075
COCC(CO)CC=O,0.2301
C1C(CO1)N(C=N)C=O,0.215
O=COC1CCC1C#N,0.2853
c1cnoc1C#CCO,0.1998
CC1C2CCC(C)(C)C12,0.3323
CC(O)C1C2C3CC1C23,0.3088
CCC12COCC1N2,0.3296
c1nc(on1)CNC=O,0.2229
CCC(O)C1CCC1C,0.3226
CC1C2C(CC12C)C=O,0.2252
CC1(C)CCOC1C=O,0.2098
N#CCNCCC1CO1,0.2718
CC12CN3C(C13)C(=N)O2,0.2558
CC#CC(=O)N(C)C,0.2235
CC(N(C)C=[NH2+])C([O-])=O,0.2383
CNc1cocc1C#C,0.1927
CC1NC1(C)C(O)CO,0.311
CN=C1NC(=O)N2CC12,0.2387
O=CC12CC1C1(CO1)C2,0.2264
CC1C=CC2CCOC12,0.2595
c1c(=O)[nH]c(c(n1)N)O,0.1638
C1CC1C1OCC2OC12,0.3431
O=CCC1CCN=CO1,0.2213
OC1=NOC(=O)C(=N)O1,0.1973
OC1C2OC(=N)C=CC12,0.2016
C(C1CN1)C1=NC=NN1,0.2681
CC12NC1CC1NC21,0.2909
C1C2C3C4C5C(C2N35)N14,0.2524
CC#CC1(C)NCC1=O,0.2073
CC12CC(OC=N1)C2O,0.2489
CNC1(CO)COC1=O,0.2544
OC1CC2CC(C2)C1=O,0.2267
CCC(=O)c1cnc[nH]1,0.1972
O=C1OC2CC1N1CC21,0.2605
CCC1OC(=N)CC1C,0.2864
CN1N=CC(=N)N=C1C,0.1788
CC#CCC1(C)OC1C,0.301
COC1CC11COCO1,0.3006
OC1C=C(CC1=O)C#C,0.2036
OC12CC(=O)C3OC1C23,0.2119
OCCNC(CO)C#N,0.2538
CC#CC1C(O)C1C#C,0.2618
O=C1C2CC(N2)C11CO1,0.1964
Cc1conc1C=O,0.1923
CC1C2CC3CC1C23,0.3391
OC1=C(NN=C1)OC=N,0.1802
ON=C1CC2(OC12)C#N,0.236
N=C1CC(O1)(C#C)C#N,0.2545
CCCC#CCC1CC1,0.2979
COC1(CC1)C1CO1,0.3171
CC(CC1(O)CC1)C#N,0.2953
C#CC1CC2CC12,0.3037
COCC#C,0.2889
Cc1cc([nH]n1)O,0.2602
c1cnc(cn1)CC=O,0.1886
NC1C2CCC2OC1=O,0.2573
C1C(=O)OC=N1,0.2478
N=C1NC(C=O)C(=O)N1,0.2017
N#CC1NC2C3NC1C23,0.2618
Cc1c(oc(=O)n1C)O,0.2401
OC1CC2(O)CCC12,0.3145
C1CCC(=O)CC(=O)C1,0.2038
CC#CC(O)C1COC1,0.2747
N=C1OCCC1OC=O,0.2648
N#CC1=CC2(CO2)CC1,0.2087
CC#CC12CC1C(=O)O2,0.2403
CC1CC2COC1OC2,0.3182
C#CC(CO)(CO)C#C,0.2916
CCn1c(c(cn1)O)N,0.2283
OCC1CC1(O)C=O,0.2227
COC(=O)C(C)(O)CO,0.2687
CC(=O)C1(O)CC1CO,0.222
C(C=O)c1[nH]c(=O)on1,0.2202
CC12CCC1C(=O)C2O,0.2109
CC1OCC2(C)COC12,0.3158
CCC1CCCC11CC1,0.3413
C#Cc1ccnc(c1)F,0.2052
CN1C2C3CC3(C=O)C12,0.2163
c1[nH]c(=O)n(n1)CC=O,0.199
CC1C2OC(C)C1C2O,0.2983
OC1CC2OCCC12O,0.2989
CC1(O)C2NC2C1=NO,0.235
CC1C(C#CC=O)N1C,0.1736
N=C1C2CCC2N1C=O,0.2281
CCN1CC1CC=O,0.2075
CC12CC1OCC(=N)O2,0.2647
CC1C2OC2CC2CN12,0.3105
OCC#CC12CN(C1)C2,0.2576
OC12CC(C1)C1(CO1)C2,0.3308
C#CCCCC1CCO1,0.3022
OCC#CC12CC1CO2,0.2413
CC(=O)C12COCC1N2,0.2201
CC1CC1CCC#N,0.3206
CC1CN=C(O1)N1CC1,0.2695
OCC1C2CC1C(O)C2,0.3338
CC1C(C)C11CC(C)C1,0.3306
OC1C(O)C11COC1=N,0.2699
CCOC(=O)CCC=O,0.2304
ON=C1CN2CC1C2,0.245
N=C1OCOC1C1CC1,0.2838
Cn1cc(nc1)C#N,0.2297
CC(CO)C1=CNN=N1,0.2467
OCC1CC=CC1C#N,0.2619
c1c(cnc(c1F)F)F,0.2121
c1c[nH]c(c1C=O)N,0.1839
CO,0.3437
C#CC(=O)N1CCC=C1,0.1809
CC1C(C=O)N1CC#C,0.1978
CC1OC(=N)OC1C#C,0.266
CC(O)C1CC1C#C,0.29
CC1NC(=O)C(C)=C1,0.2219
CC1C2C(O)C2C1=NO,0.2433
CC#CC1C(C)CC1O,0.2886
CCC1N2CC1(C2)C#C,0.2749
C1C2CC3=CC1C1C2C31,0.1717
C1CC2OCC1CC=C2,0.2545
CC(CC1CC1)C(C)=O,0.2296
CC1CC2NC2C2OC12,0.3085
OCC1C2C3C2C(=O)N13,0.2423
CC(C#C)C(C)C1CO1,0.3106
CCC12OC1CC21CC1,0.3226
CC12C3OC1C(C=O)C23,0.2097
c1c(n(nn1)CC=O)O,0.2009
CC1(C([NH3+])C1O)C([O-])=O,0.1612
NC(C1CN1)C(F)(F)F,0.3242
N=C1CC2(COC2)O1,0.2824
C1CC2(CC2)OC=NC1,0.2586
CCC1OC2CN3C2C13,0.3093
COC(C)(C)C1CN1,0.311
CC1NC(=O)NC1C#C,0.2751
OC1C2CC3CC3C1O2,0.2987
CC1(CCOC1=O)C,0.277
C#Cc1cc(=O)[nH]cn1,0.177
N#CCC1C2CC1C=C2,0.2414
CC(O)C1=NC(N)=CO1,0.2118
OC12CCC(C1)C1CC21,0.3191
CC1C(=O)C=CC1(C)C,0.1917
C(C=O)Nc1n[nH]nn1,0.2033
CCC1C(C)C(=O)C1C,0.2205
C1COc2c1oc(=O)o2,0.2375
O=C1CC2C3C1N=CN23,0.2063
CC1=NOC(=N)C(=O)O1,0.199
CN1C(=O)ON=NC1=N,0.1811
c1c(c2c(o1)OCC2)N,0.2254
CCC1CC11CN=CO1,0.258
O=C1CNCC2OC2C1,0.1939
CC1C(O)C(=N)N1C=N,0.2193
CC1CC(O1)C#N,0.2819
C#CC1(CC2CC12)C#N,0.2894
C1C2OC1C1COCC21,0.3208
Cc1c(cncn1)OC,0.2092
OCC1CC1C1(O)CC1,0.317
OC1CC11CC(O)C1=O,0.2011
CC1C2C3CC3C12,0.2833
CC1CC(C)C1(C)C#C,0.3018
COC1=C(C=O)N=NO1,0.1815
CCCC(=O)C(O)CO,0.2262
COC12CC(CC1)C2C,0.328
COC1CC=CC1=O,0.1718
OC1C=CCC1(O)C=O,0.2179
O=C1C=CCCC11CO1,0.1852
O=C1CN2CC11CCC21,0.2053
C#CCc1cnoc1,0.2466
NC1=COC=C1OC=N,0.2156
O=C1CC2OCC=C2C1,0.2063
C1NC1C1OC11CCC1,0.3196
c1c(onc1O)N,0.2407
CC1C2(C)OC=NC12C,0.2553
ON=C1CN=C2NCC12,0.2295
CC1(CCCC(=O)C1)C,0.2237
CCC1CC2(CC2C)C1,0.3384
Cc1ccc([nH]1)CC#N,0.2299
Cc1cc(ccc1O)N,0.189
N=C1NC(=O)C2CC1O2,0.2327
COCC(C)([NH3+])C([O-])=O,0.2682
CC(=NO)C#CCO,0.2028
OCCC1OC2CNC12,0.3001
CC1C2C(O)C2C1C#C,0.2821
C1C2C1C1OCOCC21,0.3249
c1nn(c(=O)o1)C(=N)N,0.2249
CC1C2C(=O)NC12C#C,0.2346
N=CN1CC1(C=O)C#N,0.2158
COCC(O)CNC=O,0.2837
C1OC23CCC(C=C2)C13,0.2425
CC1CCCC2C(O)C12,0.3135
CC1NC11COCC1O,0.3117
CC(C)(C)c1nnon1,0.2459
CC1C2OC3CC3C12,0.3139
c1c(cc([nH]c1=O)F)N,0.1933
CN1C(C#N)C1(C)C#C,0.2467
CC(NC=O)C(O)C#N,0.2591
CC(C#C)C(C)(C)CO,0.3117
CC12CC=CC1CO2,0.26
CC(=NC)N(C)C(=O)N,0.2369
OC12CC1N=C1OCC21,0.2399
CN1C2C3(CC3)CC12C,0.3179
CC1C2CC(O2)C11CO1,0.315
N#CC1CC2C3CC1C23,0.308
OC(C=O)C1C2CN1C2,0.2017
[O-]C(=O)C1CNC(=[NH2+])C1,0.2644
C(CNC=O)C#CCO,0.2682
c1cnc([nH]1)CO,0.2491
c1c(cn[nH]1)C(=O)C=O,0.1551
COCC1=NCC(=O)O1,0.2406
CC1C2C3COC2(C)C13,0.3323
[NH3+]CCOCCC([O-])=O,0.129
N=C1OC2(CC#C)CC12,0.2798
CC1C2C3CCCC2C13,0.3694
c1c([nH]nc1O)C(=O)N,0.1986
C1C(CO1)C(=O)CO,0.2199
CC12CC3(CC1N23)C=O,0.2133
CC(CO)(CO)C=O,0.2184
CC1CC(O)C(=O)C=C1,0.1929
CNc1c([nH]nc1O)O,0.2606
COC1C=C(C)C2CC12,0.2408
CC12C(O)C1OC2C=O,0.1968
CC1C2OC3C2OC13,0.3045
OC1COC(C#N)C1=O,0.2148
CC1(O)C2NC3C2OC13,0.2808
OC1(CC1)C12CCC1N2,0.3032
CC1C(OC1C#C)C#C,0.2574
CC1CC1(C)C(C)=NO,0.2508
CCC1CC11CC=CC1,0.2638
CCC(=O)n1nnnn1,0.2128
c1cc(ncc1O)CO,0.2045
CC1=CC(O)COC1=N,0.2189
COC1(CC1O)C(C)O,0.2919
O=C1C=CC2OCC=C12,0.1781
O=C1CN2C(CC#N)C12,0.2167
COC=NC1CCC1,0.2654
OCC12C3CN1CC2O3,0.2766
COC(=O)n1cnnc1,0.2256
N#CCN1C2C3OC3C12,0.2679
CC1N=C(CO)NC1=N,0.2325
O=C1OC2CC2OC1=O,0.2072
CC1C2OCCC12CO,0.3002
O=C1CCC2(CO2)C=C1,0.1833
COC1(C)C(C)C1C,0.3125
CC(CO)C1OC2CC12,0.3056
OCC1CC=CNC1=O,0.2099
CC1(O)COC(=N)C1O,0.2809
C(CO)C(=O)COC=O,0.2308
CC1CC11CCC(=O)O1,0.274
CCC1(CC#N)CN1,0.2921
CCN=COC,0.2729
CC12OC1C1CC1C2O,0.3188
CC(O)C(C)CC(N)=O,0.2801
CCCc1c(cc[nH]1)O,0.2274
CN1C2C3C4C2C1C34O,0.2757
CC12C3CC(N13)C2(C)O,0.3062
CC(C)C12CC1CO2,0.313
CN1C2CCC(C)(C)C12,0.2884
CC12CCCOC1CO2,0.3276
OCCOCC1CO1,0.3354
COC(C)C1(C)COC1,0.3056
OCC1(CO1)C#C,0.2835
CN1CCC1C=O,0.199
CC#CC1CC2(O)CC12,0.2949
CCOCC(C)CC,0.3352
c1nc2c(o1)C(=O)OC2,0.2183
OC1(COC(=O)C1)C=O,0.2166
OCC(CC=O)NC=O,0.2284
O=C1CCOC2CC2O1,0.2541
CC1(CC1CO)C1CC1,0.3214
CC(=O)c1cncn1C,0.1971
O=C1CNC2CC3C2C13,0.1948
COC1(CCCC1)C#N,0.3031
CNC(=O)C1NC1C#C,0.252
CC1=C(CC2NC12)C#C,0.1986
OC12CC(C1)C(C2)C#C,0.3039
COc1c[nH]nc1C=O,0.1909
CCN=c1n(cco1)C,0.2122
OCC1CCC=CC1=O,0.1855
CC(OC(N)=O)C1CC1,0.3239
COc1cccc(n1)N,0.1996
CNC(=O)C12CC(C1)C2,0.2656
CCC1COCC(=O)N1,0.2632
CC(C)(C)N(C)CC#N,0.2564
CC(C)(C)CC(=O)C#C,0.2041
ON=C1C2CC3OC1C23,0.233
CCC1(O)COCC1O,0.3186
C1C(=O)C2(CO1)COC2,0.2111
OC1CNC(=NC1)C#N,0.208
C#CCC12CC1CCO2,0.2826
COC1CN=CNC1=N,0.2266
C1C2C1C1N=COCC21,0.2613
CC1(CC1C#N)C(N)=O,0.2626
CC1CCC2NC12C#C,0.2666
CC1(C)OC1C(O)CO,0.3149
C1C2OC2C2=C1NC=N2,0.2366
O=C1CC(O1)C#CC#C,0.2173
CC(C)c1cn[nH]n1,0.258
OC1C2C3NC3C12C#N,0.244
FC1=NOC(=N)C=N1,0.159
[NH3+]CC(CC#C)C([O-])=O,0.2723
CC(C)(O)C12CC1CO2,0.2994
Cn1cnc(c1O)C=O,0.1984
O=CC1C2C3CC1N23,0.2102
CC(O)C(C)C(C)C=O,0.2273
CC1(O)C2CC(O)C12O,0.284
CC1OC2CC(C)OC12,0.3254
C1C2N3CC22OCCC132,0.2949
CCC12CCC3CC1C23,0.3368
c1(nnon1)NC(=O)N,0.2071
CCC(C#C)C(=O)CO,0.2297
CC(C#N)C1OC1C=O,0.2159
CC1(CCOC1)C=O,0.2294
CN1CC1COC=O,0.2471
CC12C3CC1C1(CC1)N23,0.3259
CC1CC(C1)NCC#N,0.2647
CC1CC2OCC12C=O,0.2155
COC1CCC(=C1)C#N,0.2186
Cc1c(c[nH]n1)CC#C,0.2609
CC#CCN=COC,0.2666
OC1C(=O)CCNC1=O,0.2214
Cc1ccc(o1)OC=O,0.2113
COC1CC(CC#N)C1,0.2906
CN1CCC(C1)C#N,0.2571
CC(C)(C)C(CO)CO,0.3311
CC1=NC2CC2(O1)C#N,0.2592
OCC1OCC2NC12,0.3047
C(CO)n1nc(nn1)O,0.2322
c1cc(ccc1F)F,0.2192
C#CC12CC(C1)(N2)C#N,0.2586
O=CC1CC2CC(=O)C12,0.2122
OC1COC2=C1C=CN2,0.2374
CNc1nccc(=O)o1,0.1866
C1CC2COCOCC12,0.3281
[NH3+]CC1CN1CC([O-])=O,0.2531
CCC(=O)C1(CC1)C=O,0.2225
OC1CCCC11CCC1,0.3182
CC1(O)C2C3OC1(C)C23,0.2905
CC1(CCO)OC1C=O,0.215
CNc1cnoc1CO,0.1922
C#CC#CCC#CC#N,0.21
O=CNC1C2CC1CC2,0.2741
CC1C=CC2OC1C=C2,0.2286
CC#CC(=O)NC(=N)N,0.1904
CCC1CC1(CO)OC,0.3103
CC1C2OC11CCOC21,0.2955
CC(C=O)C(CO)C#C,0.2238
CC1N=COC1(C)C,0.2714
c1cn2c(c1N)CC=C2,0.1761
COC=Nc1cc[nH]c1,0.2007
CC1C2CC1(O2)C#C,0.2541
CC12C(O)C1CC21CC1,0.3175
Cc1c(nn(n1)C)C,0.244
CC1(O)C=CCCC=C1,0.2534
CC1OC(CO)=NC1C,0.2732
O=C1CCC2CC(C2)O1,0.2666
CC1(CCCCO1)C,0.3194
NC1CCC(=N)OC1=O,0.2375
CCC(O)C1CO1,0.3486
c1cc([nH]c1)C2CC2,0.2388
O=C1OC2CC3CN3C12,0.2456
OCC1COCC2NC12,0.3063
OCCC1(CO)CO1,0.3312
CC(OC(C)=O)C(C)=O,0.2303
CC1(CN=C(N)O1)C=O,0.2028
c1coc2c1CN=CO2,0.2042
CC12CN1CC(C2)C=O,0.2125
CC1C(OC11CC1)C=O,0.2048
COC1C(C)C1C(C)O,0.3102
CC(C)C(=N)OCC#N,0.2838
C#CC12CC1(CC2)C#N,0.2426
N=C(NCC1CN1)C#N,0.2124
CC12CC1C(=O)OC2,0.2717
CCC1(O)CC1N1CC1,0.3055
COCC1(O)CC2OC12,0.3219
CC1CC2NC2(C)C=C1,0.2493
CC#CCC1CC2OC12,0.2999
c1cnc2c(n1)cno2,0.1848
CC12CCC1=CNC2=O,0.2019
COC12C3OC(C13)C2C,0.3044
CC(OC(C)=O)C1CC1,0.2843
C#CC1NC2CC12C#N,0.249
O=CC1C=CC2COC12,0.2267
c1c(=O)onc(n1)O,0.1616
CC1CCCC(=C1)C#N,0.2234
CC(=O)Nc1ncno1,0.2286
CC1CC1CC(N)=O,0.2737
COC=NC1CC(C)C1,0.2642
c1c(oc(n1)O)NC=N,0.2405
O=C1C2C3C1CC23C#C,0.2359
CCC1C2OC2CC1O,0.3375
N=C1NCCC(=O)C1=O,0.1381
CC1(CC(CO)O1)C=O,0.2134
CC1CCCC2COC12,0.317
FC1=COC(=N)C=C1F,0.1667
COc1c(=O)[nH]ccn1,0.1763
C1C2CC3COCCC123,0.3365
[NH3+]CC1=C([O-])NN=N1,0.2355
CNC(=O)CCOC=O,0.2696
OC1(C#C)C2COCC12,0.2703
CC1NC1C1=NOC=N1,0.2314
c1c[nH]c2c1CCO2,0.2318
COc1ncco1,0.246
CCC(O)C1NC1(C)C,0.3103
Cc1c(c(=O)[nH]cn1)F,0.1955
OC1C2OC(=N)CC12O,0.2701
C(C1CO1)C12CC1CC2,0.3331
C1C2CC3CC=CC12O3,0.2338
CCC1CN1CC1CN1,0.316
OCC1OC(=N)C11CN1,0.2668
N=C1OCC1CC#N,0.2859
C1CC11CC2OC=NC12,0.2621
CC1=NC2(C)CC2CO1,0.2511
O=CNC1CC2OC12,0.2756
CC1CC2CC1OC2=N,0.2862
OC(CNCC#N)C=O,0.1993
N=C1OCOCC1C#N,0.2688
C(C(=N)N(C=N)C=N)O,0.2187
CC1CC(C)(C)CC1C,0.3672
C1CC1(C2=NCCO2)O,0.2569
C1OC2C1C1OCOC21,0.2943
CC(C)c1c[nH]c(=O)[nH]1,0.2339
C1C2OCC3COC2C13,0.3113
C#CC1=C(CCC1)C#N,0.1803
CC1CNC(=O)OC1,0.306
CC1(N)CN(C=O)C1=O,0.2009
CCC1OCOCC1=O,0.2051
C1C2C3N=COCC3N12,0.2477
C1CC(O1)C1C2COC12,0.299
O=COCC(C=O)C#N,0.2239
CC(=NC)OCC(=O)N,0.27
OC12C3OC1C(=O)OC23,0.2394
CCCC(=O)CN1CC1,0.2285
O=C1C2NC2C1C1CC1,0.2128
CC12CC3C1CC2C3O,0.323
C1CN1C1C2CC1O2,0.3079
CC1(CC1)c2c[nH]nn2,0.2354
Cc1cc(noc1=O)O,0.1762
C(C(=O)N)OC(=O)C=O,0.1819
CCC1CC2(C)CC12C,0.3161
CC#CC(C)(C=O)C#N,0.2183
CC1(CCN2CC12)C#N,0.2818
CCN=C1OC2CCC12,0.272
CCOCC(CC)C#N,0.3038
CCN1CC1C(=O)C#N,0.1618
C1C2C3C2C2(COC2)C13,0.325
c1c(cn(n1)CC=O)O,0.182
Cc1c(c(=O)cco1)N,0.1777
C1C2OC11CCOCC21,0.3133
C1C2OC34COC3C1C24,0.301
CC1(CC#C)CC2CC12,0.3083
CCC1=CC2(C)OC2C1,0.2419
CC12CCC(O1)C2O,0.3348
CC1CC(CO)CC1O,0.3102
COCC1CCC=C1C,0.2582
CC1=COC(=N)N=C1,0.1618
CCCC1CC(C)(C)O1,0.3218
CC(=O)C1C2C3CC3C12,0.2021
c1c(c2c([nH]1)C=CC2)N,0.1698
C1CC1c2c(n[nH]n2)O,0.2216
COC1CC(C)CC1=O,0.2006
CCC1OCCC(=O)O1,0.272
O=C1C2C3C(C#C)N2C13,0.2244
CC1(CC2OC12)C#C,0.2977
CCCCC(C)C=O,0.2267
OCC12CC(C1)C2=NO,0.2713
CC1=NCC2N1CC2=O,0.2031
CC12CCC1(CO)N2,0.2712
C(=O)n1c(n[nH]c1=O)N,0.1898
C1C=CC2NC2C2OC12,0.2342
CC1CCC2OCC2=C1,0.2503
N=CN1C2COC(=O)C12,0.244
CCC12NCC1OC2=N,0.2577
N#CCOC1CCOC1,0.2655
COC1C(O)C1(O)C#N,0.2641
CCn1cnccc1=O,0.1954
CC([NH3+])(C1CO1)C([O-])=O,0.2677
c1cn[nH]c1O,0.258
CC1OCC1(C)CO,0.3079
CC1CC2(CC#C)CC12,0.3012
OCC(O)(CC=O)C#N,0.2236
O=C1COC2CC(C2)O1,0.254
C1OCC2C3C4C1C2N34,0.3103
CC1CC(O)CC1CO,0.3086
OC1C2OC2(C#C)C1=O,0.1992
C[NH2+]C1CC1(C)C([O-])=O,0.1473
CC1=CC(C=O)C(=O)C1,0.2055
OC1C=CC2OC2C1O,0.2326
CCC12C3CC1(O)CN23,0.2886
c1(c(oc(n1)O)N)N,0.226
CC(CO)(CO)CO,0.2982
O=C1OC2CC2C11CN1,0.2545
OCCC1OCC11CC1,0.3159
c1c(n[nH]c1O)CO,0.2521
C1CC11CC=CC11CN1,0.2451
CC12CC1C(CCO)C2,0.3247
C1OC2C3OC3C2=C1,0.2271
C1CC2COCC(O1)O2,0.3108
CCC1(OC)C(O)C1O,0.2716
c1nc(=O)c(c(o1)F)F,0.2094
CCC1OC(=N)C11CO1,0.2711
CCC12CC3C(O1)C23C,0.3017
CC#CC1OC1C#CC,0.2532
N=C1OC(=O)ON=N1,0.1902
CCc1c(c([nH]n1)C)O,0.2323
c1cnoc1CCCO,0.2448
CN1C2CC3C2C13C#N,0.2399
CC1(C)NCCOC1=N,0.2542
CC(O)C1C(O)C1O,0.2829
N=C1OC2CC3C2OC13,0.2552
COc1ccc(nc1)O,0.1897
CCC12CCC1CO2,0.309
CNC(=O)C(C)C#C,0.2737
CC(C)(C)C#CC1CO1,0.2748
CCCCC(CO)CO,0.3118
C1OC23C=CC4C2NC134,0.2036
c1(c(=O)[nH]c(=O)[nH]n1)N,0.1728
OC12C3CC3C1NC2=O,0.2507
CC12COC3C(N1)C23O,0.2684
CC1(OCC2OC12)C=O,0.2103
CC1OC2C3C1CC23O,0.2993
CC1C2CCC1(O)CO2,0.3001
c1c(c2n(n1)CC2)N,0.2268
CC12CC(=O)NCC1N2,0.2692
Cc1c(c[nH]c1O)N,0.2225
COCC(C)C(N)=O,0.2745
C#CC1C2C3C4C3N2C14,0.2708
COc1c(n[nH]n1)C#C,0.2054
Cc1c2c(c[nH]1)C=CC2,0.1961
C1OC2C3C=CC2C13,0.2334
N=C1OCOC2CCC12,0.2788
CC1(O)CC(C)(C1)C#N,0.31
CC12CC1NC=CC2=O,0.1852
OC12C3C1C1C3COC21,0.3053
C1CC2(C1)CNC2=O,0.2782
CC(C)NC(=O)NC=N,0.2413
COC1C2C3C4C3N2C14,0.2879
OC12C3CC11C=CC2C31,0.218
CC(C#C)C#N,0.2995
NC1(C#N)C2C3CN2C13,0.2724
CC(C#N)C1(CO1)C#C,0.2857
C1NC1C1=CN=CO1,0.2316
OCCC(=NO)C1CN1,0.2375
NC(=O)C12NC3C1NC23,0.2528
C1C(=NO)C2(O1)COC2,0.2394
OCC#CCC(O)C=O,0.2064
Cc1cc(ncc1O)O,0.19
CC1OCC2=C1OC=C2,0.2306
O=C1C2C3C(C#N)C1N23,0.2331
CC1C2COC(C)OC12,0.3259
NC(CO)C1=CN=NO1,0.2235
OCC1CC([NH2+]1)C([O-])=O,0.2615
C1CC1C(=NO)CO,0.2421
CNc1cnc[nH]c1=O,0.1736
CC1(C=O)C=CC2CC12,0.2011
O=CC1CC(CC#C)O1,0.2126
c1c(c(=O)c(c[nH]1)F)N,0.1753
c1c(nc(oc1=O)N)N,0.1991
OC1C2OCCC12C#N,0.2862
CC12CN1C(C2)C1CO1,0.317
CCC(=O)n1cnnn1,0.2213
C1CC23C4NC12C1C4N31,0.2707
C1C23CCC12C=CC3,0.2345
C#CC(=O)C#CCO,0.1914
COCC1C=CCC1C,0.2632
OCC1(CO)OC2CC12,0.298
CCCC1(CCO1)C#C,0.2786
OC12C3OC(CC1=O)C23,0.2057
c1c(nc([nH]1)C#N)O,0.1855
O=C1NC2C3NC12C=C3,0.2025
CC1CN1CCO,0.3152
CCC12CC(CO)(C1)C2,0.3378
O=CN1CC2CC2C1,0.2676
CNC(=O)C1(COC1)N,0.2644
N=C1NC(=O)CC1C#C,0.246
NC1=CC(=N)NC(=N)O1,0.2128
CC1OC11CCOC1=O,0.25
C#CCOC1CC1,0.2828
CC#CC1(CC#C)CN1,0.2705
C1C2CCC3=C2C1OC3,0.2035
C1OC2CC3=CCOC123,0.2253
C1C2C3OC4CN(C13)C24,0.2945
Cc1coc(=O)c(=O)o1,0.178
OC1C2CC11OC(=N)C21,0.26
O=CC12C3C1N1C3CC21,0.2053
CC12CC1(O)C(=O)NC2,0.2631
[O-]C(=O)C(=O)C1C[NH2+]C1,0.1818
CC1OC(CO)C1C#C,0.2832
CC1COCCC=C1,0.2556
CN1CC1CCC(C)=O,0.2119
CC(=O)C(C)(O)CCO,0.2266
CC1C2C3CC1(O)C23,0.3073
CC#CC1=NCC(=O)O1,0.2163
OC1C2OC1(C=O)C=C2,0.2145
CC(C#C)C1=NNN=C1,0.253
CN1N=NN(C)C1=N,0.2008
OCC1NCCCC1=O,0.2075
CCN1CC2(CO2)C1C,0.2977
CC1(NC1C1CC1)C#N,0.2801
CC#CC#CC1(C)CO1,0.2146
NC(=O)C1OCOC1=O,0.2398
CC#Cc1cncnn1,0.1615
CC(=N)NC(=O)C,0.2331
CC1(O)CC2CCOC12,0.3131
C1Cc2c(nn[nH]2)NC1,0.2062
COC(CC(N)=O)C=O,0.2006
N#CC1CCC2CC2O1,0.2822
CC12NC1C(=O)C1NC21,0.1885
CCC1C(C)C(C)C1O,0.3044
COC1C2C3CC1(O)C23,0.3087
CCc1ccc(o1)C#C,0.1911
NC12CC1C1NC21C#N,0.2357
Cc1cc(oc1)N,0.2261
CC1=CC(=O)CC=CC1,0.1834
O=C1OC2CC1C=CC2,0.2417
CN1CC1CC#N,0.2717
C1CC1(CCC=O)C#N,0.2277
CC1OC=NCC1(C)C,0.2709
CC1CC2=C(O)C=CN12,0.2269
CC(C(C)=O)C(F)(F)F,0.2305
CCC1=CC2(CC1)CC2,0.2424
OC12C3CC4C(C14)C23,0.2985
CC1C2OC1C21COC1,0.3162
CC12COC3CC(O1)C23,0.3169
CC(C)C1COCO1,0.3296
OC1CC2C(C#C)C12,0.2889
CC12C(CO)N1CC2O,0.2909
CN1CC1C(=O)C#C,0.1685
OC12CC(C1)OC=NC2,0.2699
c1c2c(n[nH]1)NCC=C2,0.1788
O=COCC1C2COC12,0.2677
NC(=O)NCC1CN1,0.2806
OC1C2NC1C(O)C=C2,0.2232
CCC1CC2=CCOC12,0.2346
N=C1OCCNC1C#N,0.2468
c1c([nH]c2n1cnn2)O,0.2361
CCC1(C)C2CN2C1C,0.3016
C1NC11C2OC1C21CN1,0.3022
CCC(O)C(C)CO,0.3301
CNC1C2COC12C#N,0.2228
c1noc(=NCC#N)o1,0.2402
c1c(nn[nH]1)CCC#N,0.254
O=CC1CC2C3C1CN23,0.2048
c1c(c(ncn1)C#N)N,0.168
CC1(O)CC11COCO1,0.3061
CC1(COC=N1)C1CC1,0.2706
C1CN1C(=O)C(=N)N,0.1953
CC12CC1C1(O)C(O)C21,0.2747
c1cn(nn1)C(=O)N,0.2307
N=C1CN2CC3C(O1)C23,0.2497
CC12OC(=N)C1C1NC21,0.2693
Cc1c([nH]c(n1)C#N)N,0.1854
CN(C=N)c1ccco1,0.2062
NC1=COC(=N)C=C1O,0.1585
NC1(CCC1O)C#N,0.2749
OCC1CC(=O)O1,0.2821
CC1C2C3C(C)C2(C)C13,0.3661
C(CNC(=O)C=O)C#N,0.1754
N=C1OC2CNC2C1=O,0.171
CC12CNC(C#N)C1O2,0.2724
N=C1OC2C(CC#C)C12,0.2752
CCC1(C)CC(=O)N1C,0.278
CCC1(O)C(C)C1(C)O,0.2955
C1C2C3C4OCC2N1C34,0.3082
CN=C1OC2OC1C=C2,0.2248
CC12C3N4C1C2(O)C34C,0.2657
CN=C1NC=C(F)C=N1,0.1392
C1OC11C2CC1C2,0.3559
N#CCC1C2C3OC1C23,0.285
CC(C)CC#CCC#C,0.2874
C1CC(C1)c2nnon2,0.2359
CNc1cnn[nH]1,0.2295
CC12CC1C=CC21CC1,0.2351
CC(C)(OC=N)C(N)=O,0.2651
ON=C1C2C3CC1CC23,0.2498
CC#CCOC1CCC1,0.2834
CNC(=O)OCC#C,0.2829
CC(=O)CCOC=NC,0.2276
CC1(O)C2C3C2C(=O)C13,0.2414
CC1COC(C1)C=O,0.2162
CC1(C)C2CC1C21CO1,0.3365
CCC12OC1(C)CC=C2,0.247
COC(=O)NC(=N)N,0.2483
OC1CC(=O)C=C1C#N,0.1669
C[NH2+]CC1=NOC([O-])=C1,0.2059
C1C2COCC3OC3C12,0.3191
c1c(nco1)NCCO,0.2121
Cc1cc(nc(n1)O)C,0.2144
CC(C#C)C(C)(N)C#N,0.2896
CC1NC1C1(C)CN1C,0.2876
CC(O)C1COCC1C,0.3079
CCC1NC1CO,0.3185
N=C1CCOCO1,0.2774
CC1CC(CO)C(C)O1,0.3128
CC1=C(COC1=N)C#C,0.1848
Cc1nc(on1)C#C,0.2135
C1CC(C1)(C#N)O,0.3007
O=CC1NC(=O)C1C=O,0.2082
OCC(O)C1=CN=NN1,0.2517
CC1CC2OCC(=O)C12,0.2098
C1CC1OCC(=O)C#N,0.1752
CC1C2CC2CC1C#N,0.3136
Cc1c([nH]c(=O)n1C)O,0.2267
CC12CC(C1)C2OC=N,0.2801
CC(O)COC(N)=O,0.3224
CC(C)(CO)OCC#C,0.2892
CC(C)C1(CO1)C(C)C,0.334
OCC(O)CC(=O)C#N,0.1901
OC12COCC1C2C#N,0.2934
c1coc(n1)C=O,0.1897
CC1CC(CO1)C#N,0.3046
OCCC(O)C(=O)C#C,0.1937
CC12C3C4CC1(C)C4N23,0.3048
CC(C)C(C)C1CC1,0.3599
C1OC11C2CC1C=CC2,0.2512
CCC(O)C1(C)COC1,0.3006
CCN=C(N)N(C)C=O,0.2302
CC1CC2OC1C1OC21,0.3289
OC1CC11COC=NC1,0.273
C1CN1C(=O)C#CC=O,0.1931
CC1(CO1)C1CC1,0.3549
O=CC1NC1C=O,0.2132
CC1(CC=O)OCC1O,0.223
CC1CCOC1=N,0.2843
C1COCc2c1non2,0.236
CCC(=NO)C(C)C=O,0.2065
OC1CCOCC1C=O,0.2216
CC(=O)C(=O)C(=O)C#C,0.1385
CC(=O)c1[nH]ccn1,0.1903
OC1CC=CC(O)C1=O,0.224
CC(C)C(CO)CO,0.3231
C#CC12CCC=C1CO2,0.2418
CC#CC#CC1(CC1)C,0.216
Cc1c(oc(=O)[nH]1)C=O,0.1775
OC1C2OCC(=O)C12O,0.2091
CC1CC11CCCC=C1,0.2498
COC1CC(O)C2NC12,0.3116
OC12C3C1C1(O)CN3C21,0.2834
CC1(O)CC11CCOC1,0.3134
CC(=O)N1CC(C1)OC,0.267
CC1(CO)CCCC1=O,0.2174
CC12CC3(C)CCC1C23,0.3313
Cc1c(=O)cc[nH]c1N,0.1997
C1C2C3C4COC3C1N24,0.3196
CC1(C)C2C3OCC1C23,0.314
CC#CCC(O)CC#N,0.275
OC12CCC=C1C=CC2,0.1983
CC1=CC(C)(OC1)C#C,0.2518
CCN1CC1(C)C(C)=O,0.2168
N=C1CC2C(O1)C1CN21,0.2693
CC1OCC2CC3C1N23,0.3142
OC1(C=O)C=CC2OC12,0.1997
OC1C(=O)CC1(O)C=O,0.2166
C1CC(O1)C1=COC=N1,0.244
CC1=NC(N)=NC(=N)O1,0.189
CN1C2CC3(CC3)C12,0.3182
CN1CC2(O)C3OC2C13,0.2765
ON=C1CC2C3CN3C12,0.2174
CC1CC(CO)N2CC12,0.3078
CC12C(O)C1CC2=NO,0.2432
OCCCN1CC1C#N,0.2686
O=CC#CC12CC1OC2,0.1893
CCC1C(OC1=N)C#C,0.2759
CNC12CN=C3NC1C23,0.1645
CC(O)C1(C)C(C)C1O,0.2863
CN1CC1C1CC1(C)C,0.3005
C(=O)c1nc(c(o1)N)N,0.153
C1CN=C(NC=N1)CO,0.2276
CC1(COCCO1)C,0.3171
NC(=O)CC1CO1,0.2707
N=C1OC23CN(CC2)C13,0.2355
CC12CC(O1)C(O)C=C2,0.2391
CC1OC=NCC2NC12,0.2652
c1c2c(c(o1)N)ocn2,0.1708
CC(C)C(=O)OC=N,0.2512
C#CC1COC2(CC2)C1,0.2843
C#CCCc1c[nH]cn1,0.2527
N=C1CC(CC#N)CO1,0.2828
CC12C3NC3C1(C)C2O,0.2875
CC1=COC2=C1N=NO2,0.1366
C1C2OCCC3OC2C13,0.299
CCC1CC=CNC1=O,0.2129
OC1=NNC=C1C1CN1,0.2329
CCC1CCOC(=N)C1,0.278
CC1CC(=O)C1(C)C#C,0.2115
CCC12CC1(C)C(=O)O2,0.2723
CCCC1(C)C2CCC12,0.3305
OCC1C2CC(=O)C1O2,0.2107
C1C=C2C=CCN2C1=O,0.168
CCc1nccnn1,0.1633
CC12COC1=NCC2O,0.2614
COCC(C)C1CC1C,0.3368
OC(C=O)C1C2CC1C2,0.2317
CN1CC1C(=O)C(N)=N,0.1661
COC1CCC=CC1C,0.2677
CC1C2NC(C=C2)C1=O,0.1923
OCCC12CC(C1)C=C2,0.2386
CC(O)C1N(C)C1(C)C,0.2862
CC(C[NH3+])C(C)C([O-])=O,0.277
CN1C2C3CC1(C#N)C23,0.2388
CN1CC1(CO)C(N)=O,0.2522
ON=C1CCC1O,0.2483
N=C1NCCCOC1=O,0.1998
Cn1c(nc(n1)N)C#C,0.1844
COC1OC(=N)OC1C,0.3081
OCC1=NC2CC2CO1,0.2572
CC1OCC=C1C(C)=O,0.1836
CC1CC2CC3OC3C12,0.334
CN1C2CC1C=C2,0.2183
CC1OC2C(CC12)C#C,0.2853
CCCCC(=O)CCO,0.2346
Cc1cn2c(c1O)CC2,0.2303
CCC1(CC1)CC,0.3437
c1cnc(=O)oc1O,0.1852
C1CN(C1)C2=NCCO2,0.2661
CCNC1=NCC2OC12,0.24
OCC12CC1C1CC21,0.2853
CC1(CO1)C1CC2NC12,0.3055
c1cc2c(nc1)COC2,0.2084
CCC(CO)C(=O)CC,0.2314
CC1CCC(O)C1C#C,0.2925
C#CCc1cnccn1,0.1947
CCC1OC(=O)C1(C)O,0.2626
CN1CCN(C1=O)C,0.2879
C(C=O)C(F)(F)F,0.2297
NC1=C(F)C(=N)ON=N1,0.1458
CC1C2C3C4N3C2C14O,0.2904
CC1(O)CC1NC=O,0.2675
CC1CCC2OC2C1,0.34
CC1(CC=O)C2COC12,0.2172
N=C1CN2C3CC(O1)C23,0.2634
CCC(=O)C(O)C#CC,0.2193
OC1C2CN(CC#N)C12,0.2542
N#CC1(CCN1)C1CN1,0.2638
c1cnc(cc1F)CO,0.2406
CC12CC1(N=CN2)C#C,0.2475
N=C1OC(=O)CC=C1,0.2205
CC(O)C(C)(C)NC=O,0.2753
COC1(C)C2CCCC12,0.3123
OC1=NOC(OC=N)=N1,0.2313
c1nc(=O)nc(o1)C=O,0.1585
CC1CCC2OC2C1O,0.3298
CCC(=O)n1cccc1,0.1926
CC(CC(C)(C)C)C#N,0.3425
NC1=NC2C(O1)C2C=O,0.2116
CC1CC2(CC2CO)O1,0.2884
COC1C(C)C1OC=O,0.2682
CCOCCOCCO,0.3339
N#CC12CC3C1OC23,0.2687
O=C1C=CC2C3CC3N12,0.1997
C1CN2C(=N1)CNC2=O,0.2374
CCC1(CC)C(C)C1O,0.2967
CC1CC1N1CCC1=O,0.2679
CC12CC3C(CC13O)C2,0.3178
O=C1CC2C3CC(=C1)N23,0.1771
COCC1COC1=N,0.2742
OCC12CC3(O)C1OC23,0.2978
O=C1C2NC2C2CC1O2,0.2012
CC1(C)C2OCC12CO,0.2936
C#CC1OC=NC2CC12,0.2539
CC(OC(=N)C#C)C#N,0.2383
CC1CC1([NH3+])C([O-])=O,0.2693
CC12OC3C(CC=C1)C23,0.2283
COCC(O)CC1CC1,0.336
C1CNC1(C#N)C#N,0.2509
OC1C2CC1(C2)NC=O,0.2749
C#CCC1COC11CC1,0.2776
CC(CO)CC1CN1C,0.2957
CNc1cc(no1)C#C,0.1947
CCC1CC2COC2=N1,0.2664
CC1(NC2CC12N)C#N,0.2464
COC(C)(C=O)C#CC,0.2036
NC(=O)NC(=N)C1CN1,0.2267
N#CC1C2CC3(CN3)C12,0.2799
COCC12CCCC1O2,0.3352
OCCCC1(CO1)C=O,0.2208
Cc1c(cncn1)NC,0.1894
CC1(O)C2OC1C1CC21,0.3128
C1C2C1C1COC2CO1,0.3248
CCC(O)C1(CO)CC1,0.3227
CC1=CC(C)(O)CC1,0.256
CCC12CCC(C1)C=C2,0.2562
C#Cc1nccn1C=O,0.1747
CC(C)(C#C)C1(C)CO1,0.3085
COCC1OCC1C,0.3142
C#CCC1OC1C1CC1,0.309
COC(=O)C1=CCOC1,0.1979
CC#CCC1(COC1)C,0.2923
CCOC(=O)NC=NC,0.2491
CC(=O)COC,0.2347
O=CC1=CCCC11CN1,0.1672
O=C(C#N)C1CN2CC12,0.1677
CC(OCC=O)C1CN1,0.2099
CC1CC(O)C2NC12,0.3086
CCC12OCOC1C2C,0.3241
CC1N2C3C4=CCC13C24,0.0652
CCC(CC)NC(=O)C,0.278
CCc1c(c([nH]n1)N)N,0.2392
CC1OC(=N)NC1C#N,0.2539
CCC1OCC(CC)=C1,0.2472
OC1C2CCOC1C=C2,0.2419
OCC1C2C3C2N2C3C12,0.2952
CC1=C(C=NO1)C1CO1,0.2339
CCC12OCC1(C)C2C,0.2982
CC1CCC2(CCC2)O1,0.312
CC1COCC11COC1,0.309
CC(=O)C1CC1(C)C#N,0.2236
NC1=NC2C(O)C2C1=O,0.1775
CC1(O)C2OC1C2CO,0.2997
CC(C)(O)CC1CCO1,0.3093
CC1C2OC3(CCC3)C12,0.3063
N#CC1C2NC2C1C#N,0.2681
C#CC1(CNC=N1)C#N,0.2472
O=C1C=CC(C#N)C1=O,0.1399
C1C2CN1C1=C2NN=N1,0.2268
OC1CC2NC2CC1=O,0.2338
CC(C)N1CC1C#N,0.2614
CCC1C2OC2C1CO,0.3152
OCC1OCC1C1CC1,0.3158
Cc1c(c([nH]n1)N)C#C,0.2215
CC1(C)CC1(C)CC=O,0.2229
Cc1cnc(=O)oc1N,0.1762
O=C1C2NC3C2C13C#N,0.2262
C1CC23NC2CNC3=N1,0.2502
CC1=CC2OCC2OC1,0.2531
CC1(CCCOC1)C=O,0.2262
COC1COCCC1C,0.3138
OC(C=O)C1=NNC=C1,0.2131
OC1=NC(=N)C=C(F)N1,0.2119
CC1C(C)=CCC1=NO,0.2426
CC1OC2C3OC2C13,0.3046
CC#CC(NC=O)C#C,0.2705
CC1CC1(O)C=O,0.2211
NC1=CC(OC=N)=CN1,0.2192
CC12OCCC11CC2O1,0.3131
CC1CNC=C(C)C1=O,0.1827
CC1CC1(CC#N)C=O,0.2258
C1C2C3OC22CCOC132,0.2986
c1cc(nc(c1F)N)O,0.1917
OCC#CC1NC1CO,0.2641
N=C1OC2C3C4C3N1C24,0.2713
CC(C)C(O)C1CO1,0.3386
CNc1ccn[nH]1,0.2379
CC12CC3N(C1)C23CO,0.3088
CC1C=CC2CC1C=C2,0.231
C#CC12CC(O1)C1OC21,0.2584
CC12CCC1CCC2,0.3513
C1CC1C12OC1C1CC21,0.2931
CN1C(=O)COC1=O,0.2566
CN(C)C(=O)C(=O)CO,0.1839
CCOCC(O)CC#C,0.2968
CCCC12CN1CC2O,0.2923
FC(F)(F)C12CN(C1)C2,0.323
O=CN1CCC(C1)C#C,0.267
C(#N)c1c(oc(=O)o1)N,0.2036
CC12CC1OC(=O)C=C2,0.2101
CC1C2OC3C2CCC13,0.3217
CCCC(=O)CC#CC,0.2282
OCCC(O)C#CC#N,0.2283
OC12CC(C1)C=CC2,0.2548
CCCCC1C(C)C1O,0.3039
Cc1nc(no1)COC,0.2425
O=C1CN2C3CC3CC12,0.1993
C#CC(CN1CC1)C#C,0.2728
CN=c1c(=O)onco1,0.2105
CC1CC=CCC=C1,0.2538
C1CN1C(=O)C#CCO,0.2175
CC12NC(C=C1)C21CN1,0.2318
CC12CC3C1N3C2C#C,0.2642
CC12CN1C1CC2C1O,0.3217
Cc1nccn1C,0.2471
NCC1(CN1C=O)C#N,0.2409
OC1C(O)C11CC2CN12,0.2702
CC(C)C1(OC1C)C#C,0.2847
O=CC12C3NC1C1C3N21,0.1984
CC1(CC(=O)C=O)CO1,0.1598
CCN1C(C)C1(C)C=O,0.2101
CC(C)c1cc[nH]c1O,0.2333
CC#Cc1coc(n1)N,0.2027
[NH3+]C(C#C)C([O-])=O,0.2663
O=CC12OC3C1CC23,0.2094
CC1C2OC1C1CC2O1,0.2777
CC1OC(C)C(C)=C1C,0.2487
c1c(ocn1)OC2CC2,0.2341
OC1=CN=C2C3CC3N12,0.2098
CN=C1OCC1(C)O,0.2754
CC1C2C3CC(C)C1C23,0.3302
O=C1C2CC1(CC2)C#N,0.2285
CC12COC1(CN2)C=O,0.188
CCN=C(CCO)OC,0.2678
Cc1c[nH]c(c1N)C=O,0.1706
N=C1CC2CCC2O1,0.2839
CCC#CC#CC1CN1,0.2085
OCC1=NCC(=N)N1,0.2229
CCCCCOC=NC,0.2728
CCOC(=N)C#CC=O,0.1965
CC(C)(C)C(F)(F)F,0.418
CC1(CC2NC12)C1CC1,0.3106
COCC12CC(C1)C2O,0.3269
C1C2CC3OC4CC1C234,0.0747
CC(C)(C1CC1)C(=O)N,0.2726
CC(C#C)C(C)(O)C=O,0.2225
Cc1c(oc(n1)N)C#C,0.1908
O=C1NC2C1CC21CC1,0.2691
CCC1OC2(CC2)C1=O,0.2179
CCC1CCOC(=O)C1,0.2714
OC1C2C3CN(C23)C1=O,0.2191
CC1OCC2(CN2)C1O,0.304
Cc1[nH]c2c(n1)nn[nH]2,0.2149
CC12C3N(CC13O)C2=O,0.2412
CC(O)C1=COC=C1N,0.2285
CC1OCC(=C1)C#N,0.2056
c1cncc(c1C#N)N,0.17
C1NC11C2C3CC1N23,0.309
C1C2CC3(CO3)CC12,0.3372
COC1OC(=O)C2OC12,0.2515
c1c2c(c[nH]1)OCOC2,0.2326
C1C(CO1)OCCCO,0.3176
CC1(O)CC(N)(C1)C#N,0.2983
C#CC12C3CC1CC2C3,0.28
CC(=O)C1CC1C1CC1,0.2294
N=C1CC2=C(O1)C=NO2,0.2064
CC1C(C)C1(O)C(N)=O,0.2675
CC1C(CCO)C2CN12,0.3009
CC1C2COC1(C)C2C,0.3189
CC12CC(C3CO3)C1N2,0.3358
CC#CC(=O)C1(C)CO1,0.1988
O=C1CN2CC12CC#N,0.2248
c1nc(c(o1)N)C2CC2,0.2127
c1c2n(nn1)C=CCC2,0.2106
CC1C2CC3OC1(C)C23,0.3139
c1c(nco1)C#CC=O,0.1784
Cc1coc2c1CCO2,0.2242
C#CCc1c[nH]nc1O,0.2471
C1OC1C1=NC=NN=N1,0.1629
C#CC(=NO)CNC=O,0.2027
C1C(CO1)(C=O)C#N,0.2176
OC1C2CCC1OC2,0.3007
CC1(CC(C1)(C#N)N)C,0.2972
CC1N2C(CC12C)C#N,0.2685
CC(C)C12CC1(C)OC2,0.2979
CC(O)C1=NC(C)=CO1,0.2397
CC1C2CC(=O)C12C,0.229
CC(OC=O)C1CC1C,0.283
OC1C2C3C2N(C=O)C13,0.2419
CC1(CC1O)C(O)C=O,0.2159
CN1C=NC2(CC12)C=O,0.1978
COC1COCC11CC1,0.3188
CC(O)C(=O)NCCO,0.2756
C#CCN1C=NC2CC12,0.2288
N=C1CC2CC2OCO1,0.2734
CC12OC1C(O)C21CC1,0.3263
CC12CN3C1C2(C)C3=O,0.2419
CCCC(=O)C1CC1O,0.2202
Cc1c(cc([nH]1)OC)O,0.2284
CCCn1cc(nc1)N,0.2204
CC12CC1OCOC2=N,0.2729
NC(=O)C12OCC1C2O,0.2529
CC12CC3CC1OC23,0.3258
CC1CC(=CC1C)C#N,0.2195
COC1(C#C)C2CC1C2,0.2949
CCOC1C2CC1(O)C2,0.3353
CCC12C(O)C3C1CN23,0.2937
CCC1CCC(C)C=C1,0.2639
COCCNC(=O)C=O,0.1758
CC12NC(C1C#C)C2=O,0.2431
CC(CC#N)C#CC#N,0.2452
CC1(O)CCC2CN2C1,0.2725
CC1COC1C#C,0.2743
OC1C2OC1C21CCC1,0.3146
CC12C3CC4(O)C(C14)N23,0.2813
O=CC1OC2C3NC3C12,0.2225
C1C2C3C4CC=CC13C24,0.2399
CCC(CC)C1OC1C,0.3288
CC(O)C(C)C(O)C=O,0.2036
CC1([NH3+])CCC1C([O-])=O,0.2702
O=C1NCC11CC2NC12,0.2558
O=C1CCC2CCC1O2,0.2107
N#CC1CC2CCC2=C1,0.2454
CC1CN1C(=O)C#N,0.2186
CC1CCC2C(O)C2C1,0.3094
C1CC23CCC12CCC3,0.3166
CC1C(OC=N)C1(C)O,0.269
CCCCCN1CC1C,0.3091
CC1C=C(C=O)C2CN12,0.1702
C(=O)C(=O)C(=O)NC=N,0.1208
CC(CO)COC1CC1,0.3198
C#CC12CC3OC3C1O2,0.2732
CN(C(=O)N)C(=N)OC,0.2674
Cc1nccn1CC#N,0.2294
COC1COC1C1CC1,0.3178
c1nc(on1)C(=N)N,0.1988
OC1CC(O)C1CC=O,0.2261
O=C1CCC(O1)C#C,0.2768
O=C1CCC2(CO2)C1,0.2213
CCOCC(C)C(C)=O,0.2295
OCCC#CCOC=N,0.2798
N=C1OC2CNC12C#N,0.2402
COc1conc1C#C,0.204
OC1C2OC2C11CC1,0.3286
CC(O)(C#C)C(=O)C#N,0.187
CC1CN1C1CC=CC1,0.2521
C1C2CC3C=CC1C23,0.2484
CCCCC1CCOC1,0.3196
c1cnc(cn1)C=O,0.1655
CCOC1(C)COC1=N,0.2712
CC1CN1C1=NC=CO1,0.23
CC1CC2CC1NC2=O,0.266
c1c[nH]cc1CCC#N,0.2495
OC1CCC2(CO2)CC1,0.33
OCCC1(CO)CC1O,0.3103
CC12CC1C=C(C2)C=O,0.1893
CC1CCC2CC2C=C1,0.2515
CC12CC1C1NC1C2O,0.2983
OCC1NC=NCC1=O,0.1968
CC1(CN1)C1(C)CC1O,0.2921
O=CC1C=CCC11CO1,0.2126
C#CC12COC(O1)C=C2,0.245
NC1=CC(=O)OC(=N)N1,0.2047
CCCc1cnco1,0.242
CC1NC1C1COCO1,0.3144
CN1CC1C1COCO1,0.3071
c1c([nH]nn1)C2CC2,0.2442
OC12CC(C1)(CC2)C#N,0.3047
C#CC(C1CO1)N1CC1,0.2783
CC1(NC2CC12O)C#C,0.2576
CN1C2C3COC2C13C,0.3033
O=C1CC2(CCC12)C#C,0.2158
CCC1C2OC2C1CC,0.3274
CC1C2CC(C)CC12,0.3307
CC1(CCC1=O)NC=O,0.2149
CCC(O)C1CN=CO1,0.2719
CC12CC1(C=O)C(=N)O2,0.219
C1C2OC3C4CC3(O4)C12,0.2832
CC1(O)C(=O)CN=C1N,0.2056
CCC12CC1C(=O)C2C,0.2269
CC(=O)CC(=N)NC=O,0.2091
CC1=NNC(=N)C=N1,0.1476
CCC1=NCC(CO)O1,0.2707
CC(=NO)C1CC2CC12,0.2536
CC1CCC(C1)C=O,0.2293
CC(=O)C#CCCO,0.2087
CCOc1ccc([nH]1)O,0.2387
COC1C2CC3CC1C23,0.318
C1OC23CN4CC2CC134,0.2532
C#CC1CC2COCC12,0.2887
c1c(=O)[nH]c(=O)oc1F,0.2335
OC1=C(O)C=NC(=N)N1,0.1472
CC1OC11CC2(CO2)C1,0.3116
N#CC1OCC11CCN1,0.2414
CC(C)CC(C)(O)CO,0.3153
CC12CC1OC(=O)C2O,0.2638
CNc1cnc(n1C)O,0.241
OCCC1C(O)CC1=O,0.2207
c1cc2n(c1)C(=O)CO2,0.1769
OCC12CC1OCO2,0.3164
O=CC1OCC2CC1O2,0.2154
C1C(CC(=O)C1=O)C#N,0.1451
CN=C1C(=O)C=CN1,0.1556
C#CC12CC1CC2C#N,0.2641
c1c(noc1C#N)C#N,0.2112
C1OC1C1CCCOC1,0.3327
CC1(C#C)C2C3NC3C12,0.2505
CN1C2C3OCC1C23O,0.2616
Cc1nc(nn1C)C=O,0.2013
N=C1NN=CC(=N)C=C1,0.1686
C1CCC2(C1)CC(C2)O,0.3266
NC12C3N=CN(C13)C2=N,0.2133
COC1CC2N=COC12,0.2638
C1C2CC3C4C=CC12C34,0.2097
COC1=NON=NC1=N,0.1781
Cc1cc(n[nH]1)N2CC2,0.2347
CN1CC23OC4C2C1C34,0.2826
C1NC1C1=NC=CN1,0.2418
CC1(CO1)C1C2CN1C2,0.3104
Cc1cc2n(n1)CC=C2,0.1889
C#CCOc1ncno1,0.2578
CC#CCC(C)(O)C#C,0.2774
C1C2CCC11OC=NC21,0.2601
c1c2c(on1)N=C(C2)N,0.1856
CC(C)(C(=O)N)O,0.2736
CN1C2CC3(C)C2C13C,0.2868
CCCC1(O)C2COC12,0.2928
CNc1c[nH]cn1,0.2203
CC12CN1C1CC2(C)C1,0.3082
CCC1OC2CC2(C)O1,0.3332
C1OC11COCC=CC1,0.2645
CC(O)C1=CC2OC2C1,0.2395
CCN(CC#N)C1CC1,0.2642
OC1CC=CC1C=O,0.2278
CN(C)c1nnon1,0.1809
CC1(CNC(=O)N1)C=O,0.2121
OC1CC1C1=CON=C1,0.2316
CCOC(CC#N)C#N,0.2939
O=C1NCCC(N1)C#N,0.2682
NCC(O)C#N,0.2627
c1c2c([nH]n1)C(=O)C=C2,0.1367
CN=COC(C)C=O,0.2186
C#CCn1cccc1N,0.2113
C1CC1C1=CC2NC2C1,0.2324
COCC1(COC1)C#N,0.2908
CC1OC(C)(C)C2NC12,0.31
COC1(C)C2C3OC1C23,0.3075
CC12CC(=O)C3C1OC23,0.2107
C1C2OC1C21COC=N1,0.251
CC12NC1C1CN1C2=O,0.2225
CC1C2OC1C2=O,0.2457
COC(C)C(=O)CO,0.235
Cc1c(cc([nH]1)C=O)O,0.1642
CC1OC(C=O)C1(C)O,0.2121
CC#CC1(CC1O)C#N,0.2636
CCC1(OCCO1)C#C,0.2971
OC1C=CC2(O)COC12,0.2428
CC1CCOC(=O)CC1,0.2742
O=CC1(C#N)C2COC12,0.2162
CCCC(C=O)C(C)C,0.2261
CC1C=CNC(=O)C1C,0.2133
Cn1cc(nc1)OC,0.2245
CC1NC1C(C)=NO,0.2401
CC12CC3OC(=N)N1C23,0.2823
CC12C3C1C1C3OC21C,0.3252
Cc1cnnn1C(=O)C,0.2062
O=C1CC2OCC12,0.2184
COCC1C=CC2OC12,0.2459
CC1C2C3C2C(C)(O)C13,0.3198
CCc1nc(on1)C=O,0.1901
CC1NC11CCC=C1C,0.2406
CC(O)C(C)C1OC1C,0.3332
N=COC(C#N)C1CC1,0.2818
O=C1CC2CCC=C2N1,0.2245
O=C1CNC2C=CCC12,0.2008
CC1C2CCC12N1CC1,0.2966
CC1CC(=NO)C(N)=N1,0.1887
CC1OC(N)=NC11CC1,0.2635
CC(C)(C)C(C)(O)C#C,0.2979
CC1C(CO)C1(O)C=O,0.2203
Cc1cnc(nc1O)O,0.2142
CC1OC2CC1C21CC1,0.3276
CC12CC1(O)C=CCC2,0.2428
CC1CC2(CCC2C)C1,0.3482
Cn1ncc(n1)C#C,0.2197
OC1CC2NC2C2NC12,0.2941
CC#CC1CC2OCC12,0.2863
CNC(=N)c1c[nH]nn1,0.1983
Cc1c[nH]c(n1)C(C)C,0.2471
O=CC1CC11OCC=C1,0.2038
N#CC1CCC11CO1,0.2979
COC1(CC1C)C=O,0.2205
C#CCCC12CN(C1)C2,0.2815
CC1(CC(=O)C1)COC,0.222
OCC1(CC(=N)O1)C#N,0.2795
CC#CCC#CC(=O)N,0.2321
CC1NC1(C)CO,0.305
CCC1CC11CCC1C,0.3445
CC12COCCCC1N2,0.3114
COC1(CCCC1)CO,0.3291
O=C1COCC1N1CC1,0.2101
COCC#CCCO,0.2849
Cc1coc(=O)c(n1)O,0.1695
CCC1OCC(O)C1C,0.3041
O=C1NC(CO1)C#C,0.2869
CC#CC1C(C#C)N1C,0.2408
CCN=CNC(=O)C,0.2355
C1C(=O)CC1(CO)C#N,0.2231
CC1C2CC1C21CC1O,0.3138
COC1=NCC(N1)C#N,0.251
COC1(CC1O)C1CC1,0.2958
C#CCc1nc(no1)O,0.2412
N#CC1CCC1C#N,0.3197
CCC1=CCC(=O)C1=O,0.1395
CCC(=O)C(=O)OC=N,0.1752
COC1CN(C)CC1=O,0.1759
OC12CC(C1)CC1CC21,0.3238
CC(C)(C)C1CC(O)C1,0.3287
OC(C=O)C1CC1O,0.1907
CC12CC1C1COCC21,0.3123
CCC1(O)CCOC1=O,0.2711
CC1(C)CC1CN1CC1,0.3145
CC1COC2CCC12O,0.3007
CC1NC11CC(C)(O)C1,0.3065
CC1=CC(=N)N=CN=C1,0.1633
CCC1OC(=O)CC=C1,0.2641
CC(C)(CC(=O)NC)O,0.2669
CC1CCC(C)(C)C1O,0.3256
CC1C2(O)CCOC12C,0.3039
CC12C=C3CC4C1N2C34,0.1759
CC(C)(C)C1(CO1)C#N,0.3015
CC1(CC1)C(C#C)C#N,0.2953
CC(C)(COC)C(=O)N,0.2764
COC1COCC(=O)C1,0.2144
N=C1OCC11CCCN1,0.2526
O=C1CN2CC1C21CC1,0.2058
CCNC1COC1=N,0.2553
Cc1cc(cc(n1)O)N,0.2233
OC12CC34CC=C(C13)C24,0.1802
CC1OC1C#CCC=O,0.2196
CC(CCO)C(O)CO,0.3122
CC1OC(=N)C(O)C=C1,0.2548
CC(C)(CCOC)C#N,0.3053
O=C1C2C3CC1CC2O3,0.2162
O=C1CC=CC1C#C,0.2157
CC1(CO1)C1NC1C#N,0.2771
CC1=NNC(N)=CC1=N,0.1813
CC1NC1C1(C)NC1C,0.3081
CC1=CCC2C1OC2=N,0.253
CCOCC(O)C(C)C,0.3234
CC1=C(ON=C1)C1CN1,0.2186
CC(O)C(C#C)C#N,0.3001
CC12OC1CCC2=O,0.2127
CCC(O)C1=CC=NN1,0.2573
CN1C2C3C2C(=O)C13,0.2155
C#Cc1cnc(=O)oc1,0.1642
CC(C)(CC1CC1)C#N,0.3309
CCC1(C)NC1(C)C=O,0.2136
CC1OC(C)C1CC#N,0.288
CC1CC2(COC2C)C1,0.3157
C1OCC2NC1C1OC21,0.2968
CC(C)(O)C1CC2CC12,0.3115
CC1(C)C2CCC(=O)N12,0.2399
C#CC1NC2C(C#N)C12,0.2632
O=CC1CCC(O1)C#N,0.2199
CC1=CC(C#N)C2CC12,0.2467
C1C(=O)N2C=CNC2=N1,0.1792
OC1CC(C=C1)C1CO1,0.2588
C1C2C3C4OCC2C1C34,0.3089
CC1OC1(C)CO,0.3393
CC1=CC=C(C)C(=N)O1,0.1673
COC1CC(C)C1=O,0.2003
N=COCCC#CC#C,0.2302
CCC12C3CC1C(=O)C23,0.2431
NC12CC1C1OC21C#N,0.2385
C1NC1C1=NC=CN=C1,0.1962
C#Cc1c(cccn1)F,0.1929
COC1C(C)C(=O)C1O,0.2082
CC12C3CC1CC(=O)N23,0.2374
CC12C=CC3CN1C23C,0.2278
c1cnn(n1)CC2CC2,0.2568
CCOC1CC2OCC12,0.3114
CC1(C)C(OC1=N)C=O,0.2192
CCC(C)CC(O)CO,0.3171
CC1CC1OC(=O)CN,0.2604
CC(O)C1CCC(=O)C1,0.2236
C[NH+]=C1CC(N1)C([O-])=O,0.2467
CC12CNC1=CC(=N)O2,0.196
OC12C=CC3COC1C23,0.2262
O=CC1C2C3CCN2C13,0.2107
OCCC(CO)OC=N,0.2714
NC1=COC(O)=NC1=N,0.1925
c1c(n[nH]n1)OCC#N,0.2394
CCCCOC,0.3409
CCOCC(C)(O)C#N,0.3045
OC1C2C1C1CC2C1,0.3128
CC1NC1C(O)CC=O,0.2277
CCC1=CC2CC1O2,0.2326
C1C2CC3C4C=CC13C24,0.2228
OC12CC(CC1)C2C#N,0.2942
O=C1NC2CC3CC12O3,0.2496
CC12CC(COC1=N)N2,0.261
OC1C2CC(CC1=O)O2,0.2239
CC12C3C4C(CN13)C24O,0.2872
CC(=NO)CC(=O)NC,0.234
CN1C2C1C(CO)C2O,0.288
CC12CC3C1C3(N2)C#N,0.2568
CC12CCC(=O)C1CO2,0.2176
COC(=O)C#N,0.248
CC1NC11COC1C,0.3092
CC(CCO)C(O)C=O,0.229
CC1C=C(C)CC2OC12,0.261
CC1CC2(C1)CCOC2,0.3164
CC12CN3C1C1(CC1)C23,0.3066
CNC(C#C)C#N,0.2566
CC(C)(CC1(CC1)O)O,0.3
OCC12NC1C1COC21,0.289
CC1CCC(=O)C=C1N,0.1958
OC12COC1C2NC=O,0.2605
CC(O)C(CO)OC=N,0.2736
CC(C#N)C1CC2CN12,0.2788
CN1CC=CC2OCC12,0.225
CCOC1COC(=N)C1,0.2845
C1CC11CC=CC2CC12,0.2449
N#CC1NCCC2CC12,0.274
CC1C2CNC(C#N)C12,0.2722
COC12CC3OC1C2O3,0.3104
C1C23CCC12OCCC3,0.3112
CC(=O)C(=O)C1(CC1)O,0.1531
OCC1=COC=NC1=N,0.207
OCCN1C2CC(=O)C12,0.2114
CC(C)C1CCC1C=O,0.2223
CCCOC(=O)NC,0.3159
CC1CN(C1)C(=O)C=O,0.1729
CC1CC(C)(C1)C#C,0.3105
CCc1c(cc[nH]1)NC,0.2128
CC1C(C)C1CC1CC1,0.336
CC(C)C1=NCC(=O)O1,0.2484
CC(O)C1CC2CC12O,0.3085
CCC#CC#CC#CC,0.1836
Cc1nc(nc(n1)F)C,0.2274
CC#CC1CN1C=O,0.246
CCC#CC(C)CC,0.2985
CN1CC2(CO2)C1=O,0.2605
ON=C1CCCC2OC12,0.2426
Cc1cc(nn1C)OC,0.2363
c1c([nH]c(n1)O)OC=O,0.2055
CNC1=NC(C)C(=O)N1,0.2353
C#CCCc1nnon1,0.2025
OC1(CCC1C#C)C#N,0.2718
CC1C2OC1(C)C2(C)O,0.3288
CC1C2NC2CC1=O,0.2256
CC1CC(C)N=C(C)O1,0.2701
CC12OC(OC1=N)C=C2,0.2373
CC(=O)C1(O)CC1C#N,0.2203
N=C1OCC2CN2C=C1,0.1968
N#CC1OC23CC(C2)C13,0.2636
CC1(CC(=O)C#N)CN1,0.1753
CC1OCC2CC2O1,0.3344
CC1=CCC2CC2C=C1,0.198
CCCCC12CC1CC2,0.3285
N=C1OC23CC12C=CC3,0.243
COC12CC3C(C13)C2=O,0.2262
CC1C2CC3(C#C)C2N13,0.268
CC(C)(C1CC1)C1CO1,0.3409
C(C#N)Oc1n[nH]nn1,0.236
O=CC1COC2CC2C1,0.2077
CC1OC(=O)C1C(C)=O,0.2289
OC1C2CN2C(=O)C1=O,0.1487
CC(C)OCC(F)(F)F,0.3428
C1C=C(COC=N1)C=O,0.1901
C#CC1C=CC2CC12,0.2462
O=C1CC2CC(=O)C1N2,0.1774
CN=C1OCCCC1C,0.2638
COC1C2CC(C)(O)C12,0.3201
CC12COC1C1(CC1)C2,0.3036
CC1C2NC2(CO)C1=O,0.2157
CCCC1(CO)OC1C,0.3326
Cc1ncnc(=O)n1C,0.2007
CC12COC1C1NC1C2,0.2994
N#CC12CC(C1)OC=N2,0.2582
OC12CC(CC1)C21CC1,0.3238
OC1CC2(O)C1NC2=O,0.2601
NC1C(CCO)OC1=N,0.2679
NC1=C(C=O)C2NC2C1,0.1785
C1CC1C1C2C3CC3C12,0.2779
C#CCNCC(=O)C#N,0.1658
CC12CC3CC1C3C2O,0.3201
CCC(CC)C(O)C#C,0.2944
CN=C(C(=NO)C#C)N,0.1806
CC12NC1CC(=O)C=C2,0.185
CC1OC(C2CC2)C1C,0.3204
CC1C(O)COC11CC1,0.2913
C#CC(CCO)CCO,0.3058
CC1NC11C(O)CC1=O,0.2109
CC1N2C3C2C1(C)C3=O,0.2256
OC1CC2OC1C1OC21,0.3107
CC1CC(C)(C=C1)C#C,0.2577
CN1CC2(CC12C)C#N,0.247
CC1(C)CC1C#CC=O,0.2034
c1c(c(n(n1)C=O)O)N,0.1965
CC(C)C(OC=O)C#C,0.2763
CC1C2OC2(C)C=C1C,0.2415
C1OCC23OC4C2C1C34,0.3044
OC1=CC=C(O)C(=N)O1,0.16
CCC(=N)NC(=O)C=O,0.1602
OCC(C#C)C(=O)CO,0.2284
CCN=COC(C)(C)C,0.2734
Cc1coc(c1N)OC,0.2186
CC1OC(=O)C2COC12,0.2676
CC1(C)C2C3CCC1C23,0.335
CN1CCC(=O)CC1,0.212
C(CNC(=O)CO)C=O,0.2227
O=C1COCOC2CC12,0.2141
CC1(O)C2OC2C1CO,0.3111
N#CCC12CN3C1CC23,0.2739
O=C1CCOC2CC1C2,0.2219
CC(O)C(O)CC1CO1,0.3168
CC(C)C1C2NC2C1O,0.309
N1C2C=CC3OC3C12,0.2252
N=COC12C3C4C3C1C24,0.253
Cn1ccc2c1CC=C2,0.1914
OC(CC#CC=O)C=O,0.2041
CC(C)C(=O)C#CCO,0.2055
CC1OC2C3OC2C13O,0.3007
CC1C(O)CCC1(C)O,0.3175
CC(=O)C(=O)C1CC1O,0.1578
CC1N2C3CC2C13C=O,0.1871
O=CC12CC3C4C3C1C24,0.2099
CC1OCC2C1CC2=O,0.2139
CC(=O)OCC(=O)CO,0.2388
CCC#CC1COC1,0.2923
COC(CN)(C#N)C#N,0.2421
CC1C2OC3C(O2)C13C,0.3213
C1C2CC3(COC3)CN12,0.2944
c1c(c(=O)c(c[nH]1)N)N,0.1676
Cc1coc(c1C)C#C,0.1952
O=C(CC#C)CC1CN1,0.2171
ON=C1C2C3CC1OC23,0.2404
CC1=CC2(C)CC2(C)C1,0.242
C1C2C3CC=CCC2C13,0.2728
CC1NCC1(N)C#N,0.2726
CC1C(N1C)C(=O)C#C,0.1822
CC(C#N)C1C(C)C1C,0.3151
CC(=O)c1cnn(c1)C,0.2095
OC1CC(C1)(C=O)C#N,0.2308
OC12COC1C2C#C,0.2755
CC(O)C1NC1C=O,0.2247
Cc1c(c[nH]c1NC)O,0.2284
COC1OC=NC1C,0.2768
CC12NC1C1CC1C2O,0.2976
[O-]C(=O)C1CNCC[NH2+]1,0.2482
CCC1NC1(C)C1CO1,0.3202
C1CC2(C1)C(=O)CCO2,0.2132
CC12CCC1CC=CC2,0.262
O=C1CC2OCC(=O)C12,0.1971
CC12CC1OC(=O)O2,0.3182
Cc1c(cccc1F)F,0.2354
O=CN1CC11CC2OC12,0.2496
CC1=C(CN2CC12)C#N,0.1948
OC1C2CC3(CN3)C12,0.3138
O=CC#CCC1CO1,0.2048
CC1C(C)C(=O)C1C#N,0.2218
N=C1OCC(=O)C2NC12,0.2143
CC1CC2(O)CC12C#N,0.2625
CCCC1(OC1C)C#N,0.3008
O=COC1=NCC2OC12,0.2239
CC(CO)N(C)CC=O,0.2074
CC1CCC(C)=CC1,0.2615
CN1N=CNC(=O)C1=N,0.1771
CCC1OC2CCC1C2,0.3162
O=COCC(C#C)C#N,0.2824
CN1C2C3CC1C23C#C,0.2499
OC1C2NC1C1NC21,0.3109
O=C1C2CC1C1(CN1)C2,0.2271
CC12CC1OCC1CN21,0.3017
CC12CC1CC2CCO,0.3246
C1CC1C(=NO)CC=O,0.2034
C1CC2CCCC12,0.3604
CCC12CC=CC1C2C,0.245
C1OC2C3C4OC13C24,0.2964
C1CC(=O)NCC1=O,0.2173
Cc1c(onc1C=O)C,0.1928
c1c(coc1N)C2CC2,0.2234
CC1(CO)OC1C=O,0.2167
CC12CC=C3CN1C23C,0.172
C#CC1OCC2CC12,0.2943
CCC1=CC2CC2(C)C1,0.2419
CCCCC1CC(O)C1,0.3306
OC12CC1CC2CC#N,0.2961
OCCC1CC2CC12O,0.3223
CN(CC=O)C(=O)CO,0.2143
O=CC12C3C=CC1CN23,0.2
CC(CC(O)C=O)C=O,0.2016
c1c(cncn1)N(=O)=O,0.1724
CC12CN1CCC21CN1,0.3023
CCN=c1cncn[nH]1,0.1514
CNc1[nH]ncn1,0.2512
Cc1cnn[nH]c1=O,0.1823
CC12CCC3(CO3)C1N2,0.3221
O=C1C2CN2C2CC1C2,0.216
CCC1(CCC1O)C#C,0.2924
CC(CCC#N)C(N)=O,0.2728
CC(C)Nc1ccco1,0.2181
O=C1CC2C1CC1CN21,0.2097
N#CC1CC2=CC=CN12,0.2158
CCC(=O)C(O)CC#N,0.2378
CCC(=O)COC,0.235
C1CC(=O)N(C1)C=O,0.2155
C#CCN=COCC=O,0.2111
C1C=C2C3C4OC13C24,0.1224
O=CN1C2C1C1OCC21,0.2444
OC1CCC11CN1,0.3123
CC12CC1OC(C)(C)O2,0.3206
CCC(=NO)C1CC1C,0.2476
CC1N=C2OCC3C1N23,0.2288
CN=C1C=COC(C)=C1,0.1871
N=C1OC(=O)C(C=O)=C1,0.1523
Cc1nc2n(n1)CCO2,0.2554
CC(C)(CCOC)C=O,0.2285
O=C1OCC2CCCC12,0.2749
c1c(con1)NCC#N,0.2155
OC1C2CC2N2CC12,0.2843
CC12CCC1N2C=O,0.242
N=C1CC(=O)CN1C=O,0.1998
CC1(COC1)C(=O)CO,0.224
NC(=O)C1(CO)CN1,0.263
OC1COCOC(=O)C1,0.2693
CC(O)C1CC(=O)C=C1,0.1925
OC12C3CC1C(=O)C2O3,0.2
c1c(cc(=O)[nH]c1O)N,0.1923
C1C2OC22COC=NC12,0.261
C1C2CC3=C(OC=C3)N12,0.222
OC12C=CN3C1C2C3=O,0.1985
N=C1NC=NC(=O)N1,0.2123
CCC(C#N)C(=N)OC,0.291
CC1OC1C1C(C)C1O,0.308
N=C1OC2C3CCC1C23,0.2721
CC1CC2C3CC3C2O1,0.3194
CC1NC2(C#N)C(N)C12,0.2348
NC1=NC(C=O)C(=O)N1,0.2084
CC12OC1C1OC1C2O,0.298
c1c(non1)NCC=O,0.1944
Cc1c(c(c[nH]1)O)C#N,0.2044
O=COC12C3C4C3C1C24,0.2417
OC1C(OC1C#N)C=O,0.2186
Cn1c(=O)onn1,0.23
CC#Cc1cc[nH]c1N,0.209
CC(=N)OCCC1CC1,0.2992
NC1=CC(=O)CC(O)C1,0.1985
C1CC(C1)CC(=O)CO,0.2337
N#CC1C2CC3CC2N13,0.2622
c1c(n2c(n1)CC2)C#N,0.2152
c1cc2c(nc1)CCC2,0.2196
O=C1CC(C#N)N2CC12,0.2198
N#CCC12CCC1CO2,0.2833
OC1C2C1C1(CN1)C2O,0.3049
C#CCCC#CC1CC1,0.2753
CC(=O)C(=NC)N,0.191
O=C1NC2CC2CCO1,0.2718
CC1CC11CC(CO)O1,0.2988
C1C2N1CC1=C2OC=C1,0.22
CC1=NCC(=N)N1C=O,0.2227
N#CC1CC2(COC2)N1,0.2666
CC1C2C3C4C1C4(C)N23,0.3003
C1OC2COCOC12,0.329
CC(C)C(O)COC=O,0.2851
CC1=CC2C3C2C2C3C12,0.2429
CC(O)C1=NC=C(O)N1,0.2336
CC1C(C)C1C1CO1,0.3332
N1C2C=CC3OC2C13,0.2241
C1C2CC1C1=NOC=C21,0.2491
COC1C2OC2C1=NO,0.2357
c1c-2cncc2nn[nH]1,0.1453
CNC(C=O)C(=O)C#C,0.16
C1C2CN3C=CN=C3C12,0.2397
CC1C(C#N)C1C1CN1,0.2653
CN1CCC2CN2C1=O,0.2766
C#CCC12CN3CC1C23,0.2741
CC(C)C(C)C1(O)CC1,0.3016
OC(CCC1CC1)C#C,0.2947
NC(=O)C(CO)OC=N,0.2544
CC(O)C(C)NC=O,0.2823
CN1C(=N)NN=C1C#N,0.1657
c1c(nno1)OCC=O,0.2031
c1c(c(no1)O)NC=N,0.2137
CC1OC2C(O)C(O)C12,0.2805
COC1OC2C3CC1C23,0.3201
CNC1=C(O)OC(=N)N1,0.2278
O=CCC12CC3C1OC23,0.2145
OC1CC2CCC=C12,0.2417
CC1CC(C)(O)C(=O)N1,0.2732
CCC(C)(C)C#CC,0.3065
C#Cc1cnccc1O,0.2024
Cc1cc(c(nc1)O)N,0.1907
CC1OC2C3CC2C13,0.3344
CC1OCC2(O)CCC12,0.3139
CC1C(O)C1C(O)C#C,0.2882
O=C1CCC1(C#C)C#N,0.2084
C1C2CC3NC3C=CC12,0.2552
CCC(C)(CC)CO,0.3317
OC1C=C2C3C4C1C2N34,0.1629
CCCNc1ncno1,0.2402
OCC1OCCC(=N)O1,0.2769
CC1C(=N)N2CC12C#N,0.2477
CCOC1C2C3OC3C12,0.2732
CC1OCOC(=O)C=C1,0.2187
CC(O)(CO)C1CC1,0.3214
CCC(C)(COC)C#N,0.312
CN=CN1CC1C#N,0.2485
CC(C)CCC(N)C#N,0.2976
CC12CC(CC1N2)C#N,0.2848
OC1COC1=NCC#N,0.2676
FC1=NNC(=O)NC1=N,0.1944
CC1CN1C1CC2NC12,0.2865
OC(CC#N)C1CO1,0.3188
C1CC(O1)C1CCC=C1,0.2616
O=CC1OC2CCCC12,0.2157
CNC1=[NH+]C(=N)N=C[N-]1,0.192
O=C1OC2C(O1)C2C#N,0.3065
CC12CC1CC1OC21C,0.3327
OC12CC(C1)N(C2)C=O,0.2702
CC(C)N=COC,0.2719
COC(C)(C)C(O)C#N,0.2828
Cc1nc(no1)C(=N)N,0.201
CC#CC1(O)C2CC1N2,0.2671
CCCC1CCOC1=O,0.273
OCC1C2C3CCC1C23,0.3146
OC1C2CC1OCOC2,0.3147
c1c2c(n[nH]1)C=CCN2,0.1885
CCCNC(=N)C(=O)C,0.1704
N#CC12CC(CN1)C=C2,0.2344
c1[nH]c2c(n1)oc(n2)N,0.2039
C1C2CC3CCC3C12,0.3342
O=C1CC23CC12CC=C3,0.2231
Cn1cc(cn1)CC=O,0.215
NC1=CC(=N)N=C(N)O1,0.2105
CN1N=CN=C1C1CN1,0.2406
c1c(c2c([nH]1)CC=C2)O,0.189
CN(C)c1nc(on1)N,0.2315
O=C1OCC2CCC2=C1,0.2152
OC12CCC1COC2=O,0.2625
CC1OCC2OC12C#N,0.2718
CC1C2CCC1C21CO1,0.3355
CCCN=C(C)NC=O,0.2333
C1C2C3CC4C1C4C23,0.3299
[NH3+]CC1C([N-]C1=O)C#N,0.249
CC(=NO)C1CCO1,0.2549
OC1C2CC3(CCC13)O2,0.3031
OC12CC3C(CC1=O)C23,0.2256
CN=C1OC=C(F)C=N1,0.1534
C1OC11C2CC1CC2,0.3497
O=CC1CC2(CCC2)O1,0.2121
CC1(C)OC1C(=O)C#C,0.1961
O=CC1CN1CC1CC1,0.2104
CCCOCC#CCO,0.281
CC1N=C2OC3CC1C23,0.2184
CCC1=CC2CCC1C2,0.251
COCCCC(F)(F)F,0.3414
CCCC1C=CC2OC12,0.2442
OC1CC2CC1CC2O,0.333
CC1=CCOCC=C1,0.1928
Cc1c(nn(n1)C)NC,0.2119
CC(CC1CCC1)C#C,0.3129
COC1C=CC2COC12,0.2477
N=C1OC2=C(O1)C=NN2,0.2292
CCOC(CO)CC#C,0.3034
CC1=NOC(=N)N=C1,0.1594
Cn1c2c(nn1)NCC2,0.2009
O=C1C2CC3C4C(C23)N14,0.2372
OC12CN3C4C(OC14)C23,0.2771
CN=C(CC=O)OC=O,0.2298
COC(C)C12CCC1O2,0.3261
c1c(oc(n1)O)NC=O,0.2382
CC1C2OC2(C)C1=NO,0.249
C(CCNC=O)CC#N,0.2804
C1C2C1C13CC4C1N2C34,0.2936
OC12C3C4C=C1CC2N34,0.1781
c1c(cn2c1NCC2)O,0.2231
C1C=CC(=O)N1CC=O,0.2059
CC1CC2C3C(O)C2N13,0.3054
CC1=C(C)C(O)CC1,0.2548
CN1C(=N)N=CN=C1O,0.1934
NC(=O)C12CN1CCC2,0.2606
CC(=N)OC(=O)CC#C,0.2509
CCCCC(=NO)CC,0.2585
CCCC(C)C(N)C#N,0.2849
CC12CC(C)(O1)C=CC2,0.2432
C1C(CC1=O)C(=O)C#N,0.1686
CC12C(CO)C1C1OC21,0.2814
CC1=NC=C(C)C(=N)O1,0.1814
CC12OC1C1CCC=C21,0.2406
O=CC1C=C2CN3C1C23,0.1741
COC1OCC(C)=C1C,0.2573
OCC1CC2C=CCC12,0.2591
CC1N2C(C)C(O)C12C,0.2808
CC1CC2(CC12)C=O,0.2266
CC1CC2CN2CCO1,0.3111
COCC1NCC1=O,0.2155
CCC1C2CC=CCC12,0.2681
C1C2CNC3=CC=C1N23,0.177
CC(C)(C)c1[nH]ccn1,0.2527
CCC1C(C)C1C(C)=O,0.2274
N#CC1C=CC2CN12,0.2314
CC12C(O)C1C(=O)C2O,0.2131
O=C1OC2C1COC2=O,0.2548
OCC12CN1C(=O)C2O,0.2205
COC1CC1(N)C#N,0.2695
CC(CC(=O)CO)C#N,0.2379
O=CC1(CCN1)C#N,0.201
CC12CC3OC1CC23O,0.2986
CC1C2CC(=O)C12,0.2297
c1cc(c(nc1)O)C=O,0.1703
COC1C(C#N)C1(C)C,0.2874
Cc1nccc(n1)O,0.2248
NC1=NC(CC#C)CO1,0.2761
C(#N)c1nc(c(o1)N)O,0.1575
OC12C3CC1C3C2C#N,0.3033
CCC(=O)CC1CC1C,0.2291
Cc1nnn(n1)CC#N,0.2546
c1c(cnc(=O)[nH]1)N,0.1511
N=C1CCC2CC(C2)O1,0.271
CCC1CC2OC(=N)C12,0.2826
O=C1CC(CC2CC2)O1,0.2856
CC1C2C1C1CCC21,0.3177
c1nc(c(o1)CC=O)N,0.1671
CCC#CC1C(C)C1C,0.2753
CC(C=O)(C#C)C1CC1,0.219
C1C(CO1)CC(=O)C#N,0.165
Cc1ccc(c(=O)o1)N,0.1605
CC1(C)NC1C#C,0.2793
CC1CC2=C(COC2)C1,0.2485
C#CC12CCC1C=CC2,0.2618
OC1CC2N3CC2(O)C13,0.306
CCCC1OCCO1,0.3435
CC1OCC1O,0.3069
N=COC(CC#N)C=O,0.2195
CC(O)CC1NC1(C)C,0.3032
CC(=O)c1cc[nH]n1,0.2057
C#CC12CC(C1)C21CC1,0.2973
CC(=O)C1=CCC(=O)N1,0.1638
CC(CO)COC(C)=N,0.2935
CC1COCC(O)C1,0.3129
OC12CCC(CC1)CC2,0.315
CCC1CCC(C)CO1,0.3225
N#CCOC1CCCO1,0.298
C1CC23CCC12CO3,0.2869
OC(CC#C)C(O)C#C,0.2935
OC1CCCC(=O)CC1,0.2221
CCC12COCCC1O2,0.3327
CC1CNC=C1C(N)=O,0.193
OC1CC2CNC1C2=O,0.203
c1c2n(nn1)C(=O)NC2,0.2316
CC1=CCNC1=O,0.2235
CC1=C(C)C2C(O)C2C1,0.2353
c1cnc-2cn[nH]nc12,0.1561
C1CCC=CCC1,0.2576
CCC(C)C1OCCO1,0.3409
CC#CC1(O)CN2CC12,0.2666
c1cc(c(cc1O)N)N,0.1949
Cc1c([nH]nc1C=O)C,0.1977
COC1(CN2CC12)C#N,0.2637
c1c(n[nH]n1)C2(CC2)O,0.2369
c1nc(no1)C#CC=O,0.1829
N#CC1CC=CCCN1,0.251
N=C1OC2CC1CCO2,0.2866
CC1C2OC(C#C)C12O,0.2476
N=C1CN=CN1CC#N,0.2226
C[NH2+]C(C1CC1)C([O-])=O,0.2639
C1CC1C1CCOC1,0.3239
CC(C)c1c(nco1)O,0.2165
CN(C)C(=O)N(C)C=N,0.2444
c1nc(c(c(=O)o1)O)N,0.1669
CC1CNC(=O)CC1O,0.2671
CC1C=C(C#C)C2OC12,0.1996
CC1CC2(CC2C#N)O1,0.2764
CC1C(O)C(C#C)N1C,0.2582
C#CCc1cnoc1N,0.2239
CCCC1C2CC(C)C12,0.3318
C#CC12CC3C4C1C2N34,0.2639
CC1C2CC3OC1C23C,0.3138
CC12CC1(OC2)C1CC1,0.2982
CCC1COC(CC)C1,0.3195
CCC1CC(CO)O1,0.3177
CCC12OC1(C)C1CC21,0.3227
O=CC12NCC1N1CC21,0.1954
N1C2C3NC4C1C4NC23,0.2248
N=C1OCCC(=O)C=C1,0.173
CN1C2CCC2C1=O,0.2686
O=CC1(CN=CN1)C#N,0.193
CCn1c(nc(n1)N)O,0.2461
O=CNC1CCC11CN1,0.2513
OC1CN2C(C3CN3)C12,0.2919
OC(CC1CCO1)C#N,0.2696
CC1CCC(C)CC1,0.3624
CCCC(O)C(C)O,0.3187
C#CC1(CC#N)CO1,0.2837
CC12CN1C(=N)C21CO1,0.2412
CC(C=O)C1COC=N1,0.215
OCC1C2CC1(C2)C#N,0.3008
CCC1(O)C2OC1C2C,0.2944
NC(CNC=[NH2+])C([O-])=O,0.2553
C#CC1(OCC=C1)C#N,0.2555
CC12OC1C(=O)C21CO1,0.1997
CN=C1CC(=O)CCO1,0.2191
CN=COc1cnoc1,0.2256
O=CC12C3CC1CC23,0.2265
C(C#N)C(CO)CO,0.2896
CC(C)C1N=CNC1=O,0.227
COC1CC2CC(=O)C12,0.2182
CC#CC1OC2C(O)C12,0.2464
Cc1c(=O)occ(n1)F,0.1597
CC1=NC2(C)CC(C2)O1,0.2657
CC12CC1OC(=O)C2N,0.2466
CC(O)CNC(=O)C=O,0.1757
N=C1CNC(=N)C(=O)O1,0.1887
O=C1CC2C=CC1C=C2,0.2142
CCC12OCC1C2C#N,0.2837
CCNC(CO)C#N,0.2669
C1CC(=O)C(C(=O)C1)O,0.2004
C(C1CO1)C1OC2CC12,0.3177
CC12C3CC=C1COC23,0.1997
CC1OC1C1COC=N1,0.2691
CCC1CN1CC1CO1,0.3146
C1C(CN1)(C#N)O,0.2541
CCC(C)(C#C)C#CC,0.2858
C1CC(C1)(CO)O,0.3108
CC(C)(C)C(O)C(N)=O,0.2721
COCC(=O)CCO,0.2349
OC1C2C(C3CN23)C1=O,0.1908
C1OC11CCC2CC1C2,0.334
CCC1OC(C)C(=N)O1,0.2898
c1c([nH]nn1)C2COC2,0.2501
CC1OCCCC1=O,0.2098
OC1C2CC3CC1N23,0.2791
COCC1OC1(C)CO,0.3343
CC(=N)Nc1cnno1,0.2042
COCCC1CC1O,0.3282
CC1CC=CC1C(C)=O,0.2254
Cc1nccn1C2CC2,0.2419
CC1C(C)N1C1COC1,0.2928
OCC1CN2CC2CO1,0.3031
CC1=NCCNC(=O)N1,0.2424
OCC1CC1OCC=O,0.2226
C1CC1C12COC1CO2,0.302
C1C2CC3(COC3)C1O2,0.3093
OC1CCC=CC1C#N,0.265
CC1CCC(C)C1C#N,0.3361
CC(=O)Nc1conn1,0.2042
O=C1CNC(CC#N)C1,0.2043
COCC#CC(C)C=O,0.2182
CCC1(CO1)C(C)=O,0.2222
c1c2c([nH]n1)C=CCN2,0.1732
CC1CC2CCC1C2,0.3577
CC1CC11OC(C)C1O,0.289
CC#CC(=O)CCCO,0.2094
C#Cc1cncc(n1)F,0.1859
CC1CC1C(=O)N1CC1,0.2486
C#CC12CC1OC21CC1,0.2624
ON=C1CC2C(O)C2C1,0.2373
CCC12COC1C1OC21,0.2958
CC12CC1C1C(O)C21,0.2759
CC1CC2C(C#N)N2C1,0.2583
C#CCC1CC1CC#N,0.301
N=C1NN=NC(=O)C=C1,0.1535
FC1=CC(=N)N=CO1,0.2029
C1OC1C12CC3CN1C23,0.3165
OCC1OC11CC=CC1,0.2682
O=C1OCC2=CCCC12,0.2417
CCC1CC2C3OC1C23,0.3047
Cc1cc(=O)ncnc1,0.1641
C1OC23CC(C2)OCC13,0.3235
CC(CC#C)C#CC#C,0.2295
N#CC12CNC1CN2,0.2499
O=C1C2CC(C2)C11CO1,0.2124
COC1(CO)C2COC12,0.2975
NC(=O)C1(O)CCC=C1,0.2391
CC12C3CC4C(N14)C23O,0.2914
CC12CC1(C)C(=O)C2O,0.2355
O=CC1(OC1C#N)C#C,0.2134
OCC1(COC1=N)C=O,0.2251
CC#CCN1CC1,0.2787
O=CC12OC1C1NC21,0.1906
c1c2c(n[nH]1)CCO2,0.2242
CC1(O)C=CC2CC12O,0.2321
CC(C)(C)OC1COC1,0.3081
CC1C2OC2(C#N)C1N,0.2469
CN1CCOC(=O)C=C1,0.1955
CC(C)OC(=NC)C#C,0.2248
C1CC1C(=O)CCCO,0.2348
C1CC1(C#CC=O)O,0.2003
CC(=NO)C1NC1C#C,0.2358
CC1NCC(=O)C1=NO,0.1487
OCC(O)C1C2CCN12,0.297
Cn1cc(cn1)NC=O,0.2214
C1CC11OCC2CC1O2,0.3197
CC12N=C3OC4C1C2C34,0.155
CN=C1CN=CN1C=N,0.2121
OCC1CC2CN3C2C13,0.3005
C#Cc1ccc([nH]1)CO,0.1962
CN1C2C(=O)C(O)C12C,0.1985
c1c2c([nH]c1O)[nH]nn2,0.2059
CC1(C)C2NC2C1CO,0.2995
CC1C(C)C1C(O)C#N,0.2953
COC(C)(C#C)C(C)O,0.3
C1C2C3C4C=CC3C1N24,0.2335
OCC1CC2N=COC12,0.2625
CC(C)CC(C)NC=O,0.282
OC12CCOC1OCC2,0.3206
CCC1(COC=N1)C#C,0.2686
O=C1NC2(CC12)C1CO1,0.2534
OC1C2OC(=N)OC12,0.2935
C#CC1C2NC2C1C#C,0.2685
NC1=COC(=C1)C1CN1,0.2079
CN1C(CO)C1CC=O,0.2018
CN1CC(=O)OCC1=N,0.2318
CC1CN1C1CCC=C1,0.2482
CC1(C)C2OC1C21CC1,0.3152
C(CO)C(=O)CO,0.2355
CC1(CO)CC=CC1,0.2651
COCC(CO)CO,0.314
CC1CC(C)=CCCO1,0.248
CC(O)C1COC(=O)O1,0.3287
CC1CC(C)(C)C11CC1,0.3413
CCc1c([nH]c(n1)O)C,0.2441
CC1(O)C(=O)NC11CC1,0.2661
CC1(O)CCC1=NO,0.249
CC1CCNC(=N1)C#N,0.208
CCN=C1C=CC(=O)N1,0.181
N=C1NN=CC=CC1=O,0.1478
CC1=CCOCC11CN1,0.2416
CC1C2NC(=O)C12C=O,0.2198
CCC1CC2C(O)CC12,0.3202
FC1=CN=C(F)C(=N)O1,0.1693
OCC(CC=O)C1CC1,0.2058
CC12C3CC1(O)CCN23,0.2993
CNC(=O)N1CCC1,0.2922
OC1C=CC=CCC1=O,0.2018
NC1(COC1=O)C#N,0.2388
C1CC12CCOC23CC3,0.3169
CNC1=CC(=O)N=NO1,0.2027
C#Cc1ccncc1O,0.1839
O=CC1OC1C#CC#N,0.2042
C1C2C3C4C=CC2C4N13,0.2362
COCCC1CC(=O)N1,0.284
COC1C2N3CC3C12C,0.2828
OC1CC1C12CCC1O2,0.3076
C#CCOCC=O,0.2294
Cn1c(ccc1OC)O,0.2328
CCN1C(C)C1(C)CO,0.2968
Cc1cocc1N,0.2272
O=C1CC2C=CCOC12,0.2036
CC12CC1C(N)C(=O)O2,0.2538
OCCC12CC(C1)CC2,0.3425
CC12C3C(O)CC1CN23,0.2934
Cc1c(non1)CC#N,0.2564
CCCCCC(F)(F)F,0.4074
OC12COC1COC2=O,0.2596
CC(C)C(C)(C)OC=O,0.2785
OC1C2C(=O)C=CC12O,0.1861
C1CC1OC1CCOC1,0.314
OC12CC1OC21CC1,0.2918
c1c2c(c(n[nH]2)O)[nH]n1,0.2003
CC1CC2(NC12)C=O,0.2175
OC1CN2CCC12C#C,0.2408
CN1CC1C1=CNC=N1,0.231
CC12OC(=O)OC1C2O,0.312
COC=NCC#CC=O,0.1972
CC(C)N1C2C3CC2C13,0.2911
CCCc1c[nH]nn1,0.2512
CC1CC(=N)OCO1,0.2785
N#CC1OC11COC1,0.2578
CC1CC(C)C(C1)=NO,0.2515
CC(OC(C)=O)C1CO1,0.281
CC#CC12CC=CC1O2,0.233
C1CC2(O1)C1C3CN1C23,0.2978
CN1C=NC(=O)NC1=N,0.2133
CCC(C)C1CC=CC1,0.2649
CCNc1c(cn[nH]1)O,0.2262
c1c([nH]nc1N)N,0.2376
C1CC12C(=O)OC23CC3,0.2764
C1CC1CCC2CC2,0.3586
C#CC(C1CO1)C1CO1,0.3022
CC1C2CCC1(C)O2,0.3242
OC12CN(C1)C2C1CN1,0.3004
CC12NC1C1NC(=O)C21,0.2547
OC1COC11C2COC12,0.2689
CC(C)CC(=NO)C,0.255
CC1=C(C#N)C2CC2C1,0.2057
CN1C2C3(C)NC2(C)C13,0.2903
OC12CC3(O)CC1C23O,0.2804
CC#CC1COC1CO,0.2846
CN1C=CNC(=O)C1=N,0.1714
CC1CCC(=O)CCO1,0.2257
CCC1(CN1C=O)C#C,0.2505
CC(=O)OC1CCC=C1,0.2627
COC1=NC(CN1)C#C,0.2663
OCC1C2CC(=O)CC12,0.2238
CC1C2OC(C)C1C2=O,0.2095
CCC1C(CO)N1C=O,0.2473
CCC1C2CCC1O2,0.3221
CCC(O)C12CN(C1)C2,0.2835
C#Cc1nc(c(o1)N)N,0.1719
COC1CCOCOC1,0.3304
c1coc2c1OCO2,0.2037
CC12CC1COC21CC1,0.3113
CC1(C)C(CO)C2CN12,0.2957
NC(=O)C1COC(=N)C1,0.266
Cc1c(coc(=O)n1)N,0.1588
O=C1COC2=NCCC12,0.2073
c1c([nH]c(n1)N2CC2)O,0.2354
CC1C2CC3OC1C23O,0.3044
CC1COCCN2CC12,0.3044
CC12CC1CCOCC2,0.3203
CCCc1[nH]cc(n1)O,0.2282
CCC1(C)CC(O1)C#C,0.2764
CCCC(=O)CC,0.2349
CN1CC1CC1CCO1,0.2982
OC1CN2C3CCC3C12,0.2604
C#Cc1ccoc1C#N,0.1839
Cc1c(c(ncn1)C)O,0.2112
CC(C)c1cc[nH]c1,0.2507
CC1CC1C(=N)NC=O,0.2281
COC1CC(=O)C(=O)O1,0.1727
CC1(CC=CC1=O)C#C,0.1856
CC#CC1C2C3CC3C12,0.2558
CC(C)N1CC1C1CO1,0.3078
CC#CC(CC#C)C=O,0.2151
OCC12CC(=O)C1CO2,0.2177
c1c(non1)CC(=O)N,0.2314
CCC(O)C(C)=O,0.2387
O=C1C=CC23CC(O2)C13,0.1738
CC(C#C)N1CC1C#N,0.2697
CC(CC(=O)CO)C#C,0.2307
CC1C(O)C2NC12C=O,0.2097
CC(=N)NC(=O)NC=O,0.2211
CC(N)(C#C)C(F)(F)F,0.2968
CC12OCC1(O)C1NC21,0.3057
CC1OC=NC1(C)C#N,0.2678
C1COCCC1CCO,0.3221
C1COC1=NCCCO,0.2781
CC(C#CC#N)N(C)C,0.1878
CCC1(CCCO1)C#N,0.3011
CCc1ccn(n1)C=O,0.2206
CC(C#C)N1CC(O)C1,0.2705
CC1C2COC1C21CN1,0.3073
CC1C2(O)CCC12C=O,0.2158
C#Cc1cc(n[nH]1)O,0.2033
CC1CNC(CO1)C=O,0.1839
OCC12CC3CN(C1)C23,0.2663
CC12CC(C1)C2C1CC1,0.3577
OCC1=CC2CC(C2)C1,0.2476
O=C1COC2CCC1O2,0.2099
CC(C)(O)C1(C)CC1O,0.3134
CC12CC1NC(=O)C2,0.2647
CC(=O)C12CN3C1CC23,0.195
CCCC(O)C(C)CO,0.33
CC12NC1C(O)C2O,0.2948
CC(C=O)C1=CNC=N1,0.2112
CCC1(CCO1)CC,0.3199
O=C1NCC2CC3C1N23,0.2594
O=C1CCC2C3CC12C3,0.2111
C1CC12C=CCC(=O)N2,0.2381
O=C1OC2C1CCC2=O,0.2094
CCC1C2C1C1(C)CN21,0.2897
C1COC=N1,0.272
CC(C)(CO)C(N)C#N,0.2925
CC1=CC2(O)C3OC2C13,0.221
O=C1CNC(C1)C#C,0.2212
CC1C2CC3C2C(=O)C13,0.23
Cc1cc(c(o1)N)OC,0.211
CNc1cnoc1,0.2082
CN(CCO)CC#N,0.2664
CN1C2CCCC12C#C,0.2696
CCC1OC2C(C=O)C12,0.2118
C1CC23CC(O2)C=CC13,0.2292
CN=c1n(cc(o1)N)C,0.2167
C#CCNCC(=O)CO,0.2058
O=C1NC2C1OC21CC1,0.2432
N#CCC12CNC1CO2,0.261
N=COC1(CC#N)CC1,0.282
OC12CC(C1)COC2,0.3178
CC1C2CC(O)(C#N)C12,0.2882
CCC1OC1(C)C(C)O,0.3177
c1c2c([nH]n1)C(=O)CC2,0.1978
OC1CC2=CC(O)CC12,0.2459
CC1C(CC1(C)C)(C)C,0.339
CCC1N=COCC1C,0.2684
CCC1(C)C2CC1(C)O2,0.3137
N#CC1C2NC1C21CC1,0.2774
CC(=O)C1CC(O)CO1,0.2043
CC12OCC1NC2C#N,0.2634
CCCC1(CO1)C1CC1,0.3448
CCC1(C=O)C2CC1O2,0.2061
CC12CC1CCOCO2,0.3228
COC1CC2C(C#N)C12,0.2919
COCC(C)CNC=O,0.2832
CC(CC#N)C(O)C#N,0.3098
C1CC12COCC(=O)N2,0.2648
OC1CC2CC12C#N,0.29
CC1NC1C(=O)N1CC1,0.2418
C1CC1(C2=CCOC2)O,0.2415
CNC(=O)c1cnco1,0.2171
CCN(CC#N)CC#N,0.2466
CC(C)N=c1ocno1,0.2312
Cn1cc(c(=O)nn1)O,0.1769
CCC1C(O)C1(N)C#N,0.2519
N=C1CNCC(O1)C#N,0.2571
CC(C)(C)C1C2CCC12,0.3189
CC1=C(C)C2CC1C=C2,0.2118
CC1C2CC(=O)COC12,0.212
OC1(C=O)C2NC1C2=O,0.1975
CC(C)C(C)C(O)CO,0.3167
CC1N(C)C1(C)C(N)=O,0.2559
C1C2CC11OCOC1C2,0.3373
Cn1c(cnc1O)CO,0.2451
c1cocc1CCC#N,0.2423
N=C1C=CC2C(C#N)N12,0.1908
C#CCCn1cnnc1,0.2609
OC12C3OC1C(=O)C23O,0.2229
CC1CC2OC3C2CC13,0.3109
CC(C)(c1cc[nH]n1)O,0.2633
CC(O)C#CC1CO1,0.2696
CC1(O)C2CCC1OC2,0.3113
CC1OCC1CC(N)=O,0.2641
Cc1cc(oc1OC)N,0.2236
CC12COC(CO1)C2O,0.2986
OC12CC1CC1(CO1)C2,0.3351
CC1CN2C=CC(O)=C12,0.2317
CC1(CCC1)C#CCO,0.2737
CCC1=NC=COC1=N,0.1681
C1C=CCOC(=N1)CO,0.2556
c1c(nnn1C2CC2)O,0.2236
OC12CC(OC1)C21CC1,0.2966
OC1C2CC(O2)C11CN1,0.2869
CC12CC3CC4C(C13)N24,0.2999
CC1C=CCOC(C)=N1,0.2405
COC(C#N)C(C)(C)O,0.304
OCC12C3CC1CN2C3,0.2867
CC1=CCC2OCOC12,0.2626
COCC#CC#CC#N,0.1863
CCOCC1CNC1=O,0.2791
NC1(CN2CCC12)C#N,0.2449
Cn1cc(oc1=O)O,0.2449
COC12CC1CCOC2,0.322
c1c(nnn1C=O)C=O,0.1791
C1OC=NC2C3NC3C12,0.2637
C1CC11CCC2CC1O2,0.3207
CC1CCC2=NC=CN12,0.2511
OC1CN2C3C4C(C14)C23,0.275
CC1CN1C1C2CC1O2,0.3146
CCC(CC#N)OC,0.2928
OC12C=CCC11CC2O1,0.2275
CN1CC1CC(O)CO,0.2843
C#Cc1c([nH]c(n1)O)O,0.208
CC1(CO)CCC(O)C1,0.3281
CC1(OCC1=O)C1CO1,0.2229
OCC(=O)C12CC(C1)O2,0.2175
CCC(OC=O)C#N,0.2789
CC#CCN(C)C=O,0.2712
O=C1CCC2NC12C#C,0.2111
CC1C(=O)CC1(C)O,0.2197
CC12C=CC3(C)CN1C23,0.2285
Cc1cnc(cc1O)F,0.2332
OCC1(C=O)C2CCN12,0.2139
CC1(C)OC2COCC12,0.328
C1CC1c2c(non2)N,0.2168
C1CC1N=C(C#N)N,0.2023
CC(CO)C1(O)CCC1,0.3219
O=CC1(CC1)C1OC1,0.2232
CC1(CO1)C(=O)N1CC1,0.2366
O=C(OCC#N)C1CO1,0.2604
CCC(C)C1(CN1)C=O,0.2231
Cc1cc(nc(=O)o1)O,0.2018
[NH3+]C1C[N-]C(=O)C1C#N,0.2112
CC1C(C)C23CC(C2)N13,0.2813
CC(=O)NC(=O)C1CO1,0.2125
ON=C1CC2COCC12,0.2447
CC1(CCO1)C(F)(F)F,0.3345
COCCc1ncno1,0.2401
OC1C2CC1(C=C2)C#N,0.2419
CC1C2CC1(CC#C)C2,0.313
OC1CC1OC1CCC1,0.3096
CC12C=CCN1C2C#C,0.2245
c1cc(oc1N)N,0.2189
OCCC1(O)CC1O,0.3176
OCC12C3C1C1C3CN21,0.2846
O=CCC1OC2COC12,0.2254
CC(=O)N1CCOCC1,0.2603
CC1(O)C2CC(CO)C12,0.3161
CC1=NC2C=CCC2O1,0.2541
CC1(C)NC1C#CC#N,0.2208
CCOC(C=O)C(N)=O,0.2093
COc1c[nH]ccc1=O,0.1927
CC1N2CC3C2C3C1=O,0.2035
CC1(CC1)CNC=O,0.2809
NC12COCC1OC2=N,0.272
N=COCC1CC2NC12,0.2668
CCC1C2NC(=O)OC12,0.2968
c1coc2c1C=CCC2,0.1864
CN(CC#C)CC(=O)N,0.2528
CCC12CC3N1CC23O,0.3142
CC1(C(=O)CCC1=O)C,0.1976
C1OC2C3C4OC2C1C34,0.3146
CC12NC1CC2(C)C#C,0.2799
NC(=O)C1CC2OC2C1,0.2767
CCC12CC3CC1C23C,0.3189
C#CCCC(=O)C1CC1,0.2306
OCC12CC(O1)C21CN1,0.2857
Cc1c[nH]c(nc1=O)N,0.2132
OC1C2C=CCC12C#N,0.2373
Cn1cc(c(n1)N)C#C,0.2051
CC(C)C1CCOC1C,0.3145
CC1OC2C3C(C12)N3C,0.3149
CCCC1COC1(C)C,0.3172
CC12CCC(N1)C2C#N,0.2878
O=C1CC2(CCO2)C=C1,0.1851
OC12CCC1(O)CCC2,0.3115
CC1(O)CCOC1C#N,0.2903
COCc1[nH]ccn1,0.2519
CC1CC2(CC2)OC1C,0.3025
CC1C=C2C3C4C3N1C24,0.1592
C1C(=CC(=O)N1)CC#N,0.2105
C1NC11CCC2OC12,0.324
C(CC#CCC#N)C=O,0.2248
Cc1[nH]c(=O)c(cn1)N,0.1747
CC1C(OC=O)C1C#N,0.2757
CN=C1CC(C)CCO1,0.2656
CCC(C)CC#CC#N,0.2452
CC(C#CC=O)N(C)C,0.1605
O=CC1CC2CCC2O1,0.2155
CC1OC11C2NC1C=C2,0.2233
CCC(=O)C(C)C=O,0.2007
CC1(C)CC=CC11CN1,0.2458
OC12CC3C1C2C3C#C,0.2959
CC1CC2(CC1O2)C=O,0.2173
C(=O)NC(=N)C(F)(F)F,0.2274
OC1CC2(NCC12)C#N,0.264
CCC(=O)CC(F)(F)F,0.2355
OC12CNC1C2OC=O,0.2517
C1OC1C1=CC=CC=C1,0.2316
O=C1OC2COC=NC12,0.2535
ON=C1CC2(O)CNC12,0.2237
CC1(COC1)C(=O)N,0.2716
O=C1CNC11CN2CC12,0.1928
CC1C=C(CO)CC1O,0.2579
COC1OCC2C1N2C,0.3192
C1CC(O1)C1=CNN=N1,0.2464
CCc1ncon1,0.2676
CCCC1=CNC(=O)C1,0.2093
CCC1(CO1)C(C)C,0.3417
O=C1COC2CC12,0.2169
NC(COCCO)C#N,0.2761
c1coc(nc1=O)CO,0.2091
O=C1CCC2CCOC12,0.2078
CNCC(O)(C#C)C#N,0.258
c1c(n[nH]c1N)CC#N,0.2384
C#CCCn1cncn1,0.2669
O=C1NC2C3CC2C3O1,0.2991
CCC(=O)OCCOC,0.2811
CC1=CC(=N)OC=C1O,0.1581
C1CC(=O)C=C1C=O,0.1544
CCOC12CC(C1)C=C2,0.2405
CCC(C1CC1)C1CO1,0.3382
CC1=CC2C(C1)C2C=O,0.2075
C#CC12OC3CC1C2C3,0.2618
Cc1cncn1C=O,0.188
Cc1cc(c([nH]1)C)C#C,0.2111
CC12CCC=CC1(C)O2,0.2415
C1C2CN3N=CC=C3N12,0.2446
OC1C2OC11CC(=O)C21,0.2088
c1cocc1CNC=O,0.2358
OC1C2C3C2C1C3C#N,0.3051
CC(CC=O)OCC#C,0.2239
O=CC1C2CC(=O)CC12,0.2204
C#CC(=O)NC(=N)N,0.1861
C1c2c(non2)OC=N1,0.2221
Cc1c(noc(=O)n1)C,0.171
CC(CCO)CC1CC1,0.3416
C1CC2(CCC=C1)CC2,0.256
OC1C(O)C2(O)COC12,0.2911
CCC1(CC)CC(=N)O1,0.2878
N=C1OCC(CO1)C#N,0.2753
C#CCc1nc(no1)N,0.227
c1nc2n(n1)CCC2,0.2677
c1coc2c1COC2,0.2308
Cc1cn(nc1N)C,0.2299
N=C1OC(=O)C2OC12,0.2384
NC1C(NC=O)C1C#N,0.2592
CCC12C(O)C1C1NC21,0.2761
OC(C#N)C1COCO1,0.2797
C#CC#CC(=O)C1CC1,0.1825
OC1CN(CC=C1)C=O,0.2415
CCC#CC1(C)CC1O,0.2773
N=COC1COC11CC1,0.2561
CC1COC(=O)NC1=N,0.2575
N=C1CC2(CC3NC23)O1,0.2749
N=C1NC2COC12,0.2515
COC(CO)(CO)C#N,0.286
CC12CC1CCC2=NO,0.2451
C1CC11C2NC2C11CN1,0.2945
N#CC12C3OC4C(C14)C23,0.266
CC(C)(C)CCCC=O,0.2287
CC1=CC2(CO2)C(=O)C1,0.2056
CC1CCOC(C)CO1,0.3197
c1[nH]c(c(n1)CC#N)N,0.2315
C#CCn1ccnc1,0.2443
OC1CC11CC(=O)N1,0.276
N#CC12CCC(CO1)O2,0.2845
c1nc([nH]n1)CC(=O)N,0.2549
CC1CC2COC12CO,0.3014
CC1CC2CC1C2C=O,0.2243
OCC1(NC1C=O)C#N,0.2145
NC(=O)C1CC(N1)C=O,0.2129
CCC(CC#N)C=O,0.2245
CC(O)CCCC(C)O,0.328
CC1=CC2C3N2CC=C13,0.1687
CCC(O)COCC=O,0.2161
NC1=CC(=N)N=C(O)N1,0.2071
CC(C)C1OC1C(C)O,0.3435
CC(=O)CN=C(C=O)N,0.17
OC12C3C4C5C(C15)C2C34,0.3144
CC1(C)CC2COC1O2,0.3312
NC1(CN2CC12)C#N,0.2679
CC1C(O)C(=N)OC1=O,0.2581
OC1C(O)C2OCC12,0.2853
CCOC1CCOC1=N,0.2683
CCN1C=CCOC1=O,0.2185
c1c(con1)C(=O)N,0.2254
COC1C2OC2C11CC1,0.3162
CC(CO)C#CC=O,0.2051
CC12CC(C1)CC2(C)C,0.3583
CC(C)(CCO)C=O,0.2285
NC1=COC(=O)C(=N)N1,0.164
CC1(CCC1=O)OC=O,0.2082
NC(=O)C12COC1CO2,0.2517
CC1N2C3CC3C12C=O,0.1868
CC12CN1CC(C2)C#N,0.2788
CC(C=O)C1CN1C,0.2067
CNC(=[NH2+])C(C)C([O-])=O,0.2297
CCCCc1ncon1,0.2661
CC1(CO)C2CC1CC2,0.3192
OCC(=O)CC1CC1O,0.2399
O=CCC12COC1CO2,0.2197
N#CC1CC=CC2NC12,0.2431
C#CC12CN1CCCC2,0.2658
O=CC12COC(CO1)C2,0.2146
CCN1CC1CC1CO1,0.3134
OC1C2OC3CC3OC12,0.2931
CC1OC(CO)C1(C)O,0.3034
CC#CC(O)CCC#C,0.2841
COC(C#C)C(C)=O,0.2085
CC1(OCC1C=O)C=O,0.2107
CC(OCCC#C)C=O,0.2267
CC1=CC2C=CC1C2=O,0.2389
CC1(C)OC11CC2CC12,0.3292
CN1C(CC=O)C1(C)C,0.1986
CNc1c([nH]nn1)C#C,0.175
Cc1cn2ccnc2o1,0.224
C1C=Cc2c1c(no2)O,0.1895
CC(CO)(C=O)C1CN1,0.2192
C1CC2(CO1)CN=CO2,0.2717
CC1NC(=O)N(C)C1C,0.2902
CC12CC(C)(O1)C21CN1,0.3029
O=CC12CC3CC(O1)C23,0.2053
CC1OC2C1C2C(C)=O,0.2187
OCC1OC1C1CCO1,0.3207
O=CNC1=CCC2OC12,0.2069
O=CC1CC(=O)OC=N1,0.2222
NC12COC1COC2=N,0.2596
COC1CC2(C)C(C)C12,0.322
CC12CC1CC=CC2O,0.2632
CC(C#C)C(=O)C1CN1,0.2239
C#CC(=O)c1cocn1,0.1904
CN=C1OC2CC2C=C1,0.1914
O=C1OCOC2CC1C2,0.2608
CCC1CC(CC=O)C1,0.2273
COCC1CC=CC1O,0.2599
CC12OCC34OC(C13)C24,0.2915
CC1(OCC11CN1)C#C,0.2685
CNc1cc(n[nH]1)NC,0.2265
O=C1CCC2C3CN2C13,0.2125
Cc1cnc(oc1=O)C,0.192
C1COCC=CCC=C1,0.2316
c1nc(c(n1C=O)N)O,0.1718
COC(C)C#N,0.3042
C1C=CCN(C=C1)C=O,0.216
C1C2OC3CC1OC23,0.3232
CC12OCC1CC2=NO,0.2374
NC(=O)C#CC(O)C#C,0.2311
COC1CC(=O)C1O,0.2077
CCCC(C)C(C)(C)C,0.3661
CC1OC23CC(OC2)C13,0.2794
CC1=NOC(=O)NC1=N,0.2145
COCC1C2C3CC2N13,0.311
CC1C2CCC(C)C12C,0.3265
c1c(c2n(n1)CC2)O,0.2374
CCc1cc(c(o1)O)N,0.212
CNC(=O)C(=O)CO,0.1804
c12c(n[nH]c1nno2)N,0.166
O=C1NC2C3CCC2C13,0.2573
OCC1CNCC(=N)O1,0.2475
CCOC12CN3CC1C23,0.2984
CC1(C(=O)CO1)C,0.2235
CC(CO)CCC#N,0.3139
CC12CC3C1N3CC2=O,0.2173
OC1CC23CN4C2CC134,0.2411
OC1C(C=CC1=O)C#C,0.1903
OCC1COCC2CN12,0.29
N#CC12CC3OC1CC23,0.2784
CCN1C=C(O)OC1=N,0.2266
CC1NC1(C)C1(O)CC1,0.296
CC1CC2C(O)CC2O1,0.2939
CC1(O)C(O)COC1=N,0.2841
C1OC2=C(C=C1)N=NO2,0.1504
CCOC1CC2(CO2)C1,0.3218
CC#Cc1nc([nH]n1)N,0.2152
CC1CC11CC(=N)O1,0.2755
OCC12C3C4C3C1(O)C24,0.2859
Cn1cc(cc1N)C=O,0.1828
CCNc1nc(co1)N,0.222
N#CCC12CC1CCO2,0.281
CC1C2CCC(O2)C1C,0.3184
CC(CC(O)C=O)C#C,0.228
CC12C3OC1C1(CN1)C23,0.2927
CN1CC11CCOC1=N,0.2542
COC1CCC=CC1O,0.2631
N#CCOC1C2CC1O2,0.2522
CC1C=CC(C)C2CC12,0.2609
CCC12CC(O1)C2(C)O,0.3014
CC12OC3CC1(C#N)C23,0.264
N=C1OC(=O)CC1C#N,0.2623
CC1C2CC(CC1O)O2,0.3004
C1CC23CC(OCC2)C13,0.3005
COC1(C)CC1C(N)=O,0.2631
CNC1=NC(=N)N=NO1,0.2422
CC1(C#C)C2C3C1CN23,0.2787
CC1NCC2NC12C#N,0.2435
NC12CN3C1C2(O)C3=N,0.2462
c1c(n[nH]c(=O)n1)C=O,0.1561
N=C1OCOC(=N)C1=O,0.1734
C1C=CC2OCCOC12,0.2414
CC1C2OC1(C)C2=NO,0.2562
COCCOCC1CC1,0.335
c1c2n(nn1)CC2,0.2611
OC12CC3C4CN4C1C23,0.2926
O=C1NC2C3CCN3C12,0.2327
CC1N2C(=O)C(C)C12C,0.2324
CC12CC1C(=N)NC2=O,0.2399
CC1=CC2CC(=O)C1N2,0.2072
CC1CCOC(=N)C1,0.2783
CC1OCC11C2CN1C2,0.3125
CC1(O)C(=N)NC11CC1,0.2562
CN=C1NN=CN=C1,0.1524
CC(=O)C1NC1C=O,0.1996
CC1CC1(C#C)C(C)=O,0.2282
C(#N)c1c([nH]nn1)N,0.228
C1NC11COC11COC1,0.3055
CC(=O)CC#CCC=O,0.2083
OC12COC(C1)C1NC21,0.3088
CCCC1CC1(O)C#N,0.2931
COC(C=O)C(O)C#C,0.2152
CCC1C2CC3OC3C12,0.3273
COCC12OC1C1OC21,0.2921
CN=C1CNC2CC2O1,0.2552
CCC(OCCO)C#C,0.293
COCC12CC1OC2,0.3091
CC1=NCC=CC(=O)O1,0.2072
CC(=O)C(=O)C(=O)C,0.1426
CC1(O)CCC2(CO2)C1,0.3182
C1C(N1)(CC=O)CC=O,0.2017
OC1CC=CC1(O)C#C,0.2453
N#CC1CC=CC2CC12,0.2472
Cc1ncn(n1)C2CC2,0.2608
CC1N2CC2C1(O)C#C,0.258
CCCN(CC)C(=O)C,0.2665
Cc1c(cc(o1)OC)N,0.2202
CC1CC(C)C2CC1O2,0.3116
COC12CC1OCC2O,0.2918
CC(O)CCOC=O,0.2852
CC1C2C1C1(O)CC2C1,0.3191
N=C1C=CON=CC1=N,0.1737
CC12NC1C1(O)C(O)C21,0.2779
CC1(C)C(N)C1(N)C#N,0.2553
CC1(O)CC2(CC12)C#C,0.2707
C1C2N=C3C=C1C1C2N31,0.1449
CN1C2CC1(C)C2C#N,0.2416
COC12CN3CC1C23,0.2984
CCOc1cnncn1,0.1813
CN1CC2COC(=N)C12,0.2322
CC1(CN1C2(CC2)C)C,0.2916
COC(C[NH3+])CC([O-])=O,0.2019
CC1(CO1)C#CCO,0.2758
CCC12CC1N(C2)C=O,0.2573
C1C2CC3COC2C13,0.3295
CC12CC1C(O)C(=N)O2,0.2694
C#CC1C2OCCOC12,0.2669
COC1C2OC(=O)OC12,0.3065
N#CC12CC3C1CN23,0.2558
C1OC2C3COC2C1O3,0.3222
c1nc(=O)n(nn1)C=O,0.1456
CC1N2CC(C)(C2)C1=O,0.2037
CC1(C(O)C1O)C(N)=O,0.2678
CC(O)C12CN(C1)C2C,0.2848
CCCC12CCC1O2,0.3292
CCCC1C2OC2C1C,0.3308
CC(=O)c1c(con1)N,0.1589
Cn1c(cc(=O)nn1)N,0.172
NC(=[NH2+])C(O)C([O-])=O,0.2245
OCC1CC11OCC1O,0.289
CC1C=C2CCC2C1C,0.2448
CC(C#N)C1=CNC=C1,0.25
CCC1(C)CC(=O)N1,0.2831
COC(=O)n1nnnn1,0.2318
O=CC1C2N1CC21CN1,0.2077
OC12CC3OC1C1C3C21,0.3006
N#CC1NC(C=C1)C#N,0.2389
CC1COCC1O,0.308
CC12OCC1COC2=N,0.2632
O=C1OCC1NCC#C,0.2516
O=CC(=O)C1C2COC12,0.1496
CCC#CC1CC(=O)O1,0.2729
Cc1cc(c(cn1)C)F,0.234
OC12CC3CC1COC23,0.3048
CCC1C2OC1(C)C2O,0.3015
CC1(O)CC(C)(O)C=C1,0.2581
CC1C2CN2CCC1=O,0.2125
OC1C2CC3NC3C12,0.2801
CC1(CC1O)C#CCO,0.2674
CC(CO)C1C(C)C1C,0.3332
CCC1C(O)C1(C)CO,0.3121
CC(=N)N(C=O)C1CC1,0.2405
CC1C2CC11N=COC21,0.2558
CCN1N=C(O)OC1=N,0.238
CNC(=O)C1OCC1=O,0.2014
c1cc2c(nc1)n[nH]n2,0.1892
c1nc(n(n1)C=O)CO,0.2171
CC1NC1(C)C1CC1O,0.3
C1CC23NC4C2OC34C1,0.2785
Cc1c(non1)N(=O)=O,0.2018
CC(C)CC12CC(C1)O2,0.3169
Cc1c(c(n[nH]1)C)OC,0.2462
CC(C#N)C1(CC1)C=O,0.2315
FC1=CC(F)=NC(=N)N1,0.1823
CCC1(C)OCCC1=O,0.2164
CC1CCC(C)C1,0.3805
OC12C3C4C5C(C13)C2N45,0.2874
CC1OC2(CC2)C1C#C,0.2677
CCCC#CCC#C,0.2873
CC(C(O)CO)N1CC1,0.311
c1c2c([nH]n1)COC=N2,0.2038
CCc1nccc(=O)o1,0.1956
CC1=C(CCC1)NC=O,0.2076
CN=C(C=O)N(C)C=N,0.1456
CC(=O)C1=CCN2CC12,0.1753
COCc1ccc[nH]1,0.2396
COC(=O)C1CN=CO1,0.2569
C1CC1c2[nH]c(=O)[nH]n2,0.233
c1ccn(c1)C2COC2,0.2444
c1c2c(n[nH]1)CCCO2,0.2287
CN1CC2CC2OC1=O,0.2917
CCc1c(oc(=O)[nH]1)N,0.2371
COC(=O)CN,0.2616
CC(C)C1C(C)N1C=O,0.2551
CCC1(O)COC(C)C1,0.3028
CC1NC1CC(F)(F)F,0.3276
NC(=O)CC1(CO)CO1,0.2603
N#CCC12NC1CC=C2,0.2497
CC(C)(CC(=O)CO)O,0.2355
[O-]C(=O)C1C2CC1[NH2+]C2,0.1612
c1nc(nnn1)N2CC2,0.1658
CC1OCC2(C)CC1C2,0.3216
OCC(O)C1NCC1=O,0.215
OC12COC1C1(CN1)C2,0.2906
NC1C2CC1(NC2)C#N,0.2601
OC1C2CC3(CN3)C1O2,0.3106
O=CC1C(C#N)C2CN12,0.2156
N=C1NC=CNC(=O)N1,0.1978
O=CC1(OC1C#C)C#C,0.2049
CN1CC2OCC=CC12,0.2229
OC1CC(O)C(C1)C=O,0.2305
CCC1(CCO)CCO1,0.3165
CCC1OCC=CC=C1,0.1902
C1OC2C3OC3C2C=C1,0.2606
OCC(O)C1(CO)CC1,0.2957
CC1C(N1C=O)C(N)=O,0.2357
CC1C(=O)CCNC1=O,0.2219
CCCOc1ccn[nH]1,0.253
CC(CO)(CO)C(=O)N,0.2666
C#CC1=CCOCC1,0.2121
CC1C2C(O)CCCN12,0.2772
NC(=O)C12CC3CC1N23,0.2602
CC1(O)CCCC1CO,0.3185
CNC(COC)CC#N,0.2716
O=CC1CC(=O)N1,0.2164
CC1C2CC1(CCO)C2,0.3436
C[NH2+]CC(=N[O-])C1CN1,0.1843
CC1C=CC2(C)CCC12,0.2585
OC1CN2CC2(C1)C#C,0.2675
CCC12C3CC4C1N4C23,0.2942
C1C2OC3CCC2OC13,0.3255
[O-]C(=O)C1CCNC=[NH+]1,0.2463
CCCCc1nnon1,0.2444
OCC(CC1CO1)=NO,0.2516
CNc1cn[nH]c1C#N,0.1803
CC1C2OC3(C)C2C13C,0.3072
CC1C2C(O)C1C21CN1,0.3139
CCC12CC1CCCC2,0.3344
CC(=O)N1C=CCC1=N,0.2114
CC1C(=O)C2OCC12C,0.1979
CC1(O)C2C3C4C2C1N34,0.3075
CCCC1CC(C1)C#N,0.3332
O=CC12C3OC1C=CC23,0.2077
COC1C2OC(=N)C12,0.2721
CC1(CO)CC(C1)=NO,0.249
CC(CC1CC1O)C#N,0.3077
CC1COCCN=CO1,0.2609
CC1CNC2=NNN=C12,0.2084
OC1COCC(C1)C#N,0.2928
CN=C1C=CN(C)C=N1,0.1801
c1coc2c1OCC=C2,0.1633
Cc1c2c(co1)C=CC2,0.1949
CN=C1OCC2OC12,0.2566
CCC(=NO)C#C,0.2072
N=C1OCCOC11CC1,0.2608
CCC(O)CNC(N)=O,0.301
Cc1nc(c(=O)[nH]n1)N,0.1813
Cc1c(cco1)C=O,0.1951
CC#CC(=N)OCC#C,0.238
c1c(cnoc1=O)F,0.1868
Cc1cc(c(o1)C)N,0.2136
CCC(C)(O)C(C)(C)C,0.3217
Cc1c(cnn1C)C#N,0.2378
C#CC#CC(F)(F)F,0.2309
c1cnc(c(c1O)N)F,0.2067
CN(C)C(=N)C(=O)C#C,0.1472
CN(C=O)C1CCC1,0.2698
C1CC(C1)(C(=O)C=O)O,0.1403
OCC(=O)C1=NCCN1,0.1652
CC1CN1CCCO,0.3014
c1cn[nH]c(=O)c1C=O,0.1479
CNCC1(CO1)C#N,0.2439
Cn1c(n[nH]c1=O)C#C,0.1877
CC1N2C3C=CC2C13C,0.207
CC12OC3(C)C=CC1C23,0.2261
ON=C1CCCC11CN1,0.2256
C#CCCc1ccon1,0.2516
CC1C=CCC11CO1,0.2666
O=CN1C2C1C1CC2C1,0.2606
CC1C2NC(C)C12C#N,0.2526
CC1CC(O1)C1(C)CN1,0.314
O=C1CC2CN2C1=O,0.1551
CC12CCN1C2(C)C=O,0.2142
NC(=O)C1C=CC2CC12,0.2483
C#CCN=c1[nH]nn[nH]1,0.2014
CC1(O)CN(C=O)C1=N,0.2241
COCC1=CCOC1=O,0.229
N#CC1CCC2OC12,0.3128
Cc1cnnn1C=O,0.2031
CCC1C2CC2OC1=N,0.2729
OC1CC1(CC#N)C#C,0.2846
C1CC(=O)C=C1CC#N,0.1898
CC12CC3CC1C2C=C3,0.2445
CCC1(CCC1C)OC,0.3176
OC1C2C3C2C2(CO2)C13,0.3362
CC(O)(CCO)C#C,0.2988
CCOCCC1CO1,0.344
CN1C=C(O)OC1=N,0.2272
CC1OC11C2CC1OC2,0.3166
CC1C2CC1(O)C(C)O2,0.2973
CCOCC#CCCO,0.2857
CN1C2CCC(O)C12,0.2824
CC(=O)N(C)CC=O,0.2129
CC1(CCC1)C#C,0.3059
CC1=CCn2c1ccc2,0.1797
Cc1c(nc[nH]1)C(=O)N,0.2287
CC1C(NC1=O)C1CC1,0.279
CC1C=CC=CC2CC12,0.1849
OCC1NC(=O)C1O,0.2691
CC(CCO)C(C)C=O,0.2265
CC#CC1OC1(C)CO,0.2706
CC(C)(C)COCC#C,0.2886
CC1C=CC2=C1C=CO2,0.1773
Cc1ncc(nn1)O,0.1687
OC12CC3C1C1C(C2)N31,0.2941
CNCC(=O)C(=O)C#N,0.1053
CC1=NCCC(O1)C#N,0.263
C1OCC23CC=CC2C13,0.248
O1C2C3C4C5C1C2C5N34,0.2913
C1NC11CCOC=NC1,0.261
CC(=O)n1nccn1,0.2231
CCN1CC(CO)C1=O,0.2772
O=C1NC23CC12COC3,0.255
NC(=O)C(O)C1CO1,0.2756
CCOCCC(O)CO,0.3139
CC(C)C1C2NC1C2=O,0.2499
COC12C3CC1OC23,0.3058
CCC(CC)(C=O)C#C,0.2185
C1C=CCC12CC=CC2,0.2606
CC12OC1CC1OCC21,0.3217
CN1CC(CC#C)C1=O,0.2753
CC1=CC=NC(=N)O1,0.1657
O=CC12OC1CC2C#N,0.2193
OC12CC1(O)C=CCC2,0.2401
CCC1OC2C1CC2=O,0.2004
NC12C(O)C1COC2=O,0.2444
C#CCOCCN1CC1,0.2676
c1cc(oc1)C=O,0.1894
CC1(CCCO1)C#C,0.2973
O=C1CCC2NC2C=C1,0.1838
CC1C2C3C(O)C2(C)N13,0.3146
O=C1CN=C2OCC2O1,0.2496
CC1C(=O)C(C)C11CO1,0.2129
O=C1CC2C(C#C)N12,0.2302
CN(C)CC(=O)C(=N)N,0.1588
CC1(C)OC(=N)C1O,0.283
COC1C2OC(C)C12,0.3042
NC(=O)N1CC1C1CN1,0.2772
CC#CC(C)C#CC,0.2858
C#CCCC1C2CC1O2,0.2893
CC(=O)C1C2CC1(O)C2,0.2243
CC(=O)C#CC1(CC1)O,0.2075
C1CC1CC2=NCCO2,0.2676
OC12C3C1C1C3CCC21,0.3033
OC1CNC1C#CC=O,0.19
OC1(CCC1C=O)C#N,0.2247
CN(C)Cc1ncon1,0.1946
OC12CC3(CCC13)C=C2,0.2262
OCC1OC2CN3C2C13,0.3088
Cc1cc2cc[nH]c2[nH]1,0.2198
N=C1OCC1CC1CN1,0.25
CC1(OC1C#N)C1CO1,0.279
CC1C2CC3C(C2)C13C,0.3381
CCCC1OCOC1=N,0.2885
CC1(C)OC1(C)CC#C,0.3044
CC(O)CC1(C)CC1O,0.3154
CN1CC1C(C)(O)C=O,0.1968
C(Cn1nnnn1)C#N,0.2686
Cc1cc(n[nH]1)CC#N,0.2556
c1cc(ncc1O)F,0.1991
CC(CO)CC1OC1C,0.3288
OC(CC#C)C(O)C#N,0.2985
C1C23CCC12OC=NC3,0.2629
CCCC12CN1C1CC21,0.292
OCC12CC(C1)C(=O)N2,0.2593
CC(C)OC(=NC)C#N,0.2273
OC1CCC2CC2C1O,0.312
CC1C=CCC2C(O)C12,0.2445
OC1(CC2NC2C1)C#C,0.2739
NC1CCN2CC12C#N,0.2692
COCCC1(CO1)C#N,0.2642
CCC12C(C)C1CC2O,0.3134
CC12NC1C1(CN1)C=C2,0.2371
O=C1C2CC3OC1CC23,0.2077
O=CCC1CC(=O)O1,0.2252
[O-]C(=O)C1CC2CC2[NH2+]1,0.2592
N#CC12CCC3OC1C23,0.2734
O=C1C2C3CC2(C#N)C13,0.2465
CC1(C)CC2OCC2O1,0.3285
CCC(=O)C12CC(C1)O2,0.2235
OC(CC#N)C1CN1,0.2804
CN1C(=O)C2C(O)C12C,0.2462
CC1=CC(C)(O)COC1,0.2538
CC1CN1C1CCOC1,0.3088
CC1(C)C2C3OC1C23O,0.2947
N#CC1(CNC=N1)C#N,0.2469
CCC1(O)C(C)C1(C)C,0.3096
c1c(onn1)CC=O,0.2112
CC12C3CC1C(=O)OC23,0.2694
O=COC1C2C3OC2C13,0.2509
CC1(CO)OC1C1CN1,0.3187
CC1CC2=CC(C)=CN12,0.2451
CN1CC(C1)OCCO,0.2933
CC(C)C1(CC1)CO,0.3355
CC1C(C)(C)C1(C)O,0.311
O=CCC1CC11COC1,0.2227
C1OC2C1C21CCCC1,0.3057
CCc1c([nH]nc1C)C,0.2525
OCC12CN1C(=O)CC2,0.2414
c1(c(c(oc1O)O)N)N,0.2178
CCCC1C(C=O)N1C,0.1945
C#CC12CC3C1CCN23,0.2638
COCCOCC#C,0.2747
OCC1=CC(OC1)C#C,0.2548
CC1OC(=O)CC=C1,0.2634
CC1=CC(COC1)(C)C,0.2614
C1OC23COC12CCC3,0.2959
NC12C3OC1C3NC2=O,0.2349
CC(O)C(C)(C)C(N)=O,0.2732
c1cc([nH]c1)N,0.2406
CC12CN1C(=O)C1CC21,0.2352
OC1CCOC=NCC1,0.2569
OC1CC1C1=CCCC1,0.244
c1cn[nH]c1CCCO,0.2573
OC12CC1(O)C1CC2C1,0.2902
CCOC(=O)NC=N,0.2537
CN(C)C12CC1OC2=N,0.2341
CCCc1c(nco1)N,0.2088
FC1=CNC(=N)NC1=O,0.1845
O=CC(=O)C1(CN1)C#C,0.1543
CCC1OC1C(O)CO,0.3181
CC1CC23CC(C)(C2)C13,0.3039
CC1CC11CC(=O)C1,0.221
CCC1N2CC2C1=NO,0.2321
OCC1CC1NCC#N,0.2595
C1OC1C12CC3C1CN23,0.3147
CC1C2CC(C)COC12,0.3196
C#CCNCC(=O)C#C,0.1687
CCC1=CC(C)NC1=O,0.2208
CC1=CC(=NO)C(=N)N1,0.1461
CC1CC=CC(CO)O1,0.266
c1c(ocn1)CNC=O,0.2402
C1CC=C(C1)CNC=O,0.2507
CCOCCCC#CC,0.3044
OC1CC1(O)C1(O)CC1,0.2852
CCC1CC=CC2NC12,0.242
CC1C2CC(=O)C1CO2,0.2224
c1(c([nH]nc1O)O)N,0.2609
CC1=Cc2c(cno2)C1,0.1838
C#Cc1cnc2n1CC2,0.2063
OC1COCCC=C1,0.2483
CNC1C(C#N)C1(C)N,0.2556
CCC(=O)C1CC1O,0.2205
OCC(=O)C1COC1=N,0.2319
CC#Cc1ccno1,0.2006
COC1COC(=O)C1=O,0.1567
CCC1C2OC2C1(C)O,0.3178
N#CC1NC2CC12C#N,0.2508
CCC1C2OC(=N)C12O,0.2558
OC1C2CC=CC1O2,0.2341
Cc1c(oc(=O)o1)N,0.252
CCN=C1CCC(=O)O1,0.2519
O=C1CC2CC3CC3C12,0.2145
CC1CC(=O)C2(CN2)C1,0.2196
CCC(=NO)C(C)C#C,0.2549
CN=C1OC2C(C)C12,0.2701
OC1C2CC1C=C2,0.2421
CCC(O)C(C)CC#C,0.3119
N#CC12CC1C=CCO2,0.2344
CC1(C=O)C=CC2NC12,0.2163
CC1C2CC3(C)CN2C13,0.2989
CCOC1(CC1C)C=O,0.2203
CN=C1CC(C)(O1)C#N,0.2642
Cc1ccnn1CC#C,0.2511
CC1(O)C2C3C1C(=O)N23,0.25
COCC(CC=O)C#C,0.2237
C#CCc1ccccc1,0.2389
OCC1=NC(=N)N=NO1,0.2064
CC(C)c1nnon1,0.247
CC(O)C(C)NCC#N,0.2671
OC12CC1CC2C=O,0.2173
C1CC23NC(C=C2)C3O1,0.2287
Cc1cnc(nn1)F,0.1672
C1OC2C3C4C5C4C12C35,0.3162
OCC1OC2CCC2O1,0.3148
CC1C(=O)NC=C1C#C,0.1816
CCCC(=O)C#N,0.2113
CC1=CCOC12CC2,0.2296
OCC12CC3C(O1)C23O,0.289
CC12CC1C(O)(C2)C#N,0.2869
N=C1CC(CN2CC2)O1,0.2782
OCC(O)C(O)C#N,0.2908
CCCC(C)(O)C1CC1,0.3292
CC1OC1(CO)C#N,0.2896
N#CCC1CCCCO1,0.3001
CCC(C)(C)CC(C)C,0.3625
CCOC(C=O)C#C,0.2174
c1cc([nH]c1)OC(=O)N,0.2198
Cc1cnn(n1)C(=O)N,0.2317
CC1CCOC(=N)O1,0.2888
CC(C)c1c(cno1)N,0.2092
c1c(c(oc1N)N)C=O,0.1803
CC1(C)COC1=N,0.2932
CC1CN2CC2C1O,0.2848
OC1C2CC11CCC1C2,0.316
CC1CC1(C)CCO,0.3373
N=C1OC2C1CC21CO1,0.2805
CC(C)C1C(O)C1C#N,0.2979
C1OC11CC2COC2C1,0.3161
CC1(O)C=CCN2CC12,0.2307
CC1(O)CC1(C)CCO,0.3207
CCC1CC(O1)C1CN1,0.3128
CC1C2OC=NC1C2=O,0.1967
CCc1conc1C,0.2487
CC1C2OC1C1CC21,0.3315
CC1NCC(=O)C=C1,0.1777
OCC(C1CO1)N1CC1,0.3005
CC1CC(=N)O1,0.2903
CC1OCC=CC1C,0.2657
OC1CC2C3C1CCN23,0.2963
CC1=CC(=O)NC(=N)N1,0.196
CCC1COC1=NC,0.2788
O=C1CC2NC2CCN1,0.2675
CC1(C=CC2NC12)C#C,0.2418
Cn1ccnc(c1=O)F,0.1754
N#CC1CCCOCC1,0.2977
N=C1N=NOC=CC1=O,0.1678
CC1(CC1)C(=O)CC#N,0.2345
CCCOC(=O)COC,0.2808
CC1NC2=NCC(=O)C12,0.2052
O=CC1C(=O)CC11CN1,0.2052
OC(C1C[NH2+]C1)C([O-])=O,0.1551
Cc1c(cncc1O)N,0.1991
CCOc1[nH]c(cn1)O,0.2458
CC1C2CC2(CO)C1C,0.3164
O=CC1CNCC(=O)O1,0.1903
CCC1=CCCC11CO1,0.248
CC1(CC(=O)CC1=O)C,0.1998
CC1(CO)CC=CC1=O,0.1897
CC12C3C(O)C1CCN23,0.3047
CC1C2CC2C1(C)C#N,0.3125
C1CC1N=CNC=O,0.2183
CN1CC2NCC(=O)C12,0.1861
CC(C)(C)C1(CC1)O,0.3046
OC1CC2C1NCC2=O,0.2061
C1CC(C1)C(=O)NC=N,0.2349
N#CC12NCC3NC1C23,0.2449
CC1OCOCC1(C)O,0.3146
CC1(O)CCCOC1=N,0.2771
CC1OCC(CO)C=C1,0.2545
COC1(CO)CC2CC12,0.3256
OC12CN3C1C2OC3=O,0.2548
COc1c(cc([nH]1)O)N,0.2262
CCC1OCCC1C#N,0.2967
CC(CC#N)N1CC1C,0.2697
c1cncnc1CO,0.2137
c1c(c(=O)nc(o1)N)F,0.2141
N=C1C=CNN=C1C#C,0.1608
N=C1OC2C3CC(O1)C23,0.2969
CC1(C)C2CC(C#N)C12,0.3023
O=C(C#C)N1C2CC1C2,0.2088
CC(CO)C(C)NC=O,0.2802
OC12CC(OC1=N)C=C2,0.2391
OC(C#N)C1=CC=NN1,0.2413
OC1CC=CC1=O,0.1914
OC1CC2C3C2C2C3C12,0.2834
CCC(=O)N1CC2CC12,0.2595
COc1cc([nH]n1)C=O,0.1682
CC(=N)OC1CCCC1,0.2943
CCOC1(C)CCCO1,0.3408
CCC(C=O)C1NC1C,0.2243
NC1=C(O)N=COC1=N,0.155
C1NC11CCC2COC12,0.3086
OC1CC23CC12CC=C3,0.2341
CC12CC3CN1C23CO,0.311
OCC(O)C(C#C)C#N,0.279
c1c(n[nH]c1OC=O)N,0.1969
OC1COCC2CC1C2,0.313
C(CNC=O)C(=O)CO,0.2322
CC12COC3CC1C23O,0.2978
CCC1CC1(O)COC,0.3193
O=C1CN2CCC(=O)C12,0.1826
CCn1cc([nH]c1=O)C,0.2281
C1NC2C3CC=CC12O3,0.2178
CC1C(O)C2CC(=O)N12,0.2367
CCC1(CCO1)C#C,0.2789
CCC1C(O)C2CCC12,0.3057
O=C1OC2C(C#C)C12,0.2527
CC(=O)C(=O)OCC#N,0.1815
O=C1CC23CCC2C1C3,0.2202
CC12CC3C(CC1)C23O,0.3047
CCC(=O)OCC1CN1,0.2533
CC(O)C12CC1C(=O)C2,0.2321
CC(CO)CC(=O)CO,0.2409
c1c[nH]nc1NC=N,0.2207
COC12CN3C(C13)C2C,0.2953
OC1CC1(OC=O)C#N,0.2529
Cc1c(nco1)NC=N,0.2078
CC(C)C1CCC(C)O1,0.3301
O=CN1CC2C3CC1C23,0.2704
COC1(CNC1=N)C#N,0.2477
CC1C2CN(C)C12C=O,0.1903
CN1C(CNC1=O)C#N,0.2702
CC1C=CC(O)C1(C)C,0.2539
CC12CC1CC(C2)C#C,0.3132
CC1CC1(C)C,0.3445
CC#CCNC(C)C=O,0.2102
OC1CC1C(C#C)C#N,0.2946
O=C1NC2CC(=O)CC12,0.2223
CCCOC1(C)CC1O,0.3167
CCOc1nc(on1)C,0.2457
O=C1NC2CC2O1,0.3002
CC(C)(CO)OCC#N,0.2961
c1c(c[nH]c1N(=O)=O)O,0.1499
C1C(=C(C(=O)N1)C=O)N,0.1829
COCC(OC=O)C#C,0.2577
N=C1C=NNC=CC1=O,0.1688
COC1C2CC3C2OC13,0.3049
CC(C)C1CC2CC12O,0.3097
OCC1CC2CC(=O)C12,0.2166
O=C1NC=CCC2NC12,0.2076
CC1(OC2CC12O)C#C,0.265
CCC12CC3(O)CC1C23,0.311
OC1CC(OC1=N)C#N,0.2809
O=C1CN2C1COC2=O,0.2228
CC(C)C(=O)CCC#N,0.2314
Cc1c(cc(n1C)O)N,0.225
CC(C#N)C1(CN1)C=O,0.2227
C#CC12OC1CCC=C2,0.2308
CCc1c(c(c[nH]1)N)C,0.2242
CCC1OCC1C#CC,0.2896
CN1Cc2c(n[nH]n2)C1,0.2068
CC(CCCO)C1CC1,0.3426
O=C1OCC2(CO2)C1=O,0.1592
CNC1=NCC(=O)N1,0.236
C1CN1CCC(=O)CO,0.2152
CC(=NO)CO,0.2567
C#CCC1(CC1)C(=O)N,0.2696
C1CC(=O)CC(=O)NC1,0.2152
CC1CC=CC1(O)C#N,0.2527
C1CC23OC4CC2C1C34,0.3211
Cc1c(c(cn1C)O)N,0.2201
Cc1cnc(o1)C#C,0.1951
NC1=NC2CC2OC1=N,0.1907
OCC12CC3C1C2C3=O,0.2441
c1c2n(cn1)C=CC2,0.202
N#CC12CC1C1COC21,0.2731
N=C1OC(C#C)C1C#C,0.2715
CC(C#C)C(C)(O)C#C,0.2859
COC(C#C)C#CC,0.2705
CCC(O)C(=O)CC,0.239
OCC12CC3(O)CC1C23,0.3005
COCC1(C)CC1C#C,0.2902
ON=C1CCCC2NC12,0.2418
CC1CC2OCCC2O1,0.3254
Cn1nc(c(n1)O)N,0.2072
CC(=O)C1CCC1(C)C,0.2264
CC12CCC1OC(N)=N2,0.2769
C1C2CCC3OC3C1O2,0.3007
O=C1COC1C1CN1,0.2094
OC12C3NC1=CC(=O)C23,0.1505
CCC(=O)CCCOC,0.2356
OCC1(CO1)C1(O)CC1,0.3211
CC1(CNC(=O)C1=O)C,0.17
CNC1=CC(=O)C(O)C1,0.206
OC1C2C3CC3(O)C12,0.2969
O=C1NC2CC12C1CN1,0.2382
CC(O)C(=N)OC=O,0.2343
OC12CC3C1CC(=O)C23,0.2221
CCCCC1NCC1=O,0.2183
CCC1CC(C)(C1)OC,0.327
CC1(CO)OC(=O)C=C1,0.2239
CC12CC3C1N3CC2O,0.2939
COC1(CC1)CC2CC2,0.3121
CC12C3CN3C3C1OC23,0.3044
c1cnoc1COC=O,0.2389
CCC1(O)C2NC2C1O,0.301
CC1C=CC(=O)CC1=O,0.185
OCC(CC#N)NC=O,0.2802
CC(C)NC(=N)C=O,0.168
CC(O)C1=NC=NO1,0.262
CN1CCC11CCC1=O,0.1797
OC1CC(O)(C1)C=O,0.2242
CC12CCC1C(O)CO2,0.3054
FC(F)(F)CC1CO1,0.3637
O=C1CC2COCC2C1,0.2208
Cc1ccncc1C#C,0.2004
CCC1CC(C)C2OC12,0.3407
C1NC11CCCC11CN1,0.2943
CCC1(COCOC1)C,0.3297
CCOCC(C)(O)C#C,0.296
N=COC1CNC1C#N,0.2575
O=C(C#C)C(=O)C1CN1,0.1513
CCC1OC1C(=O)C#N,0.197
C1CC2COCC1C=C2,0.2553
ON=C1CCC2CC1O2,0.247
CC1COC11CN(C)C1,0.2914
N=C1OCC2C1C1CN21,0.2587
CC1(CC1)C2CC(=O)C2,0.2218
N#CC12CC(CO1)C=C2,0.2442
N#CC12CC3C4C(C14)N23,0.2503
OC1(C#C)C2C3OC2C13,0.2595
CC1COC(C)CO1,0.3208
CC1CCC(=O)C2CN12,0.212
CC12CC1C=CC1CC21,0.2443
CCC1C(CN1C)C#N,0.2585
CC12CCC(O1)C2=NO,0.259
CC12C3OC11C=CC2C31,0.2165
O=C1C2C3CC1C23,0.2444
OCC12C3CN=C1OC23,0.1595
OC1CC(O)C1N1CC1,0.3137
CC1OC2C1CCC2O,0.311
COC1CC(CO)C1=O,0.1984
CC(O)C1=CNC=C1N,0.2349
C1C2CC3C4C3N2C14,0.3047
CCCC1(CO1)C(N)=O,0.263
C[NH+]=C(N)C(CO)=N[O-],0.138
C1C(=O)COC=N1,0.2046
CC1CC1N(C)C(N)=O,0.2845
OCC1CCC2CC2O1,0.3269
CC#CC12OC1C1CC21,0.2397
CC(C)CC12CC1OC2,0.2978
CCC(C)C(=O)COC,0.2306
CC12CC(CO)(C1)CO2,0.2989
CC1OCC(CO)C1C,0.3107
CC#CC(O)(C=O)C#N,0.2157
C1C2N1C1C3C4CC23C14,0.3139
OC1C2C1C1CC2O1,0.3225
C#Cc1cc2n(c1)CC2,0.2158
C(C1CN1)N1C=NN=C1,0.2621
CN1C2C(C#N)C1C2=O,0.2474
c1c(c([nH]c1N)C=O)O,0.172
CC12C3CC1OC(=N)C23,0.2732
CCC(O)C(C)(C)C#C,0.314
OCC1CC2=CC=CN12,0.2503
CCC(O)C(=O)C(C)=O,0.1586
CC1C=CCNC1C#N,0.2487
O=C1OCC2C3CN2C13,0.2467
CC12CC1CC(=N)O2,0.2722
CC1(NCC=C1)C#N,0.2327
C#CCC#N,0.3022
N#CC1(CCC1)C1CO1,0.3104
C#CCn1ccoc1=O,0.2379
CC1(CC(=O)CN1C)C,0.2011
OC1CC2OC12C1CN1,0.3025
CC1NC11C2C3OC1C23,0.2943
CC1C2N3C(C2=O)C13C,0.233
CC1CC(C1)C#CC#N,0.239
OC1CC(OC=O)C=C1,0.2535
c1c(nc2n1CC2)C=O,0.2025
CC(=O)C1CC1(C)C#C,0.2194
N=C(OC=O)C#CC#C,0.1911
c1cnc(c(n1)N)O,0.1839
C1C2CC1C13CC(O1)C23,0.3107
CC1CC2(CC2)C11CO1,0.3237
CC12CCC1C1CCC21,0.3219
CC1C2C(C=O)N2C1=O,0.1915
O=C1C=C2CC3C2C13,0.1613
OCC12OCC1NC2=N,0.2541
N=COC1C2C3CC1C23,0.283
CC1=C(N)C2OC2C1=O,0.179
C#Cc1nc(co1)O,0.1805
CCCC(OC)C1CN1,0.3156
C1CCC(=O)NC=CC1,0.2214
CC(C)C12CC3C(C1)N23,0.3129
CC#CCCCC1CC1,0.3034
CC1CCC1C1CO1,0.3458
OCC1CC(O1)C#C,0.2698
CCCC1(CO1)C(C)C,0.3422
C1CNC(=O)CC(=O)N1,0.253
CC1NC1C1OC1C,0.319
Cc1[nH]cc(n1)C(C)C,0.2457
CC(COC=N)OC=O,0.2641
CC(=O)C(=O)CO,0.1612
CC1C=CC2C3OC3C12,0.2613
COCc1coc(=O)[nH]1,0.2421
C1C2CCC3CCC1C23,0.3454
CCC(=O)C1CN2CC12,0.2145
C#CCNC1CC1C#N,0.2619
CC#CC(=O)CC1CN1,0.194
CCc1ncc(o1)C#N,0.2079
CC1CC2(O)COC2=N1,0.2461
CN1C2COCC12,0.3133
CC(C)n1c(=O)[nH]nn1,0.2253
OCCC(O)C1CN1,0.3168
CC(C)(CCC=O)CO,0.2296
CN1C=C(CC1=O)C#C,0.1773
OCC1=CC(O)COC1,0.2485
CC1COCC1(C)C=O,0.2293
OC12CC3C1N3C2C#N,0.2568
O=C1OC2CCC(=O)C12,0.2154
O=CC1CCC11CN1,0.2142
N#CCC1CC2CN12,0.2783
CC(NC(=O)C#C)C=O,0.2124
c1c(nc([nH]1)CCO)O,0.2261
C#CC#CC(=O)CCO,0.1848
N#CC1C2C3CCN1C23,0.252
CNC(CC=O)C#N,0.1988
Cc1cnc(=O)ncn1,0.1544
OC1CCCCC2OC12,0.3131
CC12NC1C1CCC21O,0.292
CCN=COC(C)CC,0.2734
NC(=O)C(CO)C=O,0.2101
O=C1CNC(C=C1)C#C,0.1637
C1OC23C1C1C2C=CC31,0.223
O=C1NC2C1C21CCC1,0.2495
C1C=CC=CC(=O)CO1,0.1701
NC=[NH+]CCC([O-])=O,0.2378
C1CC23CCC4C(C24)C13,0.3387
CC1C2C3CC1(O)C23O,0.2888
C1C2C=CC3(CCC3)C12,0.2419
ON=C1COC1C1CC1,0.2447
C1C(=O)CN=C(N1)C#N,0.2036
COC(=O)C1CC(=N)O1,0.2539
O=CC12CCC3CC1N23,0.22
CNc1cc(n[nH]1)N,0.2343
CN=CN(C=O)C=O,0.2138
CC1C2(C)OC1(C)C2=O,0.241
CC1=COC=C1C1CO1,0.2377
C1CC2N=COC2O1,0.2758
NC(=O)C12CC1OC2=N,0.255
CC(O)CC(O)C(C)O,0.296
c1c(n[nH]n1)O,0.2377
C#CC1=CCCC2OC12,0.2025
C1C(=O)CC1(CO)C=O,0.2148
CCC(=O)c1ncco1,0.1948
CC1NC11C2C3CN2C13,0.3042
OC1=C2C3CC3N2N=C1,0.2087
c1c(c([nH]n1)C#N)C#N,0.2065
CC(=O)n1cc(nn1)O,0.1815
CC1CCCCC1C#C,0.3112
CC12CC=CC1(O2)C#C,0.234
C1CN1c2noc(=O)o2,0.2582
OC1(CC2OC2C1)C#C,0.2917
CC(C)(CCO)C1CC1,0.3392
N=C(C#N)N1CC=CC1,0.2052
CCCCC(C)CC#N,0.3458
CC(=O)NC(CO)C=O,0.2177
C(=O)Oc1c(non1)N,0.2079
CC1(CO1)C(=O)CO,0.2271
Cn1c(=O)ccoc1=O,0.2256
C1C2OC3C4OC13C4O2,0.2056
CC1(C)NC(=O)C1C=O,0.2215
c1c(=O)[nH]nc(n1)O,0.1532
O=C1CC23CCC12OC3,0.197
CC1OC(CO)CC1O,0.2991
N=C1CC(=O)CCO1,0.2247
CC(O)C(O)(C#N)C#N,0.2719
N=C1C=NNC=C1C#N,0.1643
CC1(CC(C1)NC=O)C,0.2797
CC1(O)CC1CNC=O,0.2797
OCC1C2C3N2CC=C13,0.1674
c1cn2c(c1N)C=CC2,0.1619
ON=C1C2COC1OC2,0.2476
OC1CC2(OC12)C#N,0.2661
CC12CCC1OC21CC1,0.2988
CC12OC3CC=CC1C23,0.2366
CC(O)C1CN2CC12C,0.2928
c1c[nH]nc1OCC=O,0.2022
N=C1C=CON=NC1=O,0.1394
CC1(CC2CO2)CO1,0.3418
N=COC1CC1C1CO1,0.2769
C(CC=O)CC#CCO,0.2253
C#CC12C=CC3C1CN23,0.2054
CC1N(C=O)C11COC1,0.253
OCC1(NCC1O)C#C,0.2648
C[NH2+]CC(CO)=N[O-],0.1562
NC(=O)C12CC3C1N3C2,0.2514
CCC1(C)C2CC1(C)C2,0.3581
CN1C=CC2CN2C1=O,0.2041
CC1C2C=C(C)C1C2O,0.2381
O=C1NC2C3CC3CC12,0.2721
CC1COC(=O)C=C1C,0.2179
C1OC2=NCCCCC12,0.2701
CC(C)(C)c1nc[nH]n1,0.269
COCC1C(C)C1O,0.3139
Cc1cnnn1C,0.2526
C#Cc1ccoc1C#C,0.1771
CCC(OC)(C=O)C#C,0.2045
c1c(c(n[nH]1)CO)C#N,0.2404
CC12CC(NC=N1)C2=O,0.1965
CC(CC=O)C(C)=O,0.2258
CC1OCCC11CC1O,0.3072
CC1CCC1CO,0.3387
C#CC1COC(C1)C#N,0.2914
CC1C=CCC2(O)CC12,0.2636
CC(O)(CO)C1CCO1,0.3176
CNC(=O)C1C(C)N1C,0.2361
CCC1(CC1[NH3+])C([O-])=O,0.1398
O=CC1CCOC2CC12,0.221
C1C2CC3CC2C1CO3,0.3129
CC#Cc1ccc([nH]1)O,0.1918
CCC1=NC2CC2CO1,0.2507
CC12CN3CC3C1CO2,0.3029
CC1(CC1)C(=O)NC=O,0.2179
CC1(O)C2CCC1C=C2,0.2563
C1C=CCC12CC(=O)C2,0.2199
c1cn(nn1)C(=O)C=O,0.165
CC1N2CC1(N)C2C#N,0.2561
CNc1[nH]cc(n1)C#C,0.2029
C1CC11COCC11CO1,0.3249
CN=C1OC=CN=C1,0.1607
CC(CCC(N)=O)C#C,0.2766
CC1(CO)CCC1C#C,0.2987
CC1(O)CCC(O)CC1,0.3009
c1c(c([nH]n1)NC=O)N,0.2072
C#CC12C3CC1=CCN23,0.1663
Cn1cnc(=O)nc1,0.1998
O=C1CCOCC2CC12,0.2238
C1C(CO1)COCC=O,0.2197
c1c-2ncnc2[nH]cn1,0.1797
COC1=NC2CC(C2)N1,0.2623
CC12CC1(OCO2)C#C,0.2533
COC1=NC(=N)NN=N1,0.1684
CC12C3OC4C(CC14)C23,0.3297
CCNC(=O)CC1CN1,0.2727
CC12CN1CC(=O)C=C2,0.1631
O=C1C(NC1C#N)C#N,0.2143
NC1=[NH+][C-](C#N)C(=O)C1,0.1313
CCOC(COC)C#N,0.2831
CC(OC1CC1C)C#C,0.2781
CC1CC2(CO)COC12,0.299
c1c(c(c(nn1)N)O)F,0.1994
CC12CC(CO1)C2O,0.3011
OC1(C#N)C2C3OC3C12,0.2706
CC1N2C3CC3(O)C12C,0.2945
O=C1NCC=C2CCC12,0.2377
CC(O)(CC=O)C(N)=O,0.2031
CNC(COC=O)C#N,0.2473
C1C2OC3CC4C3N4C12,0.2871
CC(C)(C(=O)C(=O)N)O,0.166
CC12CN1CC2(O)C#N,0.2564
N#CC1OC2COCC12,0.2612
C1C2C=CC3C4OC23C14,0.1617
CC1OCC1(CO)C#N,0.2809
Cc1c([nH]c(=O)cn1)F,0.1672
CC#CC1OC2C(C)C12,0.2574
CC1C(O)C1C(C)(C)C,0.3069
CC12C=CCC11CC2O1,0.2431
CNc1cc(no1)N,0.2337
N=COC(CC#C)C#C,0.282
CC(C=O)C1(CN1)C#N,0.2105
Cc1c([nH]c(c1O)C)C,0.2221
CC1CC=CC1C1CO1,0.2639
OC12CC3C(C13)C2C#C,0.2787
OCC12CC(C=O)C1O2,0.216
N#CCC1CC2COC12,0.2976
OCC12OC1C1CC2C1,0.3085
CCC12CC1CC2=O,0.2311
C1CN1C12CC3CC1C23,0.3106
CC1OC23CC4C2OC134,0.2606
c1c[nH]c2c1[nH]nc2,0.2143
CC1CCC(=O)C1C,0.219
CC(C)COC1CC1C,0.3265
CC12C3OC(C13)C2O,0.3094
CCOC(CO)C#CC,0.2857
OC12CN3C=NC1C23,0.2147
OC1C2OC=NC1C2O,0.2447
OC1CC1C1CC1O,0.3222
CCC1C2CC(=O)CC12,0.2239
CNC(=O)CC(C)C#N,0.2785
OC1C2COC(=N)C12O,0.2449
CC1COC(=N)C1C#N,0.2739
OCC1CCC(=O)CN1,0.2019
N=C1OC=C(C=O)C=C1,0.1663
CC1OCC11CC(=O)C1,0.2185
O=C1CC2NCC2O1,0.2573
CC(C)(CC1CN1)C#N,0.2939
CC12CC1C(=O)NC=N2,0.2245
COC12CC1C1CC2O1,0.3265
NC1(CNC1=N)C#N,0.2519
CC1C2CC(=N)OC12C,0.271
CNC(C=O)C(=O)NC,0.2006
CC1(CCC1=O)C1CO1,0.2154
OC1C2C1N1CC=CC21,0.2227
CC1=C(F)C(=N)NN=N1,0.1704
CC1CN2N=CC=C2N1,0.2385
CC1CCC(O)C1(C)O,0.3083
CC1=CC=CCCC=C1,0.1823
CC1(O)C2CC2C1=O,0.22
CC1(C)OCC1CC#N,0.2853
OCC1CC(O)C2OC12,0.323
CCC(NC(C)=O)C=O,0.2125
CC1C2NC1(C#N)C2C,0.2661
CNc1cc(on1)OC,0.2368
CCCC1CC1(C)CO,0.3339
CC1CCC2(COC2)O1,0.3095
c1c(oc(=O)c(n1)O)N,0.152
O=C1CC23COC2C1C3,0.2214
Cc1c(nccn1)C=O,0.1694
OCCOC1CC=CC1,0.2683
COC(=O)C1(CO1)C=O,0.2166
CC(C)OC1CC=CC1,0.2678
CC1(CO)OC1C1CC1,0.3356
CC1CCCC1C#N,0.3395
OCC1CC2CC12CO,0.2927
NC(=N)C(=O)COC=N,0.1724
CC1(CC(=O)C12CC2)C,0.2179
CC1C2CC(=O)C12O,0.2221
O=C1C2OC2C1N1CC1,0.2062
CC(C)CC1(C)OC1C,0.3373
COC(=N)CC(=O)CO,0.2254
C1OC11CC2OC3C2C13,0.314
CC(=O)C1CC1CCO,0.23
C(CC(C#N)C#N)CO,0.2733
O=CC12CC1OCCO2,0.2216
CC12N=COC1C2O,0.2491
C1CC2OC1C=C2,0.2568
CCc1cc(oc1N)O,0.2268
CC(C)C(C=O)C=O,0.1958
CC1CC2(O)C(O)C2O1,0.3008
CC(C#C)C1CC=CC1,0.2644
OCC12C3N1CC2C3=O,0.2273
CC1OC11CCOC1C,0.3203
CN=C(N)N(C)C=O,0.2307
C1CNCC(=O)C1=NO,0.1714
OCC1=CC(=N)C=NO1,0.1836
CCC1CC1CCCO,0.3417
CC1CC(CCCO)O1,0.3224
C1Cn2c1nc(n2)N,0.2271
CC(=O)C1(CC#C)CO1,0.2226
CC1C(C)C1CO,0.3286
CC1NC(C#N)C1CO,0.2642
CC1=CC2(C)CC3C1C23,0.2376
CC1CC2(C)C1CC2=O,0.219
CC1CC(OC1=O)C#N,0.2769
N=C1NC=CN=CC1=O,0.1334
OC(CC1CC1)C#N,0.3004
c1coc(c1N)CCO,0.2144
CC1N2CCCC12C#N,0.2688
C1OC1C1=CCCOC1,0.2463
C(COCCO)O,0.3369
CC(O)CN1C=NN=C1,0.2671
CC1(CC1O)C#CC#C,0.2181
CC12CC(O)(C1)C2C=O,0.2187
c1cn[nH]c1C#CC#N,0.1823
CC1N=C2OC3C2C13C,0.1623
c1c([nH]c(=O)nc1F)N,0.2007
N#CC1COC1C1CC1,0.2858
OC(CC(O)C#C)C#C,0.2687
CC(C#N)C1=CC=CO1,0.2329
CC(OC=O)C1(O)CC1,0.2775
NC(=O)C(O)CCC#C,0.2683
COC(CCC=O)C#C,0.2289
CN1C2C(O)CC12C#C,0.2662
C#Cc1[nH]c(c(n1)N)N,0.1809
CC1NC1(CC#N)C#C,0.2736
CCNc1[nH]c(=O)on1,0.2599
C1COC(=O)C12COC2,0.2578
NC12CNC1COC2=O,0.2519
CC#CC(C)CCC#N,0.2838
O=C1NC=C2C=CCC12,0.1724
CC1(O)C2NC2C2NC12,0.2884
C(CC=O)COCC=O,0.2244
CN1CC(C1)OC(=O)N,0.2691
N=COCC(C=O)C#C,0.2245
c1nc(no1)O,0.2469
OCC1=NC(CO1)C#C,0.2744
C1CC1(CC(=O)N)CO,0.2582
CC1C2C3C=CC2(O)C13,0.2256
CC1=CCC(CC1)(C)C,0.2618
CN1C=NC(=N1)C1CN1,0.234
CC1CN2C1C2C(C)=O,0.2116
OC(CC1CN1)C#N,0.2633
CC1C2OC3CC3OC12,0.3153
C1CNC(=CC1=O)C=O,0.1428
CCc1cnoc1CC,0.2375
CC1CNC(=O)C=CC1,0.2128
CC12CCOCC1C2O,0.3038
c1c2c(c([nH]1)N)CCO2,0.2228
ON=C1C2NC1C2O,0.257
CC1OC1(C)C(O)C#C,0.2974
COCC(C)(O)C(C)C,0.3319
COCC(C)OC=O,0.2786
c1c(c(oc(=O)n1)O)N,0.1607
OC(C#C)C12CN1CC2,0.2772
C1OC2C=CCCC2=C1,0.2456
CC1(CO1)C1=CN=CN1,0.2419
CC12CCCC1OC=N2,0.2725
C#CC1=C(CNC1=O)N,0.19
CCC1COCC(=N)O1,0.2724
CCC(=O)C1CC(C)O1,0.2189
N#CCC1C2CC1C2,0.3475
COC12CC(C1)C=CC2,0.2544
CC1(C)C2CC1C2(C)O,0.3336
CC1(C)C(C#C)N1C=O,0.251
C[NH+]=C(N)NCC([O-])=O,0.2603
CC1C2C1C1(CN21)C#C,0.2359
O=CC12CC3(CN3)C1O2,0.2113
COC1C(=N)OC11CC1,0.2684
CC1CC(O)C=CC1=O,0.188
OC1CC2CC1C=C2,0.2458
CC1=CC(OC=N)=NO1,0.2386
OC1CC2C3NC3C=C12,0.2342
CC1CC2OCC1CO2,0.3188
COC=NC(C=O)C#N,0.2189
OCC1OC1C1CC1,0.3399
C(COCC#N)C#N,0.2988
CC(=NO)CC(C)(C)O,0.2533
CC1(C#C)C2C3CC1C23,0.3041
CC(O)CC(N)C#N,0.2766
c1c2c(no1)CCO2,0.2167
CC1CC(=O)C11CO1,0.2046
C#CC1OCC1C1CO1,0.2732
O=C1C=CC2CCC12,0.1888
C1C=CC2C3C4C1C2N34,0.2528
CC1C(CC1(C)C)=NO,0.2512
CC12C3CC(C13)C2CO,0.3032
CCC(=O)NCCC#N,0.2747
CN=c1c(=O)[nH]cco1,0.1805
NCC1(COC=N1)C#N,0.2367
[O-]C(=O)C1NC11C[NH2+]C1,0.2519
c1c(ncnn1)OC=O,0.1698
COCC1OCC11CC1,0.3074
CC1C2CC3N2C13CO,0.3121
CC(C)Oc1ccn[nH]1,0.2584
OCC1CC2(CC12)C#N,0.2873
CC12C(O)C1(O)C1CN21,0.2811
COC(=O)C(C)(O)C#N,0.257
CCC12CN3C(CC1)C23,0.2978
CC1CC(COC=N)O1,0.2782
CCC1(CCC#N)CO1,0.3153
CC12CC1C1=CC=NN21,0.2345
CC12CC1(N=CO2)C#N,0.2603
CN1C2C1C1(C)CC2O1,0.3014
CC1=CC2(NC2C1)C#N,0.2368
CC1COCC(N1)C#N,0.2615
CC12C3C(O)C1N=CN23,0.2296
O=C1CC2CC3CCC123,0.2126
CCC12CN1C(C)C2=O,0.2167
C#CCCOC(=O)CN,0.2594
CC1C(C)C(O)C1O,0.2951
CNC(=O)C1(C)NC1C,0.268
C1OC11COC2CC2C1,0.3076
CCC(O)C(O)C(C)=O,0.2315
OCCC(C#C)C1CN1,0.2825
CC(C)(C)CC1CCO1,0.315
CC1CC11OC2CC1C2,0.3077
C1C=Cc2c(nn[nH]2)N1,0.156
CC#CC#CCCOC,0.2263
OC12CC1OC(=O)C2=O,0.1718
CC1CN1C1(C)CC1O,0.3012
CCC12CCOC1C2O,0.3119
N=C1C2OCC22CCN12,0.2295
CC(OC=N)C#CC#N,0.2254
OC1(C#N)C2OC=NC12,0.2501
CC#CCC1=CCCC1,0.2581
OC1C2COC2C1C#N,0.2808
OC12C3C=C4CC1C4C23,0.1702
NC1=C(N)OC(=N)N1,0.2294
OCC12CN1CC2,0.2996
CCC(C)(O)C#C,0.3012
COC1C=C(C)C2OC12,0.2394
OC1CC2C3CC3C=C12,0.2334
OC1CCOCCC=C1,0.2477
CC1COCC(O)C1O,0.2978
COCCOC(=N)C=O,0.1892
CC1CC(O)C2NC12C,0.3019
O=CC12CN(C1)C2C#N,0.1928
CCCCC(CC)CO,0.3392
CC1CCC2CC12C#C,0.2878
CC12OC3C1C2C31CO1,0.3128
CCC1C2CC(C)=CC12,0.2415
CCC12OC1C(C)C2O,0.3189
O=CC1(CO1)C(=O)C#N,0.1804
NC1=CC(=N)C(N)=NN1,0.1761
O=C(NCC#C)C1CO1,0.2611
CC#CC1CCCCO1,0.2846
[NH3+]CCC1=NON=C1[O-],0.2233
CC1C(C#C)C1N1CC1,0.2546
O=CCC1C2CC2C1=O,0.2219
C1CC23COC4C2C1C34,0.329
COC12CC(C1)C2CO,0.3355
CC12COC1C(O2)C#C,0.27
CCC1(C#N)C2COC12,0.2768
O=CC1C2NC1C2C#N,0.2106
N=C1NN=NN1CC#C,0.2008
CC(O)CCC1COC1,0.3083
OC1C2CC1C(=O)O2,0.2717
CCCC12CN1C(=O)C2,0.2373
CC1CC2(C1)OCC2C,0.3065
COCC12CC1C(=O)O2,0.2756
CC(C)(C)C1COCO1,0.3225
CC(C)C(CC=O)C#C,0.224
N=C1CCOC(O1)C#C,0.2779
c1c(nc(nc1F)O)N,0.2296
OC12CCOC1=NCC2,0.2616
O=CC1CN2C(C#N)C12,0.2188
CC1C2C3OC1C=CC23,0.238
CC1N(C)C11CC2OC12,0.3038
CCn1cc(nc1O)N,0.2304
CN1CC1C1=CNN=C1,0.2362
OCCC(C#N)C1CC1,0.3067
CN1C=CCOCC1=O,0.2125
CC(C)C1=CC(C)OC1,0.2485
C1CC2OCCC=C2C1,0.2531
COCC(C)CC1CC1,0.3392
CC(CO)COC(C)=O,0.285
O=C(C#N)C1COCO1,0.1876
CC(O)(C#C)C(N)C#N,0.2717
CC1COC(O1)C(N)=N,0.2647
CC(C)C(C)(C)C=O,0.2279
N#CC1NCC=C1,0.236
CC(C)N(C=O)C(=O)N,0.2536
CNc1[nH]cc(n1)OC,0.2261
CC(=O)C(=O)N(C)C=N,0.1762
OC1CN2C3C2C(=O)C13,0.2185
OC12CC1(C=O)C1NC21,0.2149
C1CC2CCCCC2=C1,0.252
C#CC12OC1CC21CO1,0.2611
c1c[nH]c2c1CCCC2,0.2392
CNc1ccccn1,0.1924
C1OC2C3NC3CC=C12,0.2513
C1C(=O)C(=O)CC12CO2,0.1434
CCOC1=NNC(=N)N1,0.2435
COC(C)C(C)C1CC1,0.3347
CC(C#C)C1(CC1)C=O,0.2226
Cc1c(c(no1)NC)N,0.2323
CC1CC23CC(C2)C13,0.3075
C1CN(CC1=O)CC=O,0.1889
CC1CC2=CC3OC3C12,0.2375
CN1CC=CC=CC1=O,0.1791
CC1(C)C2OC=NC12,0.251
OC1CC2OC1C21CN1,0.3102
NCC(NC=O)C#N,0.2658
CC1OC2C3C1CC23C,0.312
NC(=O)COC1CC1O,0.2252
CC1OC(=N)CCC1O,0.2765
C(C#N)NC(=N)C=O,0.18
COC1C(O)C1(C)C#C,0.2664
COC(=N)N1N=CC=N1,0.224
CCC(CCC#N)OC,0.3073
CC(O)C12CCC1OC2,0.2974
CC1C2C3(C)CC3C12O,0.2824
C(C1CO1)C1CCOC1,0.3232
CN=C(C=O)NC=N,0.1544
CCc1cnc(cn1)F,0.206
CC1(CC2(O)CC12)C#C,0.3028
CCC(CC)CC#C,0.3144
N=C1OC(=O)C2CC1N2,0.2372
c1c(nc(o1)C(=O)N)O,0.1864
CCCC1(C)CC(O)C1,0.3278
Cc1c(nno1)O,0.2023
CC#CC(=NO)C1CC1,0.2027
CC1(O)CCC=CC1O,0.2568
OCC(CNC=[NH2+])=N[O-],0.2235
OC12CC1CC(C2)C=O,0.2271
FC1=CC(=N)C(F)=CN1,0.1893
CC(=O)C1=NCC2CN12,0.1831
O=C1OC23CC(C=C2)C13,0.2228
COC1CC(OC)C1C,0.3165
CCOC(C)C#CC#C,0.2243
C(CC1CO1)CN1CC1,0.3232
OC1CCC2C(C=O)C12,0.2259
CC1CC2CCC(C2)O1,0.3141
C1C2COCCCOC12,0.3074
CCC1OC(C)=NC1C,0.269
OC12CC3(CC1C23)C#C,0.2862
CN=COC1CC(C)C1,0.272
O=C1OCC2CC2C=C1,0.2105
c1c(coc1N)O,0.2232
NC1=[NH+]CCC1C([O-])=O,0.2639
c1c(=O)cc(oc1N)F,0.2108
OCCC(O)C1CO1,0.3413
OC1(C#N)C2CCOC12,0.2731
CC1CC2OCCC12O,0.306
O=CCC1CC(C1)C#C,0.2261
OC1=CC(=N)C=C(O)O1,0.2078
OC1C2C3C1C2C3=O,0.2517
CC1CCC2OC1C2O,0.3241
CNC(=O)C(C)O,0.277
c1coc(c1C=O)N,0.1828
CN(C)C(C=O)C#C,0.2026
OC12CC(C1)CC(=O)C2,0.2208
C1CC1C1OC2CC1C2,0.3294
Cc1c[nH]cc(c1=O)F,0.1965
CC#CC12CC(N1)C2=O,0.2344
Cc1c(c(=O)ocn1)O,0.1792
CC(=O)COC(=O)C=O,0.1811
CCN1C2CC(O)CC12,0.2843
OCC1CC1(C=O)C#N,0.2216
CCCC(O)C(=N)OC,0.2742
CC1C2C(C)C1C2C#N,0.3291
C1C2NC2C2=C1C=NN2,0.2413
Cn1ccnc1C2CC2,0.2357
OCCCOC(=N)C=O,0.1941
CC1C2C3CN2C13C#N,0.2543
CC1C=CC2C(C=O)N12,0.2077
OCC(O)C(O)C1CO1,0.3224
CCC1(C)CC2CC2C1,0.337
N=C1ON=CN=CC1=N,0.1691
CC1CC2(CC2)NC1=O,0.2668
CNc1n[nH]nn1,0.2066
OCCC(O)(C=O)C#N,0.2192
CCC(C)(C#N)C1CC1,0.3385
COCC1CC(O1)C#N,0.2706
O=C1NCCCC11CO1,0.2526
CCCC1(C)NC1C#C,0.2786
CCCOC1(CC1)C,0.3327
CC12CC(C)(C#N)C1O2,0.2962
O=CC12CC1C=CCC2,0.2168
CC1CC(O)C=CC1C,0.258
CC1(C)C(O)C1(N)C#N,0.269
C1COCC(=C1)C=O,0.1936
CN(C)C1C(O)CC1=O,0.2064
CN(C)c1ccon1,0.2162
CCCC1CC2(C1)CC2,0.3473
OC1CC(O)C1(O)C=O,0.2109
CC1=CCCC(=O)NC1,0.2513
CC1C2C1C1(C)CC2C1,0.3409
Cc1c(cnnc1O)O,0.1994
CCC12CN3C1C2C3=O,0.2435
OCC12CC1NC2=O,0.2529
CC(=O)Cc1[nH]ncn1,0.2162
CC1CC(C)C=CCO1,0.2612
OC12CC3C1CC23O,0.2947
CC12CC(O)C=C1CO2,0.237
CC12NC1(C)C(O)C=C2,0.2206
CN1CC2COC2C1=O,0.2458
OC1CC2OC2C1C#C,0.3043
CC(C)(C)C1NC1CO,0.3133
OC1CCCC(=O)C=C1,0.1875
CN1C(=O)OC=NC1=N,0.2146
CCC(=O)N(C)C(=O)N,0.2569
C(C#N)N=c1onno1,0.2152
OC1CC2(COC12)C=O,0.2182
CC1C2COC2CC1=O,0.2196
CC1C2NC2C11CC1,0.3066
C1CC2(O1)C1OCOC21,0.2749
CC1(CC2CC12)C(N)=O,0.2727
C1C2C3NC3C=CCN12,0.2232
c1c(nn(c1N)C=O)N,0.1869
NC1=CN=CC(=N)N=C1,0.1481
CCC1OCC11CC1O,0.3094
CC1C=CCCC1=NO,0.2525
c1c2c(coc2on1)N,0.2043
CC1CC2CCCC2O1,0.3092
O=C1OC2CC12,0.2794
CC1C2C3CC1N23,0.3212
OCC1C2CC(C2)C1=O,0.225
CCCN=C1OCC1C,0.277
OCCC1C2C(O)CN12,0.2896
CN=C1CNC(=O)N1,0.248
c1cn[nH]c1C(=O)C#N,0.1767
CC1C2C3OC3CCN12,0.2852
O=CC1C2NC2C2CN12,0.2115
O=C1CN2CC12C1CO1,0.2221
CN1C2C1C1OC2C1O,0.3085
CC1C2NC2(C=O)C1O,0.21
O=CN1C2CC3OC2C13,0.2544
CC12CC1OC2,0.3098
CN=C1OC(C#C)C1N,0.254
COC(CC#C)C#N,0.2841
CC(CO)C1=CN=CO1,0.2427
OC1CCCCC11CC1,0.3252
CCC12CC1NC(=O)C2,0.2645
COCC1OC1CC#N,0.2953
ON=C1CC2C(C#N)C12,0.2412
Cc1conc1NC=N,0.223
CC1OC2CCCC=C12,0.2537
CC1(C#N)C2CC(=O)N12,0.2298
C1CC1N1C2C3OC3C12,0.2644
CCCC12CC(C1)CC2,0.3654
CCC(C#C)C(=O)CC,0.2262
c1cnc(nc1N)F,0.2182
CC1OCC1(O)C#C,0.2734
OC1CC11C2CC1CC2,0.305
CCC1(C)C(C)C1C=O,0.2239
CC12N=CN3C(C13)C2=O,0.1958
O=C1CC2CCC2C1=O,0.1402
O=C1CC=CC2CC12,0.2158
CC12CCC(C)(O)C1O2,0.3207
OC1C2OC3C2CC13O,0.2959
COCC1CC1C(C)=O,0.2269
Cc1c(noc1NC)O,0.2292
CN=c1ccncn1C,0.1704
OCC12CC3C(C1)N23,0.2976
N=C1COC(=O)CN1,0.2428
C#CC12CC3NC1C3O2,0.2487
CC1NC1CC(=O)C=O,0.1509
C1OC1C#CC1COC1,0.2675
CC1C(O)C2=CN=CN12,0.2502
OC1CC(C1)C=O,0.228
CC1NC1C(C)(C)O,0.3119
O=C1CC2(CN3CC23)N1,0.2709
C1COc2n1c(=O)[nH]n2,0.262
CCNC(=O)CO,0.2715
CC1(O)C2NC1C1OC21,0.2993
CCCC1(CO1)C(C)O,0.3439
CC1C=CC2(NC12)C#C,0.2303
CC1CC2(CC1O2)C#C,0.2694
OC1C2OC2CC1=O,0.2275
CCc1c(c(c[nH]1)C)O,0.2293
OC1CC=CC(=O)C1=O,0.1457
CNC1CNC1C#N,0.2464
CC1=C(C(CC1)(C)C)C,0.2537
O=C1C2C3CC1CCC23,0.2245
CCOCC(C)(C)O,0.333
CC(C1CO1)C1CCO1,0.3214
CN(C=O)C(=N)C#N,0.1969
OCC1NCC(=O)C1=O,0.1419
Cc1nc(no1)N(C)C,0.2114
C1CC2(CC3CC2O3)O1,0.3074
Cc1ccc([nH]1)COC,0.2307
CC1(C)CC(C#C)C1O,0.2859
C1C2C1C1OC2CCO1,0.322
CC1NC(C)(C=C1)C#N,0.2327
CC1C=CC=CCC1O,0.1941
CC1C2C3C4N2C4(C)C13,0.3055
CC(C)(C)C1=CCOC1,0.2492
CC(O)C(C)(C)C(C)O,0.3157
COC1CC(O)(C1)C=O,0.2208
OC1CCCCOC1=O,0.2504
C(C1CN=CO1)N1CC1,0.2628
c1c(oc(n1)N)C(=N)N,0.1912
c1(nnon1)O,0.2227
N=C1NC(=O)N2CCC12,0.2508
CCC1(O)CC2C(C)C12,0.316
COCCN=C(C=O)N,0.178
OC(CNC=O)C#C,0.267
Cn1c(ccc1O)C#C,0.1921
COCC1NC1C=O,0.2229
C1C2C3CC4CCC13C24,0.3572
OC1C2C3C4C(N23)C14O,0.2904
OCCC12C3C4C1N4C23,0.2773
Cn1cc2c(n1)OCC2,0.2264
CC12CCC1OC(=N)O2,0.3088
CC(C(N)=O)C(=O)C#N,0.1776
Cc1c(cccn1)OC,0.2103
c1(c(nn[nH]c1=O)N)F,0.1697
OC12CC3OC1C3C=C2,0.2383
COc1c[nH]cc1C#N,0.2158
CN=COC(=O)C(C)O,0.2427
NC(=O)C1C2CC1OC2,0.261
CCC1=C(C)OC(=N)N1,0.2196
CN1C2C1C(C)=CC2O,0.2353
CC(O)C#CCCC=O,0.2213
O=CC1OC11CNC1=O,0.2105
OC1(CCOC1=N)C=O,0.2239
CCC1(CCC1C)C=O,0.2231
CC12OC1C1NC1C2=O,0.1911
c1c(nc([nH]1)O)CO,0.2548
N=C1OC2CC3CCC123,0.2743
CCC1(CO)C2CC1O2,0.3042
CC1CC1N(C)C=O,0.2646
C1=C2C3C4C5C1C5C2C34,0.1725
CN(CC1CN1)C=O,0.2733
OC1CCC2C3OC3C12,0.3192
C#Cc1c(non1)C#C,0.203
CCOC12CC1C(C)C2,0.3309
CC(=O)C1(C)CC2CN12,0.2195
CCC1=CC(=O)OC1=N,0.1963
CC(C)(COC=O)C#N,0.2864
CC12CC(O)(CO1)C=C2,0.2463
CC1(C)CC(CCO)O1,0.3215
c1nc2[nH]ncn2n1,0.2329
C#CC12NC3CC1OC23,0.2563
[O-]C(=O)COC1C[NH2+]C1,0.271
CCC(=O)C(C)C#N,0.2327
CC1(C)CC1(C)C(N)=O,0.2686
COCC1COC1C,0.3259
CC(=O)c1cc(n[nH]1)O,0.1801
COC12CC1(C)C=CC2,0.2471
C#CC(CO)C#C,0.2872
C1CC1OCC#CC=O,0.2018
N#CC1CC11CC=CC1,0.2665
C1=CC2C3C4C3C2C14,0.2479
CC12COC1(C#N)C2N,0.2225
CC1COC2CC1C2,0.3185
Cc1cc[nH]c1CC=O,0.1766
FC1=NNC(=O)C(=N)N1,0.1924
OC12CCC3C(OC1)C23,0.2977
CC1CN=C(N)N1C=O,0.2115
OC12CC1C=CC2,0.2474
CC12CC1C1CC(O)C21,0.2914
CNc1cn(c(=O)o1)C,0.228
CC1OC2C=CCOC12,0.251
C1C(CO1)OC=O,0.2637
c1c2c([nH]n1)CN=CN2,0.2107
CC1CC1C1(CN1)C=O,0.2181
CCC1CC2(CCO2)C1,0.3142
NC1=NC=C(OC=N)O1,0.2208
CC1C=CC(C)(C)C1=O,0.2192
CCC12CN(C)C1CO2,0.2792
N=C(C=O)N1C2CCC12,0.1733
CCC(OC=O)C(C)O,0.2758
CC1C=C(C)N(C)C1=O,0.2087
C1CC1C12CC1CC=C2,0.2419
O=C1CNC2C3NC3C12,0.1951
CN1C2CC2C1C=O,0.1845
O=CC1=CCC2NC2C1,0.1993
COC(=O)CCCC#C,0.2755
OCC12CC(O)(C1)C2=O,0.2434
CC1C2C3C1N2C3(C)C,0.3039
CC12CC(C1)CCC=C2,0.253
C1C2CC3COC=NC123,0.2396
N=C1OC=COC1=N,0.1881
CC1(CO1)C12CN1CC2,0.3075
CC1(C)C=CCCC1O,0.2682
Cc1c(ncnc1F)C,0.2268
C[NH+]1CC=CC1C([O-])=O,0.2294
CC1(CCOCC=C1)C,0.2636
NC(=O)OCC1CN1,0.3059
CCC12CC(O)C1C2C,0.3155
C[NH+]=C(N)C([O-])=O,0.1972
c1c(c(on1)N)CO,0.2223
COC(C)C(O)C1CN1,0.3126
CC12CC3C4N1C2C34O,0.292
CC12NC1C(=O)NC2=N,0.2281
CC(=N)NC(=O)COC,0.2365
OC1CC2CC(O)C12,0.2961
C1OC2C3NC12C=C3,0.2139
CC1CC=CC2NC12C,0.2392
CC(=O)C12CC3C(C1)N23,0.2216
CCC12COC(=O)C1N2,0.2608
CCOCCC(=O)C,0.2347
CC1C2C(C#C)N2C1C,0.2557
CC(O)C12CC(O)C1O2,0.3144
CCNC(C)(C=O)C=O,0.1744
CCOC(=O)NC(C)C,0.311
C1CN1C1C2CC1CC2,0.3255
CCC12CC(O1)C(O)C2,0.3179
CCC12CN3C1C=CC23,0.2063
CC(=O)C1(CCC1)OC,0.2149
CC(C#C)C1=NON=C1,0.2349
CN(C)c1c[nH]cc1O,0.232
NC(=O)C1COC(=O)O1,0.2713
COC1=CNC=NC1=N,0.1927
CC1C(O)C(O)C1(C)C,0.2936
CC1C=CC2OC2C1=O,0.2071
CC(C1CC1)C(C)(C)O,0.3302
CCC12OC1C(C)C2=O,0.2117
CC1CC(CCO)C1C,0.3402
COC1CCCOC1=N,0.2749
CC1OC(=N)C1(O)C=O,0.214
NC(=O)C12CCN1CC2,0.2598
CCC1C(C)C1O,0.3056
O=C1C=CC2OCC1O2,0.176
OC(C1CO1)C1CO1,0.3366
OC1CC23NCC2OC13,0.2652
C1C2CN1C1=CNN=C21,0.25
Cc1cc(n[nH]1)COC,0.2566
O=CC12OC3CCC1C23,0.2047
CC1C(C#C)C(C)C1=O,0.219
CC12CC(CO)C1(C)O2,0.3099
N=C1C=CNN=CC1=N,0.1634
OC(CCC=O)CC#C,0.2292
COCC(O)C#CC=O,0.204
CC(C=O)C1=NOC=N1,0.2145
OCC1CN1CCC#C,0.2822
CC(=O)C1CC1C(C)=O,0.2079
CC1C2CNC(=O)C12C,0.2702
CC(=O)C1OC1C1CN1,0.2031
CC1CC11CC2(C)OC12,0.3336
C1CC1CC(=O)C=O,0.1525
OC1=C2CCN2C(=O)O1,0.2275
COC1(C)CCC11CO1,0.3244
C#CC#CCC#CCO,0.2288
C#CCC1OC2CC12,0.2878
Cc1ccoc1CC=O,0.1917
CN1CC23CCC(O2)C13,0.2893
CCC(OC=N)C1CO1,0.2786
O=C1CC23CC1C2CO3,0.2224
C#CC(=O)NC(=O)CO,0.1991
OC1C2OCCC(=O)C12,0.2204
c1coc(n1)OC(=O)N,0.2484
OCC12CC3C1CC23O,0.3276
N#CC1CC2CCC1C2,0.3367
O=C1CC2(CC#C)OC12,0.2165
CC(C)C(O)C1CC1,0.3305
NC(=O)CC1(CO1)C#N,0.2452
CCc1cnc(o1)C#N,0.1995
OCC1CNC(=O)C1=O,0.169
CC1C2CC(=O)C12C#C,0.2229
CC12CC1C1(O)CC2C1,0.3184
O=C1C2OCC3NC2C13,0.1988
C1C2C3COC(C3)CN12,0.3038
CC1C2C1C1CC2C=C1,0.255
CCc1c(nccn1)N,0.1876
CC(C)CC(=O)NC,0.2788
CC12COC3C(CO1)C23,0.3194
c1cc(=O)ncnc1N,0.1733
CCC(=O)C1(CC1)CC,0.2324
N=C1COC(=O)C(=N)N1,0.1955
CC1CCCC2(C)OC12,0.3358
OCC1C2CCCC1O2,0.301
OC1CCC1C#CC#C,0.2242
CCC(CCCO)C#N,0.3049
COC1(C)CC=CC1,0.2653
C1OC1C1=NCCCO1,0.2506
CCCC(=O)C#CC#C,0.185
OCC12OC1C=CC2=O,0.1676
CCC1(O)CCC2CC12,0.3258
CCN1C=NC(C)C1=O,0.2284
CC1C2(C)CC1(CO)O2,0.3162
CCC(C)(C)NCC#N,0.2694
C1C2C1C1CC2COC1,0.3143
Cn1c2c(cc[nH]2)cn1,0.2218
CC12C3CC11C=CC2C31,0.2209
CC1CC2(CN2)C2NC12,0.3101
CC(CO)C1=CNN=C1,0.2589
C1CC2CC1CCC=C2,0.2554
CC#CCC#CC,0.2875
CC1C2CC1OC(=O)O2,0.3196
OC1CC2C(O)C(O)C12,0.2928
Cc1[nH]nc(n1)C2CC2,0.2475
O=C1CC23COCC12O3,0.2193
CC1N(C)CC1(O)CO,0.2904
C(CC(=O)N)C(=O)CO,0.2366
CC1C2C(O)C2(O)C1O,0.2884
COC1OC(C=C1)C#N,0.2638
CCC1C(O)C1(C)O,0.295
OCC1C(C#C)N1C=O,0.2556
CC1CC2(C)CCC2=C1,0.2429
C1CC1C2=CCOC2,0.2421
OC1C2C3CC2CC1C3,0.3158
COCCc1nnon1,0.1986
CC#Cc1coc(n1)C,0.211
C1CC2(CC1=O)COC2,0.2202
CC1(CN1C(=O)C=O)C,0.1691
CCC(CC(C)C)C#N,0.3446
c1c2c(no1)OC=NC2,0.237
Cc1cnn(c1O)C=O,0.1977
CCC1(CO1)C1(C)CC1,0.3513
CC1C(C)C(=N)N1C=O,0.2288
O=C(C#N)C1CC2CN12,0.1675
CCn1ncnn1,0.2664
N=COC1CC2(CO2)C1,0.2796
CC(O)C(=O)N(C)C=O,0.2234
OC1CCCN2CC12,0.2868
CCN1CC(C1)NC=O,0.2497
CC(CO)CC1(O)CC1,0.3029
CN(C=O)C(=N)C1CC1,0.2297
COCCN1CC1,0.3241
O=C1CC(O1)C1COC1,0.2659
C#CC1(CCC#N)CN1,0.2762
CC1CC(O)(C1)C1CO1,0.3311
OCC1(OCC=C1)C#C,0.2474
CC12CN1C(C2)C(N)=O,0.2688
CC12CC=CC1(N2)C#C,0.2259
OCC1C(=O)CNC1=O,0.2123
C1OC1C1=CCCC1,0.2448
CC(=O)n1nc(nn1)O,0.1994
c1([nH]nc(n1)N)N,0.2391
CC1CC(=N)OC1C=O,0.2134
OCC1=C2CN3C(C1)C23,0.1673
CN=C1OCCC2CC12,0.2622
CC12C(O)C3C1CCN23,0.3056
CCC1(O)C2OC2C1O,0.301
OC1C2C3C=CC1N23,0.2166
CCC1OCCC1(C)C,0.3148
COC1(C)C2OC1C2C,0.3053
OC1C2CC1(CC2)C#N,0.2904
CC(=O)CCN1CC1,0.2229
CC1C2N3CC=C1C23C,0.1672
OC12COCC3OC1C23,0.2836
O=CC1CC2C3OC3C12,0.2291
c1cc2c(nc1)ocn2,0.2069
C(C#CCC#N)C#N,0.2886
O=CC12CC=C3CC1C23,0.1695
COCC(C)CN1CC1,0.3171
CC12CC(O)C1C(=O)O2,0.2707
CC1(C)CC2(CO2)C1O,0.3231
CC1=CC2OC3(C)C2C13,0.2265
CC(C#N)C1(C)CCC1,0.3331
CC12C=CCC1N2C=O,0.2368
OCCC12CC1C1NC21,0.2799
c1nc2n(n1)CCCO2,0.258
CC1NC(=O)CC2CC12,0.2663
N#CC1C=CCC2CN12,0.2413
CC(O)CC#CC1CN1,0.2681
N#CC1CC2CC1O2,0.2971
CCC1CC2(CC2)CO1,0.3331
CNC(=O)NC,0.3052
OC1C2C1C1COCC21,0.3039
CC(O)C1C2CCC12C,0.3139
CC1C2CCC1C2C#C,0.3026
O=C1CC2CC3(CC3)C12,0.2161
CCOC(C)C(C)C=O,0.2265
CNC12C3NC1C(=O)C23,0.2199
CCC1CCC(=O)N1C,0.2709
NC(=O)C1OC1C#N,0.2412
CC12CC3C(CC1O)N23,0.2953
C1OC2C3CC=CC12O3,0.2258
CC(O)C(C)CCCO,0.3347
CCC1OC2COC12C,0.3056
CC1C=CC2CCCC12,0.2628
c1c([nH]nc1C#N)C#N,0.2203
OC1CC2(NC12)C1CN1,0.3012
Cc1ncnnn1,0.1613
CC1=NNC(=N)N1C=O,0.1836
O=C1C2C3C=CC1C23,0.2049
OCC1C2C3CC1C23,0.3173
CC1(CC=CC(=O)N1)C,0.2068
CC(O)C(F)(F)F,0.3637
C#Cc1nc(on1)C#C,0.2001
Cc1c([nH]nn1)N2CC2,0.2267
CCN1C2C(O)C2C1=O,0.2467
CC(C)(CO)C#CCO,0.2863
CC1CC(C)(O)C1C#N,0.3025
CC1CC(=NO)C11CC1,0.2355
N#CC12NC1CC1CC21,0.2706
CC1C2C3CC4C(C23)N14,0.3048
N=C1CC2OCC2O1,0.2857
Cc1cc(c(=O)oc1)F,0.1748
c1c(c(=O)onn1)CO,0.1749
CC1N2CC1(C2)C1CO1,0.3098
CCOc1nc(co1)C,0.2446
CCOC(=O)C1CC1O,0.2478
CCC12CC(C1)OC2=N,0.2861
CCCCCC1CC1C,0.3516
CNC(=N)C(=O)OC,0.1894
CC1(C)N2CC2C11OC1,0.3195
CCn1c(=O)[nH]nn1,0.2255
N#CC1CC1C#N,0.3008
CNC(C#C)C(=O)OC,0.2318
O=CC1C2C3CCN1C23,0.2019
CCC12CN1C1C(C)C21,0.2851
CC(C)C(=O)C(C)C,0.2264
CC1C2N1C1CC2(O)C1,0.2964
OC12C3NC1C3CC2=O,0.2126
CN1CCC2C3OC2C13,0.2827
CC(C#C)N1C2CCC12,0.29
c1c2c(oc1N)NCC2,0.2076
CC1C=CC(O)C1C,0.2625
OCC1OC1C#C,0.2776
CCC(COC=O)C#N,0.2854
C1N=C2NC=NC3C1C23,0.2155
CC1CC2NC2(C1)C#C,0.2668
C#CCNC(=O)C=O,0.1753
O=CC12CN1C(=O)C2,0.2087
OC12CC1C1NC21C=O,0.1839
COC1C2OC(C#N)C12,0.2511
CC1(O)CC2NC2C1,0.3164
CC(CCC(N)=O)C=O,0.2261
CCC1C2C3NC3C12O,0.2777
CC12C3N1C1CC2C31C,0.3062
CC(=O)C12CC1C1CN21,0.2127
C1OC1C1=CN=CN=C1,0.2097
O=C1NC2CC3OC3C12,0.2813
CC1CC1C1CCC1=O,0.2168
CC1C(O)C2=CCOC12,0.2338
NC(=O)CC1C(O)C1O,0.2606
N=C1CCC(CC=O)O1,0.2241
CC(=NO)CC1CC1,0.2553
N=C1OC2C1CCC2=O,0.2058
CC1CC(O)(CO1)C#C,0.2758
CC(C)C1CN1CC=O,0.2144
NC(=O)C(=N)N1CCC1,0.2037
CCC1(COC=O)CN1,0.2726
CCOC(COC)C=O,0.2132
CC1C(C#C)N(C)C1=O,0.2693
COC(CNC=O)C#N,0.2674
CC12CC1(O)COCC2,0.31
CC1OCC(C)(O1)C=O,0.2139
CC(=NO)C(O)C1CO1,0.2547
CCC1(CC)COC1C,0.3096
C1C2CCC3(CC3)CN12,0.3003
CC12C(O)C1NC2=O,0.2501
OCC1C(O)C2CCC12,0.2978
O=CC1=C2CCN2CC1,0.1767
N#CC12CCC1CCO2,0.2909
Cc1c[nH]c(=O)n1C=O,0.1887
OCCC1CCC(=O)C1,0.2226
CCNC(=O)C#C,0.2328
OC1CCC2(NC12)C#C,0.2659
CC1C2C3C(CO)C2C13,0.3371
CC1(C#C)N2CC1(O)C2,0.2734
C#CC1(COC1)CC=O,0.2185
CCC(C)(C)OCC#N,0.2956
Cc1c(nno1)C=O,0.2034
COCCC(C)N1CC1,0.319
CC1(CC=CC1=O)C,0.1906
OC1=NC(=N)C=NC=C1,0.1695
C1CC12CCN(C2)C=O,0.2642
C#CCNC(C#N)C#N,0.2547
CC1C2CC2OC1CO,0.3118
OC1C2CC3(O)C2C13O,0.2829
N#CC1C2CC3(CO3)C12,0.3013
CC1NC1C1(CC1)C=O,0.2174
O=CC1NC(=O)CC=C1,0.202
Cc1cc(n[nH]1)NC=N,0.2183
NC12CC(C1)OC2C#N,0.2626
COc1ccoc1,0.2342
CC1=C(CCOCC1)C,0.2443
CN(C(=O)N)C(=O)N,0.2617
CC1C2C3CC(O)C3N12,0.2662
CCCC1(C)COC1=N,0.2927
OC1CC2CN2CC1O,0.2779
CN1CC1C1(C)COC1,0.2934
CC1CC2CC1C2(C)C,0.3596
c1c2c(c[nH]1)CCCC2,0.2404
CCc1[nH]c(c(n1)O)O,0.2132
CN1CC11COC(=N)C1,0.2693
O=COCC1COC1=O,0.2749
CC1CCC2C(CO)N12,0.2912
CC#Cc1cocn1,0.2139
c1conc1C#N,0.234
OC1C2OCC2C11CC1,0.3013
OC12C3C1C1CC3C21,0.3073
OCC12C3CC1C1C3N21,0.3011
CCC1CC2CC1C=C2,0.2545
CC1CN1C(=O)C1CO1,0.2401
C(C(CO)(CO)O)O,0.2944
C#CC12CC1CC2,0.2702
N=C1OCOCC11CO1,0.269
COC1C(C)C1CC#C,0.2977
OC1CC1C12CC(C1)O2,0.3005
O=CC(=O)NCC1CO1,0.176
CCCC1(CCC1)CC,0.352
OCC12CC(C1)C1CN21,0.3039
Cc1cc2n(c1)CCO2,0.2328
O=CC1CN=CNC1=O,0.2213
c1c(c(nc(=O)o1)N)O,0.1874
CNc1cc(c(o1)N)O,0.2156
CC12C3N=C4OC(C13)C24,0.1537
CC1C2CC1(C)C2CO,0.3288
CCC(=O)OCCCO,0.2864
C#CC1CCC11CCO1,0.2818
CC1C2CC1C(O)C=C2,0.2472
N=COC1=CN=NN=N1,0.1695
COC1C(=O)C2OC12C,0.1944
CCn1c(n[nH]c1=O)N,0.2478
c1c[nH]c(c(c1=O)O)O,0.186
CCCC1OCC11CN1,0.3078
CC1NC1(C)C(N)=O,0.2662
CCC(OC(C)=N)C#C,0.2882
CC(=O)C12CCN1CC2,0.2035
CC12CC(O)C(CO1)C2,0.311
OCC1C(O)C1C#C,0.2804
O=C1CCC2CC2C=C1,0.1875
CN1CCNC1=O,0.295
CNc1cc(n[nH]1)C#N,0.2045
C1NC11CC2OCC12,0.3097
CC1CC(C)(O)C2OC12,0.3241
CC1C2CC=CC(C)C12,0.2635
COC12C(C)N3C1CC23,0.3259
CCC(=O)n1nccn1,0.2231
OCC1=NC2CC2N1,0.2483
CC1OCC2(CO)OC12,0.3251
COC1CC=CCC=C1,0.2556
C1CN(CC1=NO)C=O,0.2378
c1nc(no1)C2CC2,0.244
C[NH2+]C(CC=O)C([O-])=O,0.2073
OC1CC2CC3C1CN23,0.281
C1OC2C=CC3NC3C12,0.2389
CCC1C2CC3CC1C23,0.3352
N#CC1N=C2NC3C1C23,0.1716
OC1C2CC1(N2)C1CO1,0.3054
N#CC12C3COC1CN23,0.2559
CC#CC(=O)OC(C)C,0.2337
NC1(CC11COC1)C#N,0.2746
COC1CC2C(C)C12,0.3244
CCC(=O)C1NCC1O,0.2208
CN1CC=C(C1=O)CO,0.2185
OC1CC2=C(CCC2)C1,0.256
CCCC1OCCCO1,0.3501
CC1CC11C2CN2C1C,0.3032
CCCc1nc(no1)O,0.2442
C1CN1C1=NCC2OC12,0.2381
C#CCc1c(nco1)O,0.2186
CC(O)C1CC1CC#N,0.3143
C1C2C3C4C2C11CN4C31,0.2925
CC(O)C1(C)C2CC1O2,0.3088
CCCC(N)(C#C)C#N,0.2701
CCc1cc(=O)cno1,0.1825
O=C1CC=CC1CC#N,0.2226
OC1C2OCC(C#N)C12,0.2809
CC1(CC(=O)OC=N1)C,0.2485
C1OC11C2CC1C1NC21,0.3081
CC1CC2(C)CC2C1O,0.3167
CCC(C)C(C)(C)O,0.3266
O=C1CN=C(O1)C1CO1,0.2426
CCC1COC(=O)C1C,0.2737
O=C1CCOC1C#N,0.2162
c1c(c(nc(n1)F)F)F,0.2194
CNC(=O)c1ncno1,0.204
C1C2OC3OCC2OC13,0.3294
CC12NC(C#N)C1C2O,0.2525
NC1(C#N)C2C3OC3C12,0.2475
CC#CC12CC3C1CN23,0.2565
OC1CC(O)(C#N)C1=O,0.1898
c1cc(n(c1)CC#N)N,0.2147
CCC(=O)C(=O)NC=N,0.1653
CC1(O)CCOC=NC1,0.2572
O=C1CNCCNC=C1,0.1708
N=C1OC=C(O1)C#N,0.1906
COC1C(C)C1C1CO1,0.3193
C1CC12C=CNC2=O,0.2051
C1OC2C=CC3CC12C3,0.2413
CCC1OC(CO)C1C,0.313
C1C(CO1)(CC#N)C#N,0.283
CC12CC3(CCO3)C1O2,0.3044
CCCCCO,0.3427
C1CN1C1C2COCC12,0.3024
OC12CN(C1)CC(=O)C2,0.1911
CC1C2C3C1CC23C#C,0.2725
C1CC23C=CCC2CC13,0.2452
O=C1CC2NC12,0.2224
OC1CC2(COC2)C1O,0.2911
C1CC11C=CCC2OC12,0.2521
CC12COC3C(O1)C23O,0.2753
CC1C(C)C2(C)OC12C,0.3176
CCOCC1COC1=N,0.283
CCC1COC2CC12C,0.303
OC1CC2(CCO2)C1,0.3085
OC1CC2=CC(=N)OC12,0.2054
C1CC2CCOCC2C1,0.331
OC1C2CCN2CC1=O,0.1865
CN(C=O)c1cnco1,0.2223
CC#CC1CC1C1CC1,0.2805
c1c(onn1)NC=N,0.2024
CC1OCC2(O)CC12O,0.2965
CN(C)c1cc([nH]n1)O,0.2356
c1cn[nH]c1OC(=O)N,0.2413
CCC1(C)CCC(O)C1,0.3303
CC12CC3CC(O1)C2C3,0.3189
CN1C2CC3OC3(C)C12,0.3062
COC12CC3C1COC23,0.3214
C1C2C1C13OC4C1N2C34,0.2727
CC(C)(C)N1CC1C=O,0.2053
N=C1C=CN=NOC1=O,0.1504
C#CC1(CC1)COC=O,0.2688
CC(C#C)C#CC#N,0.2387
CC(C)CCOCC#C,0.2887
CC1=CC(=N)C(F)=CO1,0.1942
CC(C#N)N(C)CCO,0.2651
COc1cc(c[nH]1)C#C,0.2067
C#CC12NC3=NCC1C23,0.171
CCC1CN2C=NC=C12,0.2547
OC12CN(C1)C2C#C,0.2713
O=C1C=CC2(OC12)C#C,0.1682
CC1C2OCCOC12C,0.3016
OCC1CCC1C1CO1,0.3261
OC1C2C3C(O)C2(O)C13,0.31
ON=C1C2C=CC1C=C2,0.2115
OC12CC1(NC2)C=O,0.1868
OC1C2OC3CC=C1C23,0.2114
OC1C2OCC(O)C12,0.3168
CC(O)C1=CC=NN1C,0.2505
CC(C)C1(CO1)C1CC1,0.3365
CC(=O)C1CC1C#C,0.225
c1(noc(=O)o1)N(=O)=O,0.1916
O=CC1CCCC=C1,0.2184
CC12COC3C1C2C3=O,0.2191
O=C1CC2C3OC12C=C3,0.1983
O=CC12COC(C1)OC2,0.222
CCC1C(C)OC1=NC,0.278
CNC1(CC1)C#N,0.2671
Cn1c(ncnc1=O)N,0.2105
CCOCCOC=O,0.2849
CC1(CO)C=CCC1=O,0.2208
CCc1c(n(nn1)C)C,0.2437
COC1CC1OC=N,0.2712
CCC12CC(C1)(C2)C#C,0.3023
C1C2OC3CC1N1C2C31,0.3202
CNc1ccc(nc1)O,0.1752
C#CC1C2C3C1N=CN23,0.2259
OC(C#C)C1COCO1,0.2795
C1C2OC3COCOC123,0.2939
[NH3+]C1C2COC12C([O-])=O,0.2371
CCC(CC#N)CC#N,0.3332
OC1CC2NC(=O)C12O,0.2555
CC(=O)CN1CC=CC1,0.2018
C1COCC12OCCO2,0.3308
COC1C(C)C2CC12O,0.3217
CN1CCC2(C1=O)CC2,0.2677
Cc1cn(nn1)CC=O,0.2059
CC1OC(C#N)C(C)=C1,0.2529
CC12C3C4N1C4(C#N)C23,0.2373
CC1(CC1OC=N)C#N,0.2712
CC1=C(C=CCCC1)C,0.1954
CC(C)(C)C1OC1CO,0.3325
CCC1(CC1C)C#C,0.2934
O=CC1OCC(C=O)=C1,0.1706
CCOCC(=O)CCO,0.2348
NCC1CC([NH2+]1)C([O-])=O,0.2626
CC1C=CC(=O)C2CC12,0.1896
CC1=C(F)C(=N)C=CN1,0.1863
CC12OCC3CC1OC23,0.327
CC1=C2C=CCC2CC1,0.19
CC#CC12CC3C(C1)C23,0.2779
CC(=O)C1OCC1C#C,0.2185
C1CC2COCC22OC12,0.3293
CC1(C=CC(=O)C1=O)C,0.1377
O=C1CN=CN2CCC12,0.1888
CN=C1CC(C)OCO1,0.2651
N=C1NC2CC2C1=O,0.1871
Cc1coc2c1ocn2,0.2007
CNC1=CC(=N)N=NN1,0.1555
NC(=O)OCC(O)C#N,0.309
c1c(c(cnc1O)O)N,0.201
CC(C)C1C2C3CN2C13,0.301
CCc1nc2n(n1)CC2,0.2679
CC1C2C1C1(CN21)C#N,0.2409
C1CC2C3CC(C3)OC12,0.311
OC12CC1C(OC2)C#N,0.2929
CC1CCCC=CC=C1,0.2058
CC12CN1C(C)(C2)C=O,0.2167
O=C1C(C2CN2)C2CN12,0.2306
Cc1c(c([nH]c1O)O)O,0.2083
CC(=O)C1(C)OC1CO,0.2213
OC1CC23CC=CC12N3,0.2349
CC#CC(O)CC(N)=O,0.2559
CCC#CC12CC1OC2,0.2597
O=C1OC2C1CC21CC1,0.2786
CN1C2C3C2C2(CC2)C13,0.2919
CCC1OCC1(C)O,0.3078
CC1OC1C(N)C#N,0.2859
NC(=O)C1C2CCC12O,0.2605
OC1C2CC(O)C12C#C,0.2694
c1c2c(on1)COCC2,0.2375
CC1(C)C2NC2C11CN1,0.2956
CC1=CCC2C3OC1C23,0.2308
CC1(C)C2CCC1C2=O,0.2285
CC(C)OC(C=O)C#N,0.2216
NC1=C([NH+]=CN1)C([O-])=O,0.1582
CC12C(CO)C1CC2=O,0.2283
C1CC1C1OC2CC12,0.3154
OCC(O)CC1CC1,0.3278
CCc1c(nc[nH]1)CO,0.2391
N=C1OCC2(CN2)C=C1,0.2111
N#CC1=CC2CCC1C2,0.2134
CC1C=CC2OCCC12,0.2619
N#CCNCC1CN1,0.2717
N=C1CCC(O1)C1CN1,0.2722
COC(=O)c1nnon1,0.2141
Cc1concc1=O,0.1843
OC1CN(CC1O)C=O,0.2651
OC1CC1C1=NNC=N1,0.2285
CN1CC23NC(C2O)C13,0.2694
C1C(C1N1CC1)N1CC1,0.3111
c1c(oc(n1)CC=O)N,0.1772
CC#CC1NCC1=O,0.2077
C1OC1C1C2CCCC12,0.33
OC1C=C(C#C)C2NC12,0.1989
CC(CO)OC(C)=O,0.2834
c1c([nH]nc1N2CC2)N,0.2405
NC(=O)C1C2OC=NC12,0.2565
COc1ccc([nH]1)O,0.2365
C1OC23CCN4C2CC134,0.2616
C1NC1C1=NC=CO1,0.2351
OC12C=CCC1C2C=O,0.2115
COCc1nc(no1)N,0.2262
O=C1CC2CC2(O1)C#N,0.2781
CC1NCC2=NON=C12,0.2081
Cc1ccn[nH]c1=O,0.1787
C1C=CC=CC(=O)C=C1,0.1739
CC1OC2(C)CC1C2=O,0.2067
C1C2NC2C=CC2OC12,0.2529
OC1=C(C=CN1)C1CN1,0.2419
CC12OCC1=CC1OC21,0.2301
N=C1ON=NC=N1,0.1547
CC(=O)CC12CC(C1)O2,0.2278
CC1(C=O)C2CC(=O)C12,0.2099
OC1C(=O)NC11CC1,0.2656
Cc1c2c([nH]n1)OCO2,0.2262
CC12CC3(O)C1CC23O,0.3171
OC1C2NC2CN2CC12,0.2763
OC1C2OC2C1=O,0.2034
CCCC1(C)CC=CC1,0.2655
CCC1=CCCC1(C)O,0.2568
CCCC1COCC1C,0.3208
CC(CCCC#N)C#C,0.3015
N#CC12OC1CC1CC21,0.2819
C#CC(=O)C1CC1,0.206
CC1CC(=O)C1(C)C#N,0.2176
C#CC1C2C3CCC3N12,0.2481
C#Cc1[nH]c(nn1)C#C,0.1936
COC12C3C4C3C1CC24,0.3047
C1NC1C1=NC=CN=N1,0.164
CC1C(COC1=O)C=O,0.2224
N#CC1(CN1)C1CCO1,0.272
CC(=O)C1CO1,0.224
c1cc([nH]c1CC=O)O,0.1643
CC1(CC1O)C1CCO1,0.3225
CC1(O)CN2C(C#C)C12,0.2556
CCc1c(c(c[nH]1)N)O,0.2218
COC1COCC(C)O1,0.3264
COC1=NC(C)CN1C,0.2654
CC1(COC(=O)C1)C=O,0.2235
CC1CC1C(C)=O,0.2303
C1C2C3C2C2C=CC3N12,0.2484
CC(=O)CCC1CCC1,0.2341
CC1=C(CC2NC12)C=O,0.1889
OCCOC1CC1C=O,0.2292
N#CC12CC3C(OC1)C23,0.2709
C#CC1C=CC2CN1C2,0.2215
OC1CNC1C=O,0.2096
C1C=CC2CN=COC12,0.2509
CN=C1NC(C#N)C1O,0.2521
CC1C2OC3CC2N1C3,0.2978
OC1C2CC2OC1C#C,0.2676
OC1CC2(CC#C)NC12,0.2801
C1C2NC3=CNC=C3C12,0.2226
CC1(OC=N)C2CC1O2,0.2649
COC1COCC(=O)O1,0.2559
N=C1ON=NO1,0.2189
CC(O)C#CC(C)C#N,0.2861
CC1(CC2CC2O1)C#N,0.2885
CC1OC(OC1=O)C#C,0.2735
CCOC1C(N)C1C#N,0.2678
Cc1noc2n1cnn2,0.2177
CN1C2CC1C(=O)C=C2,0.1645
C(=N)(C(=O)NC(=O)N)N,0.2105
C#Cc1cc(=O)cco1,0.1778
COC(C)C1=NNC=N1,0.2498
C(C(=O)NC(=N)N)O,0.2264
CC(=O)c1c(nc[nH]1)N,0.1691
C#CCc1cocc1N,0.2198
OC1CN(CC=O)C1=O,0.2103
CC1(CC2NC12)OC=O,0.2524
COC(=O)C#CC1CC1,0.2295
CC1CCC2=C1C=CN2,0.2379
CC1(O)CC1OC1CC1,0.3081
CC1C2CCC12CC#N,0.298
OC1CCCCNC1=O,0.2727
C1COC(OC1)C2CC2,0.3482
CC1NCC2=C1ON=N2,0.1936
Cc1c(cc[nH]1)COC,0.2345
CCC1CC1CC=O,0.2256
CCC(CC(N)=O)OC,0.2727
CC12OC3C1CC2C3=O,0.2109
COC1OCCCC1C,0.3316
N=C1CC2CCC(O2)O1,0.2784
CC#CCC1COC1,0.2963
CC1OC1C(=O)N1CC1,0.2391
C1C2C3OC4(COC24)C13,0.2937
CC12CNC1C(O2)C#N,0.2502
Cc1cnc[nH]c1=O,0.1953
CCN=c1n(nno1)C,0.1966
CN1CC1C1CCOC1,0.2996
C(=O)C(=O)C(=N)N,0.1409
NC1C(C#N)C11CCN1,0.2452
O=C1C2C=CC1C21CC1,0.2475
c1c(n[nH]n1)CC2CC2,0.2568
CC1C2C3CC2C3C1=O,0.2202
N=C1OC(=CC=N1)C#C,0.1456
NC1C(CC1C#N)C#N,0.2656
CC1(NC1C1CO1)C#N,0.2791
N=C1C=CC=NN1C=O,0.1492
CC12CC1C1C3CN1C23,0.3115
CC(=O)CNCC(=O)C,0.1994
CC1OCC2=C1N=CN2,0.2395
CCC1(O)CC2(C)OC12,0.3094
CCC(=N)NC(=O)C,0.2338
COC(C=O)C1CCC1,0.2106
CC1CC(O)C(CO)C1,0.3017
N=C1C=COC=C1C#C,0.186
COCC12CC(C1)C=C2,0.2406
Cc1c(c(c[nH]1)OC)O,0.2333
CCC12CC1C=CC2C,0.2454
C#CCC12NC3C1OC23,0.2818
CC1C2C(O)C(O)C12C,0.3142
OC1COC23CC(C2)C13,0.3034
COC1=CC(=N)ON=C1,0.1677
CC1C2C3CC1C(O)C23,0.3303
CC#CC(CO)CC=O,0.2219
c1(nc([nH]n1)O)N,0.251
CNc1coc(=NC)o1,0.2334
Cc1[nH]c(cn1)CC#N,0.24
CCC1C(C)CC1C#C,0.301
CC1=CN(C(=O)C1)C,0.2045
CN=COC1(CC1)CO,0.2706
CC1CC(O)C(C)(O)C1,0.3163
CCC12C3C4C3N1C24,0.2792
C#CC(=O)CC(=O)CO,0.1867
OC12CC1C1CC1C2=O,0.2037
Cc1c[nH]ncc1=NO,0.1589
CC1CCC(=O)C1=NO,0.1656
NC(=O)C(CCO)C#N,0.2776
CC(=O)C(OC=N)C#C,0.2203
N#CC12CC3C1CCC23,0.3196
CC1OC1(C)CNC=O,0.2816
OCC12OC3C(C=C1)C23,0.2282
OC1=CC(=N)C=C(O)N1,0.1991
COC1C2CN2C1C#N,0.2597
C1C2OC3OCC=C3C12,0.241
CC1(C)C(CO)C1C#C,0.2862
Cc1cc(c(cn1)N)O,0.2001
c1cc2n(c1)CC=C2,0.1751
OCC1NC1C(=O)CO,0.2234
CCC12CC1(C)C=CC2,0.2462
CCC#CCC(=O)C#N,0.1786
C1CC1CNCC#N,0.2677
CN1C2C3(C)CC1C23O,0.2757
CC(=N)OC1=CN=CO1,0.24
CC1OC2C3C1OC23C,0.2906
CN(C)c1cocn1,0.2053
CC1N(CC=O)C1(C)C,0.2082
CC1OCOC(=N)C1=O,0.184
CC(N)C#N,0.2983
C1CCC#CCOCC1,0.2697
C1OC23C1CN1C2CC31,0.3054
CC(C)C1(CCC1)CO,0.3361
CCC12CC3C(C1)OC23,0.3152
C1C2OC2C2C3OC2C13,0.3079
CN=c1oc(no1)CO,0.2368
O=C1CNC2CC2C=C1,0.1638
CCC1(CC1(C)O)C#C,0.2904
O=C1CC2CC2CO1,0.2759
N=C1OC=C2NCCN12,0.2289
COCC1(CC1)OC=N,0.2856
CCC12CC3C1COC23,0.3232
C#Cc1cnc([nH]1)O,0.2007
c1c(nc(oc1=O)F)O,0.2036
C#CC12OC1CC1OC21,0.2661
CC1C2C3C1C2C3(C)O,0.3275
C1C2C3C4C1N1C2C3C41,0.2807
OC1C2C3C4CC(C14)N23,0.3014
CC12C3C1C1=CC2=CC31,0.1226
N=C1OC2OCCC2=C1,0.2146
CC(=O)N1C2CC1(C)C2,0.2467
CC1NC(=O)OC2CC12,0.3024
CC1NC2(CC2)C1=NO,0.2187
O=CCC1COC=NC1,0.2172
CC(NC(=O)C=O)C=O,0.1722
N=C1NN=NC(=N1)C#C,0.1501
CC(=N)NC(=O)CC#N,0.2319
CCC12CC(C1)OC2=O,0.2731
Cn1c2c(nco2)nn1,0.219
COc1c[nH]c(n1)C#N,0.1817
O=C1CC2COC2C=C1,0.1845
C#CCc1c(non1)N,0.2147
CN(C)CC#N,0.2588
CC(=O)C1C=CC2CC12,0.2158
CC#CC(=O)C(C)C#C,0.1979
C(c1nc(c(o1)N)O)N,0.2172
OCCC1C(O)C1C=O,0.2224
O=CC1C2NC2C2OC12,0.2175
CCOC=NC,0.2729
CC1OC2CC3(CO3)C12,0.3045
CC1C(C)C1C1(C)CO1,0.3273
CC1OC(C)C1CCO,0.3135
O=CC1C2CC3OC3C12,0.2196
COc1ccc(o1)C#C,0.1845
CC(OC(=N)C#C)C#C,0.2327
CC1C2N1CC2(C)C#N,0.2709
OC1(CC1C=O)C1CN1,0.2212
C(CC#N)CNC=O,0.2784
C1CC(=O)OCOC1,0.2706
OC(CC#N)(C=O)C#N,0.2272
COC1C2COCC12C,0.3093
OC1C2C3CN2C1C3=O,0.2094
OC1CCC2CC2C1=O,0.2172
CC1CC2(CO2)C1C#C,0.2964
CC1OCCCC2NC12,0.3105
CC#CC#CC(=O)C#N,0.1582
c1c(cnc(n1)CO)O,0.1932
COC1C(C)COC1C,0.3059
OC1C=CCOC2CC12,0.2522
CCC1(O)CC2CC1O2,0.3065
CC12C3C(C3C1O)C2O,0.314
O=CC1CC1CN1CC1,0.2224
CC1NC1C1CCO1,0.3105
CCn1cccn1,0.2626
CC1=NNN=C(N)C1=N,0.1668
OCC1(C=O)C(O)C1O,0.2211
CCCOC1CC=CC1,0.268
C1NC1C1CCO1,0.3166
CC(C)C1CCC1CO,0.3357
C1CC(=O)CCC1CO,0.2236
CC#CC(O)C(O)C=O,0.2122
CC(CCCC=O)C#C,0.2278
CCCC(CC=O)OC,0.2228
COCc1nccnn1,0.1643
C#Cc1[nH]cc(n1)C#N,0.205
OC12CC1C1OC1C2=O,0.194
CC1CCC(C)O1,0.3311
N=C1OCCC(O1)C#C,0.2646
C(CO)C(=NO)CC=O,0.2135
CC1OC2(COC2)C=C1,0.2438
O=C1CC2C(C3CC3)N12,0.2347
CC1=CCOC1CCO,0.2497
CN1C2CC3C4C1C2N34,0.2744
OC1C=CCOC1C=O,0.2229
COCC1(CN1)C(C)C,0.3165
C1=CC2C3C4C1C2N34,0.2436
CC(CCO)OC(C)=O,0.2827
CCCCC1NC1C#C,0.2819
C1OC2CCOC=NC12,0.2589
CC1=CC2(CN2C1)C#C,0.2286
CC12C3CC1CC23,0.3379
CC1OC11CC(C1)C#N,0.3021
C1CCC2OC2COC1,0.323
Cc1nc(n(n1)C=O)C,0.2136
COC(=O)C1OCC=C1,0.2341
C#CC1C2C3OC1C23,0.273
CCC1N2CCC2C1=O,0.2019
[O-]C(=O)C12CC[NH+]1CC2,0.2603
CC12C3C4C5C(C13)C2N45,0.287
N#CC1COCC2OC12,0.3053
COCC1NC2COC12,0.2968
C(C#N)C(C#N)(C#N)N,0.2736
CC(O)CNC(=N)C=O,0.1699
OC12CC1N1C3CC1C23,0.2874
CNc1cc(no1)C#N,0.1891
Cc1nccc(=O)n1C,0.1935
CCC1CC(=O)NC1C,0.273
CCc1c([nH]cn1)C#N,0.2138
CC(O)COCCCO,0.331
CC1(C#C)C2CC(O)C12,0.2869
CCC(CO)(CO)C=O,0.2181
CC12CCC3C(O1)C3O2,0.3046
CC1CCCCC1=NO,0.254
c1c[nH]nc1,0.2677
O=C1C2CC3OCC13O2,0.2287
O=CC1C2C1C1OCC21,0.2272
CCN=COC(=O)C#C,0.2127
CCC1C2OC2(C)C1=O,0.2111
CCC1CN1CC(C)=O,0.2229
OCC1C2CC1C1OC21,0.3256
COC1=NC=CC(=N)O1,0.1866
OCCC(O)C(O)CO,0.3161
CC(C)(C#N)C(C)(C)O,0.3235
NC(C#N)C1=NON=N1,0.2016
C#CCn1c(ccn1)N,0.2285
O=CCN1C2CCCC12,0.211
C#CC1CC2(CC2)CO1,0.2902
c1c(nco1)C#N,0.2302
CC1CC2C3C1CC23O,0.3248
CC1(C)C2CC1C1CC21,0.3435
C1C(=NO)C(=O)CN1,0.1495
CC1C2NC2C2CC1O2,0.3033
CC12CNCC(=O)C1N2,0.1964
CC1COCC1CO,0.3152
CCC(O)(C=O)C1CO1,0.2222
CNc1cc([nH]c1O)N,0.2121
CCc1cnccc1C,0.2296
CC12OCC1C2C#C,0.278
O=CC12NC1CC1NC21,0.2029
CC12CN=CN1C2C#N,0.2367
OC1C(O)C(=O)NC1=N,0.245
CC12CC=C(C#C)C1O2,0.2007
CNC12C(C)C1OC2=N,0.2482
CC1(C)C2N3CC3C12O,0.2827
COCC1CC(C)C1C,0.3238
CC(=O)c1cnno1,0.1899
N=C1OCCNC=C1,0.1949
CNc1ncccn1,0.1899
C#CC(C#C)C1CN1,0.2712
C(=N)NC(=N)C(F)(F)F,0.2323
O=COC12CC3C(C1)C23,0.2645
CC1C2CC1(CCO)O2,0.3117
CCC1=CCC2CC12C,0.2433
COCCc1conn1,0.2227
CCC1CN1C(N)=O,0.2856
CC1=CCC=C(C=C1)C,0.1874
N=C1OC2C(O1)C2C#N,0.279
Cc1c(nc(cn1)F)C,0.206
OC1CC2NC2CC1O,0.303
NC(C#N)C1=CON=C1,0.2468
CC1OC2(CCC2)C1=O,0.2168
OCC1OC(C=C1)C#C,0.2459
CC(OC=O)C(C)(C)C,0.2847
c1c[nH]ccc1=NO,0.1711
C1C(=O)OCC(=O)O1,0.269
CC1OC2COC2C1=O,0.1962
O=CC1OCC11COC1,0.2119
C1COCC(=O)C=C1,0.1826
CNc1c(cn[nH]1)C#C,0.2182
C1CNCC(=O)OC1,0.2417
COC1C=CC(O)C1C,0.2516
CC1CN=C(CCO)O1,0.2723
C1C2OC=NC1C1OC21,0.2691
OCC1=NC(=N)NN=N1,0.1663
COC1CC(C1)C(C)=O,0.2316
CC1(CCO)CC2CN12,0.307
CCNC(=O)CCCO,0.2779
OCC1(O)CC1CC#C,0.3068
N#CCC1CCOCO1,0.3089
C#CCc1cnno1,0.2334
CC12C3CC1C(C3)C2=O,0.2282
Cc1nc(n(n1)C=O)O,0.2141
CC1C2CC(C)=C(C)C12,0.2404
CC1C2OC2C(O)C1C,0.3207
[O-]C(=O)CN1CC[NH+]=C1,0.1453
CC1CCC(C=O)C1=O,0.2076
OC1CN=C2NCC=C12,0.1929
C1C2C3C4C5C2C13CN45,0.3224
COC1C2OC2C2OC12,0.2944
CC(CCCO)CC#N,0.3064
CC(N)C(N)(C#C)C#N,0.2602
CC1CC2C(O)C1C2=O,0.2303
CC(C=O)C1(C)CN1C,0.1953
COCC1OC1(C)C#C,0.2861
N=C(C=O)N1CC1C=O,0.184
CC12CC1(CCO2)C=O,0.2146
CC12COCC1OCO2,0.3208
COC1CC1(OC)C#N,0.2692
CCOCC1OC1C=O,0.2184
C1C(=O)C(=O)C(=O)CO1,0.122
CCC1(C#C)C(C)C1O,0.2858
CC1OC2COC1C=C2,0.2423
OC1COCOC1C=O,0.2226
CC(C)C1COC1CO,0.3067
CCC1(C)C2CC2C1C,0.3341
CN1N=C(C)C=NC1=N,0.1449
CC1=CCC2(O)CC2C1,0.2606
CC12CN1C(C=O)=NC2,0.179
C(C#N)c1nnon1,0.25
C#CC(=NO)C#CCO,0.1783
CC(=O)NC(=N)CO,0.2448
N=C1N=CN=CNC1=O,0.1915
CCC(C)(O)CC(C)C,0.3179
O=CC12CC3CN1CC23,0.2037
N=C1C=NNC=NC1=N,0.1742
CC(C)C1C2CC1CC2,0.363
N=C1OC=CC=C1C=O,0.1444
CC1OC(=O)NC1C#C,0.2843
CCC1CC(=N)OCO1,0.2788
C1C2OCC3OCOC123,0.3256
O=C1CCC1OC1CC1,0.2023
O=C1NC(CC=C1)C#C,0.2075
c1cn[nH]c1C(F)(F)F,0.258
CC(O)CC#CCO,0.2761
CC12CC3(CN3)C1(C)O2,0.3128
CCC(C)C1COC1=N,0.2897
CN1C2C1C(C)(C)C2=O,0.2018
CCOC(CO)COC,0.3201
CNc1cc(co1)CO,0.2181
CN=C1CC2C(C)C2O1,0.2655
C1CC2CC(C1)N=CO2,0.2738
CCc1cnn(c1O)C,0.2483
CC12CC1CCC(O)C2,0.3259
ON=C1CC2N=COC12,0.2359
CC12CCC3CC1C2O3,0.3015
CN=c1[nH]nnn1C=O,0.1783
CC12CC3(CC3O)C1N2,0.3134
c1coc(c1N)C#N,0.1915
CCC1(C)CCC(C)O1,0.3177
C1OC1C1CCC11CC1,0.3446
OCC12CC3C1CN3C2,0.285
CC(O)C1(O)CC(O)C1,0.3091
Cc1cc(nn1C)O,0.2376
C1C(CO1)(CC#N)N,0.2778
ON=C1CNCC1C#N,0.2337
c1c(c(=NO)cn[nH]1)O,0.1571
CC1(CC2CN12)C#C,0.2774
CC1CC23CC(C2C)C13,0.3069
N=C1NN=C(C=N1)C#N,0.1433
C1CC1CC#CC#N,0.2455
CC12CC(C1)(CO2)C=O,0.2175
C1C(CO1)CC2COC2,0.3133
O=C1NC=C2CCC12,0.2017
CC1C2CC1N2C(C)=O,0.2469
C(c1nnon1)N,0.1949
CC#CC1OC2(C)CC12,0.2588
CC1C=CCOC1=N,0.2629
CC1OC2CCC(C)C12,0.3123
C1CC2OC2CN=CO1,0.2511
C1OC2CC3CC12C3,0.3254
CC12OC(=N)OC1C2O,0.2952
CN1CC(C1)C#CCO,0.2497
CC1CC2=COC(=O)N12,0.2313
CCC(O)CCC#N,0.3231
CC1CN2C=NC=C2O1,0.2359
CC1C2COCC12C=O,0.2255
CC12CC(C1)C1CC2O1,0.3153
OC1C2C3NC1C23C#N,0.2519
N=C1OC=C2OCCN12,0.2384
NC1=NC2CC2(O)C1O,0.2295
CCC1(C)C2C3CN2C13,0.307
CC1CC(=O)N1C=N,0.2289
N=CN1C(C#C)C1C#C,0.2417
C1C2CC11COCC21,0.3356
CC(OC(C)C#N)C#C,0.2865
CC12C3C4C(C(O)C14)N23,0.2909
OC1COC11CNC1=N,0.2487
Cc1c(noc1NC)C,0.2223
CCC12OCC1C2CO,0.3009
CNC1(CC(C)C1)C#N,0.2665
OC1CCC2(CC2)OC1,0.3096
Cn1c2c(nn1)OCC2,0.2099
COC(CO)CCO,0.3179
COC=Nc1ncco1,0.1837
N=C1OCC2C=CCC12,0.2667
CC12CC3N1C3(C2)C=O,0.2105
N=C1OCCNC1C#C,0.2472
COC(=O)C1CC2CC12,0.2642
c1c(c(c[nH]1)O)C(=O)N,0.1851
CCn1nc(c(n1)N)N,0.2079
CC1OC2C1OC2=O,0.2483
CC12COC1C1COC21,0.3003
CC(O)(C=O)C#N,0.2198
Cc1cnc(nc1)C#N,0.2022
CCc1cc(co1)C#N,0.2155
C1C2OC2C2=C1N=NO2,0.2054
CC12OC3(C#C)C1NC23,0.2467
CCC12CC(C)(C1)C2C,0.3635
c1nc(no1)C(F)(F)F,0.2714
C#CC1C2C3OC3C12,0.2631
N=C1C=CC(=O)NC=N1,0.181
OCC1(O)CC2CC1O2,0.2987
C1N2CCC3COCC123,0.3137
OC1CCC1C1CCO1,0.3147
C1CC1C1CC2(CO2)C1,0.3274
c1c(c(ncn1)O)N,0.1974
C1OC2COCC12,0.3256
CCC1=CCC(=O)C1O,0.2225
COC1CC(C1)C#CC,0.2928
CC1(O)CC=CCC1=O,0.2141
CCCC1(CCC1)CO,0.3338
O=C1CN2CC12CC#C,0.2222
C1CC2C1N=C1OCC21,0.2633
CC1C2CCOCC12C,0.323
c1cc(n(c1)CC=O)N,0.1781
CCC(CO)C(=O)C#N,0.194
CC12CC(O)CCC1O2,0.3311
CC1(O)CC1(C)CC#C,0.3095
CC1(C)CC(CO1)C#N,0.2962
OC1C(O)C1(O)C1CN1,0.2638
CC(C)n1c(=O)onn1,0.2289
CCCN=C(C)OCC,0.2761
C1COCCN1C(=O)N,0.2832
OC1=NC(=N)NN=N1,0.1635
CCCC1C(O)C1C=O,0.2225
O=CC1CC(C=C1)C#N,0.2112
COC1CC2OC2C1O,0.3115
COC1C2NCC12O,0.2841
CCC1NC1(CC)CO,0.3033
CC1=NOC(=N)C(=O)N1,0.1963
CC1CCCOC=N1,0.2584
N=COC12C3CC1CC23,0.2687
CC(CC(=O)C=O)C=O,0.1575
CCC12CC3C1CC23O,0.331
CC#CCC#CC(C)O,0.2819
C1C2C1C1(CC21)N1CC1,0.2773
CC1COC2=C1NN=C2,0.22
OC1C2C3C1C(=O)N23,0.2454
[NH3+]C1CC1[C-](C#N)C#N,0.2701
CNC(C(=O)N)C(=O)N,0.2445
CCC1C2CN1CC2=O,0.2061
CC1OC2CC1C2O,0.2994
CC12CCC1(O)CC=C2,0.2614
c1c(c(noc1=O)F)F,0.1856
CC1COC1C(O)C#N,0.2678
N=C1N2CC2CN1C=O,0.2307
OC1CCCCCOC1,0.3164
CC1(CO)CN1CC#C,0.2675
OC12COC3C(C=C1)C23,0.2249
CC1=CC(=[NH2+])C([O-])=CO1,0.1346
C1CC1(CO)C(F)(F)F,0.356
O=C1CCC23CC(O2)C13,0.2146
CC(C)C(=O)NC(=O)C,0.2199
CC1OC(C1C)C(C)=O,0.2193
CC(O)CC1=CON=C1,0.2471
C1C2C3C4C3C1OC24,0.3408
CC#CC(C)C#CC#N,0.2272
CCC1(C)C2CC(O)C12,0.3183
COC1CCC2OC2C1,0.3311
Cc1cnoc1C,0.2393
CC1CC1C(=O)C(N)=O,0.1759
OCC12CN=C3OC1C23,0.1629
CC(C1CO1)C(=O)C=O,0.1516
CC1CC11CC(C)CO1,0.3055
CC1=CC23CN4C2C1C34,0.2245
CC(C)C1C(C)OC1=O,0.279
CCC12CC(=O)C1N2,0.2213
CCOC1(C)C2CC1C2,0.3372
CC1NC11CC(=O)C1C,0.2143
CC12OC3=NCC1C23N,0.1535
Cn1nc(nn1)N=CN,0.2128
CC(C)N1C(C)C1CO,0.2803
OCC1CCC2(CC2)C1,0.3368
c1c(c(c([nH]1)C#N)N)O,0.195
C(=O)N(C=O)C(=N)C#N,0.189
CC12CN1C(=O)NC2=O,0.2355
NC1=COC(=N)NC1=O,0.1764
CC(C)C(C#N)C(C)O,0.3098
OC1C2C3C4C3C1CC24,0.3253
CC1(C)CCC1(O)C#C,0.283
c1c(ocn1)N=CN,0.1816
CC1C2CN(C)C2C1=O,0.1958
CCC(CC)C1CCC1,0.3656
CC(C=O)(C=O)NC=O,0.1907
CC1=NC(N)=COC1=N,0.1388
CC1(O)CC1C#CC#N,0.2262
CC1C2C3C4OCC13C24,0.32
N#CC1=NC2(CC2)CN1,0.1845
OC1C(O)C2=CCCC12,0.2397
CC1OC2COC(C)C12,0.3192
OC1=NOC(=N)C(=N)O1,0.1952
CC(O)C1CNC(=O)O1,0.3134
CC(O)C12CC(C)C1O2,0.3156
OC1C2C1C1C2OC1=N,0.2757
CC1OCC1CNC=O,0.2705
O=C1NC23CCC12CC3,0.2728
NC1C2CC1(N2)C#N,0.2548
C1CC1C12CC1N1CC21,0.2817
CC1(CCCO1)OC=O,0.2746
CC(OC=N)C1(O)CC1,0.2802
CC1CC2C3CC2(C3)O1,0.3317
CC1(C)CC2C3CN3C12,0.2947
CN1CC(=O)C2CC1C2,0.2046
CC1OC(C)C1N1CC1,0.3176
CC1OCC2COCC12,0.312
CC12CC1(O)CC21CN1,0.3026
CC1CCN=COCO1,0.2571
O=C1C2C3NC(C23)C1=O,0.1517
CCN1C(CO)C1(C)C,0.2881
O=CC12CC(C1)C2,0.2183
NC(=O)C1(O)CNC1=O,0.2516
CC1CC2C3C2C(=O)N13,0.2412
N=COC1C2C3OC1C23,0.2622
C1CC=CCC(=O)NC1,0.25
CCCC1CCC=C1C,0.2596
c1c(cn2c1CC2)O,0.2284
CN=c1[nH]cc([nH]1)C#N,0.1633
COCC1CC(=O)C=C1,0.1935
O=C1NC=CCC1C#N,0.2073
CC1CC(C)(C)C(=O)N1,0.2744
OCCC(O)CN1CC1,0.2973
OCC12CC3C1C1C2N31,0.2875
Cc1c(nno1)C#C,0.2046
c1c(noc(=O)n1)C#N,0.1607
OCC12CCC1(CO)N2,0.2943
CNC(C#C)C(F)(F)F,0.277
O=C1OCC11CCN1,0.2373
CCC1(C)C2C3OC2C13,0.2976
CC(CO)CN(C)C=O,0.2723
O=C1C2C3C(N13)C21CN1,0.2494
CC(C)C(CO)C(C)=O,0.225
N=C(C#C)N1CC(=O)C1,0.1965
CC1=CC2C3C4C(C13)N24,0.2344
C1C2CN=C3OCOC123,0.2679
CC1(CC#C)OC2CC12,0.2852
N#CC12CCN3CC1C23,0.2678
C1C2C3OCC3=CCN12,0.233
OCC12CC1C1CC1O2,0.3101
CCOC(=O)C1CO1,0.2629
CC12C3C4C5C(C15)N2C34,0.3037
OCC1=NC(=N)OC=C1,0.1739
CCC1OC2COC12,0.308
NC1(COC1=O)C1CN1,0.2478
Cn1c(c[nH]c1=O)C=O,0.1616
C#CC12CCN1CC=C2,0.2317
CCC1(O)C(C)C1CO,0.312
CN=C1OC(N)=CC=N1,0.1651
C#CC#CCCCC#N,0.2293
c1nc(n(n1)C(=O)N)O,0.2259
CCN(CC)C(C)C#N,0.2577
CC1C(C#N)C1(C)C=O,0.2211
O=CC12CC(CO1)C=C2,0.2215
C1OCC11C2COCC12,0.3151
OC1CC2CCN2C1=O,0.2575
CC1=CCC2CC2CC1,0.2538
CC1C2(C)CC1(C2)C#N,0.326
OC1C2CC(NC=O)C12,0.2793
CN=COC1COC1=O,0.2421
CC#Cc1c[nH]c(n1)N,0.2067
C1CC11CN2CC(C2)O1,0.3005
CC#CC1CNC(=O)C1,0.2695
c1c(ncnc(=O)n1)N,0.1656
CC1C(C)C1C#CC#N,0.2234
C1CN1c2nc([nH]n2)O,0.2501
c1c(=O)[nH]nc(n1)F,0.1603
[NH3+]C1CCOC1C([O-])=O,0.2662
CC1(CO)CC(O)C1=O,0.196
c1c(noc1N(=O)=O)N,0.158
Cc1c(cc(cn1)N)F,0.1958
CC#CC(=O)OCC#N,0.2327
OC1C(NC1=N)C#N,0.2706
O=C1CC2(CO2)CCO1,0.2736
CCCc1c(cno1)N,0.2078
c1cc(c(cc1N)F)N,0.1856
Cc1cccc(c1)F,0.2314
O=C1C2OC1C2CC#C,0.245
OC12CC(N3CC13)C2=O,0.2171
COCCCCC#N,0.2969
C#CC12CC(CC1)O2,0.2698
CCCOc1cc[nH]c1,0.2401
CC(C)C1CC11COC1,0.3056
CN=C1NN=CC=C1,0.1536
CC1C2(C)C3OC3C12C,0.2817
CCN1C2CC1C2OC,0.2908
CN1CC1C12CC1OC2,0.2929
OC1CC2C3N4CC13C24,0.2892
CCc1cocc1N,0.2256
CC12C3OC1C3CC2=O,0.2111
CC(=O)C1C2CC=CC12,0.2131
CC1OC11CCN2CC12,0.3143
CC(C)N(C)C(=O)NC,0.2905
CC(=O)CC1CC1CO,0.2337
O=C1COCCC11CO1,0.2053
CC1CN2N=CC(N)=C12,0.2259
CC12CC3C(CC13C)O2,0.32
c1c(c(c([nH]1)N)C=O)N,0.1585
O=CC1OC11CN2CC12,0.2053
CC(C)C1(O)CC1O,0.3143
N=C1OC2CNC(=O)C12,0.2561
N=C1NC(=O)C(=O)C=C1,0.1478
CCCN1CCC1=O,0.2785
O1N=CC=C2C=CN=C12,0.1364
OC1C2CN3C2C13C=O,0.219
CC(C)(C(C#N)C#N)N,0.2605
COC1(CC1C#N)C#N,0.2805
OCCOCC1CC1O,0.3297
CN1CC(N)(C#N)C1=N,0.243
COC(=O)NCC(C)O,0.3077
CC12CN(C1)CCO2,0.2883
C(=O)c1nc(c(o1)N)O,0.142
CCN(C=O)C1CC1C,0.2637
CCC1C(=O)COC1=O,0.2128
CCC1C2CC3CC3C12,0.3131
O=CCOC1CC2NC12,0.2118
NC(=O)NC1CC2CC12,0.2976
CCC(O)(C=O)C(N)=O,0.203
CC1OC(C)C(C)O1,0.3368
CC1CCCC1(N)C#N,0.2865
CC1CC2=NON=C2N1,0.206
CC(=O)c1nc(co1)O,0.1688
CC1C2CC1(O)C2CO,0.3129
OC(C1CO1)C1CC1O,0.2967
CC1C2C3C2(O)CC13C,0.3208
OCC1NCC1(O)C#C,0.2551
CC1CC2CCCC12O,0.3254
COC1(C)OCCC1=O,0.2168
C1CCC2(C1)COC2=O,0.2807
CCC1CN2CC2CO1,0.3051
CCCC(C)C#CC,0.3034
CCOC(=NC)C1CO1,0.2517
CC1CN2CC2(CO)C1,0.3083
c1c(cc(cc1N)F)N,0.2189
O=CNC1C2C=CC1O2,0.2298
OCCC1C2CCC12O,0.3235
c1c2c(c(o1)N)OCO2,0.223
CNC(C#N)C1(C)CO1,0.277
C1COCC(=O)N1C=O,0.2072
CC12COC1CC2C=O,0.216
c1c([nH]cn1)OC=O,0.2198
CN1CC2(NCC12)C#N,0.2321
OC1=C(F)C=COC1=N,0.1684
c1c(cc(nc1N)F)F,0.2161
c1c(=O)occ(n1)N,0.1359
CC1C2C3N2CC13CO,0.2892
CCC1(CN1C)C#CC,0.2723
CC1=CC2CC(CO2)C1,0.2461
CCN1CC1CC#C,0.2776
CC(O)(CC=O)C1CO1,0.2231
CC1(C(=O)CN1C)C,0.2021
CC1(CO1)C1C2CCN12,0.3122
CC12OC1C1C3CC1C23,0.3261
Cc1ccncc1O,0.2124
CC1(O)CC1(C)CC#N,0.308
OCC1(CC(=O)N1)C#C,0.2704
O=C1OCC2C1C1CN21,0.2446
c1c(c[nH]c1O)O,0.2362
NC1=NC2C3OC1C23N,0.2226
CC1(CC(N1)C#N)C#C,0.262
CCC1C(C)C1C#CC,0.2794
C1C2OC1C1=C2CCC1,0.2275
CC1(CC=O)C2CC1C2,0.2246
Cc1ncnc(n1)OC,0.2245
OC1C2COC1C(=N)N2,0.255
OCC1C2CC1C21CO1,0.3261
OC1C2OC3CC1OC23,0.2943
CC1(C)C(CC1=O)C#C,0.2177
C1CCCN(CC1)C=O,0.2672
O=C1C=CC2C3OC3C12,0.1857
O=C1CC2C3OC2C3C1,0.2191
CC12CC3(C)OC3C1N2,0.3009
C1Cc2c(n[nH]n2)C1,0.2423
O=C1NC2C3CC3C12,0.2616
CC1=C(C[NH2+]C1)C([O-])=O,0.1517
CC1NC2C(OC12)C=O,0.2055
OC1CC(=N)OC1C#N,0.2705
CC12CC(OC=N)C1O2,0.2735
O=C1OCC2OCCC12,0.2687
OC1=CC=NC(=N)O1,0.1727
COC1CCCC2NC12,0.3105
CC(=O)C(C#N)N1CC1,0.2209
CC1C2CCC2C1(C)C,0.3336
CC12CC(C1)C(CO)C2,0.34
OC1C2OCOC1C2O,0.2921
N=CN1CCOC1=O,0.2481
N=C1OC2CC1N=CO2,0.2649
CC#CCCOC(=O)N,0.3028
CC12CC1OC2C1CO1,0.3054
CC12CC(=O)CCC1N2,0.2211
C1C2C3C4C3C1N1C4C21,0.3071
CN1CC(C1)(CO)C=O,0.187
O=C1CC2OC(C1)C=C2,0.2273
C#CC1(NC1C#N)C#N,0.2486
C1C=CC2NC12,0.247
CCN(C)c1cnon1,0.1943
CC12CC=C3C=CC1C23,0.1752
CC12OC3C1CC23,0.3158
Cc1c(ncn1C)C=O,0.2038
CC1(CC1)C1OCC1=O,0.2187
O=C1C2NC1C1CCC21,0.229
N=C1OCC2=C1ON=C2,0.2048
N=C1CN=C(N1)C1CO1,0.2196
CCC1=C(COC1=O)C,0.2304
OC1(CCC1=O)C1CO1,0.2181
O=C1OCC2NC2C1=O,0.1842
C1CNC2=C(C1)N=NO2,0.1697
CC(=O)N1CC2(O)CC12,0.2569
CCCC1(C)C(C)N1C,0.2866
O=C1OC2C3OCC3C12,0.2616
CCC12C3C4OC1C4N23,0.3034
OC1C2CC3(CO3)C1O2,0.3168
OC12C3C1C1=NC2CN31,0.1264
O=C1NC2CC3OCC123,0.2652
C1C2CN=C3OCC3N12,0.2422
COC1CN2C(C#N)C12,0.267
C(=N)NC(=O)NC=N,0.2279
CC1(C)C(O)CC11CO1,0.3206
N=COCC1=NOC=N1,0.2302
C#Cc1cc(ncn1)O,0.2056
CCOCC(C)(O)CC,0.3306
CC1CC(O)(C1)C#C,0.2874
CC1CC1OCC#C,0.2791
CCc1c(nn[nH]1)C#C,0.2253
O=CC12NC1CN1CC21,0.193
CCC1(O)C(C)NC1=O,0.265
CC12CC(C1)C(=N)O2,0.2865
O=C1OCC2CN2C=C1,0.2043
CC1OCOC(=N)C=C1,0.213
CCC(C)C([NH3+])C([O-])=O,0.2655
CC1C=CCOC1C=O,0.2282
CC1(C)CC(CO)C1O,0.3017
CC#CC1CC11CCC1,0.2768
CCC(CC)CC(C)O,0.3302
C#CCC1=CCCOC1,0.26
CC1C2(C)C3CN2C13C,0.3068
N=COC1COC1C#N,0.2697
CCC12CC(C1)CC2C,0.3667
CN1C=NOC1=N,0.2268
COC1COC11CC1,0.2996
CC12CN3C1C=CC23,0.2077
CC(=O)C12C3C4C3N1C24,0.2022
CC(C)C1CCCC1=O,0.2186
C1C2C3CC4C(O3)C4N12,0.3056
CC12CC1CO2,0.3155
C1CN2C1=CC(=O)CC2,0.1894
COC1=CON=CC1=N,0.1712
CC(C)C1(C)CN=CO1,0.2724
CC1COC(CC#C)C1,0.2983
CC1(C)COC(=O)C1O,0.2767
CC1CCCC(C)(C)O1,0.3185
CC1(OC1C1CO1)C#N,0.29
CC(C)(C)c1cocn1,0.2461
OCCC(CC#C)C#N,0.3023
COC1C2CC(N2)C1=O,0.198
CC1COCOCC1=O,0.2134
CC1CC2CC(C)(C)C12,0.3332
CC12CC(C)(CC1)C2O,0.3102
O=C1OCC2C3CC3N12,0.2834
N=C1OC2C3CC3OC12,0.2619
CC1(CC(C1)CC=O)C,0.2272
CC1=CC2(CC1C2)C#C,0.2367
NC1CC(CO)OC1=O,0.252
CC1C2(C)OC1(C)C2O,0.2999
CCn1c(ccn1)C#C,0.2118
C(c1c(nno1)C#N)O,0.2202
C1OC1C1(CO1)C1CO1,0.3231
OC1C2CC1(N2)C=O,0.2067
CC12CC1C1(C)OCC21,0.3141
O=C1CCC11OC1C#C,0.2018
N#CCC(C#N)C1CC1,0.3291
CC1CC(=O)C(=O)N1C,0.1734
CC1CC23CC(CC2)C13,0.3015
CC(=O)C1(C)OCC1=O,0.1942
N=C1OC2C3OC1C23,0.242
OC1CC1C(=O)C#N,0.1796
c1cnn2c1ncnn2,0.1587
N=C1NC(=O)C=C1,0.1865
NC(=O)CC(O)C#C,0.2535
CC1C2N(C)CC12O,0.2708
COC1C2CC1C(=N)O2,0.2761
CCOCC(=O)C#N,0.1977
N=C1NC2CC2CC1=O,0.1638
N#CC1CC2OCC12,0.2797
C1C=CN(C1=O)CCO,0.2092
CCNC(=O)C(C)CC,0.2762
CC12COCCC1N2,0.3131
OC1COC=NCC=C1,0.2275
OC(CCC#N)C1CN1,0.2859
CCC1=CCC(=O)CC1,0.2231
Cc1cnc(nc1O)N,0.204
CCC1=COC(=N)N1,0.2222
CN1CC1C(C=O)C#N,0.1932
O=C1CCN2C(C#C)C12,0.2116
CC(C)(C(=O)COC)O,0.2304
CC1=CC(=[NH2+])O[CH-]C1=O,0.1161
CNc1nc(on1)NC,0.2412
C1C(=NO)CN1C(=O)N,0.2372
c1cc(nc(c1F)F)N,0.1922
CC1(CC#C)CN1,0.2975
OC12CC3OCC1CC23,0.3148
c1conc1NC=N,0.2198
CC12NC(=O)C3OC1C23,0.2332
CC1(N)CC1(C#N)C#N,0.2653
NC1=NC2CNC1C2=O,0.2015
OC12CCC3C1N3C2=O,0.235
CC(=O)Nc1ccn[nH]1,0.2132
c1cc([nH]c1)CNC=O,0.2144
CC(=O)C(=O)CCC=O,0.157
c1c[nH]c2c1c(n[nH]2)N,0.2202
CC(=O)C1=NCCN1,0.1702
OCC1=CC2OCC2C1,0.2514
CC1C(O)C11CC(C)O1,0.2829
NC1CC1(O)C#N,0.2537
CC(=O)C1(C)CC1C#N,0.2259
Cc1cocc1N(=O)=O,0.1764
CC1(O)CC(C=C1)C#N,0.2655
c1(nnon1)OC(=N)N,0.1858
CNC1C(O)COC1=O,0.2548
C#CC12CCC1C1OC21,0.275
CC1C=CCC2OC12C,0.2685
OCC1=NCC(N1)C=O,0.1989
CC1OC11CNC1C#C,0.2693
CCC1(CC#C)CO1,0.3053
CC1OCCC(=N)O1,0.2779
CCC(C)C1CC(O)C1,0.3303
CC1=CCCC1CCO,0.26
CNc1cnnnn1,0.171
CN=COc1nc[nH]n1,0.2377
C(C1CO1)C1=CC=CN1,0.2406
NC1=C(NN=N1)C1CN1,0.21
OC1CC1(O)CC=O,0.2214
O=CN1CC(=O)C1C#N,0.2072
C1C(CC12CC(=O)C2)O,0.2208
CC12NCC1(C#N)C2O,0.2555
O=C1OC2CCC1CO2,0.2745
CC(C#N)C#CCC#N,0.2854
CC(C)(C)OC1CC1,0.3162
CC#CCC1(CC1)C,0.3002
O=C1CCCC2CC12,0.2254
CC12COC3OCC1C23,0.331
CC1(CO)COCC1=O,0.2125
Cc1cc(n(c1N)C)O,0.2363
CC1=CC2(CC2)C2CC12,0.2348
CC1=NC(=N)NC=N1,0.1817
CC12C3C1C1C3C=CC21,0.246
CN=C1C(=NC)OCO1,0.2244
CC12CC3CC1(O)C23,0.3025
c1cnccc1CC#N,0.2265
COC(C#N)C(O)C=O,0.2359
CC1(C)CC2(CO2)C=C1,0.2506
N=C1C=CNC(=O)C=N1,0.1513
CCc1cc(n[nH]1)O,0.2438
CC1CC11COCC=C1,0.2502
CC1C2C1C(=O)C2O,0.2236
CNc1cccnc1O,0.1899
CCC1(O)C2OC(C)C12,0.2905
CC1(COC1=O)OC=N,0.2527
CC1N=CNC1=O,0.2298
C1OC11C2C3CN=C1N23,0.193
C1CC(=O)C(=NC1)N,0.1722
C1C(CO1)(CC#N)O,0.2771
OCC(O)(CC#C)C#N,0.2873
OCC(=O)C1C2CN1C2,0.2225
CN1CC1C(O)C(C)=O,0.2015
Cc1c(nc[nH]1)CCO,0.2427
CC(C)C1CC(C)(C)O1,0.3156
C1C2OC3CCC=C3C12,0.2457
CCCCC1(CCC1)O,0.3257
CC(C)(C)C12CCC1O2,0.3228
CC1CC2(CC2)C2CC12,0.3288
CNc1c[nH]ncc1=O,0.1638
CC12CCC1CC2C#C,0.2974
OCC12OC1C1CC21,0.2807
CC12CC1C1CC1C2=O,0.2147
CC1(CC1)n2nccn2,0.2552
NC(=O)C#CCC1CO1,0.2322
CC(=O)CC1NC1CO,0.23
CC1OCC(C#C)C1=O,0.2107
CC1NC2COC1C2=O,0.1946
CC12CC(C1)(NC2)C#N,0.2654
CC(O)C1(CC#C)CC1,0.3077
CN1CC2CC3OCC123,0.277
C#CC12OCC3CC1C23,0.2588
OCCC1OCC2CC12,0.3339
C#CC(C#C)C(F)(F)F,0.2958
CC(O)CCC1CC1O,0.3257
COC1(C)CC2CC12O,0.3225
CC1COC(OC1)C=O,0.2247
CCC(O)C1CC1(C)O,0.3187
OCC1C2CCC1C2=O,0.2283
c1coc(n1)N2CCC2,0.2265
N#CC1NC11CCOC1,0.271
CC1C2C3OCC2(O)C13,0.3015
CC#CC1C2NC2C1C,0.2806
c1nc([nH]n1)CO,0.2715
c1c(noc1N)C=O,0.1697
CC#CC(C)(C)C#C,0.2862
c1cocnc1=O,0.2076
C1C2C=CCC3COC123,0.2397
CCC1(O)CC2OC2C1,0.3257
CC(C1CC1)C(=O)CO,0.2353
N=CN1C=CC(=O)C1=O,0.1507
Cc1cnccnc1=O,0.1586
C#Cc1cc(c[nH]1)C=O,0.1836
COC1CCOC1C=O,0.2242
COC(C)C#CCC=O,0.2198
C1N2CC11OCOCC21,0.3104
CC(=O)C12CC1OC2=N,0.2264
CC(C)CCC#CC=O,0.2054
CC1CC2C3CC3C12,0.3105
C1CN=C(C1=O)OC=O,0.1783
CC12CN3C(C13)C2C#C,0.2754
CC1C(O)C11CC(=N)O1,0.2758
O=C1C2OC2C1C1CN1,0.2024
CC1CC2(C)CCC1C2,0.3536
CC1C2CC1(C)C(=N)O2,0.286
CC1CC2N=COC12,0.2622
COC1CC(CO1)C=O,0.2294
C[NH2+]C12COC1[C-]2C=O,0.1691
CC1C2OC2C2(C)OC12,0.3206
O=CC12CCC1CC2=O,0.2015
c1nc(c(o1)N)C=O,0.1935
CC1C2CC1(CC#N)N2,0.2818
CCOC(C)C#CCC,0.2894
CC(O)CC(O)CO,0.2997
C1COCC=C1NC=O,0.2153
CC(C=O)C1CC2NC12,0.2224
CC(O)C(C=O)N(C)C,0.1813
OC12CC3CN4C1C2C34,0.269
ON=C1COC(=O)C1O,0.2358
CCC12CC1C1C(C)C21,0.2814
CN1C=CC([O-])=CC1=[NH2+],0.2016
C1C2OC3(CN4CC34)C12,0.3047
COCC1CCOC1,0.3318
CCC12CCC(CC1)O2,0.3236
COCC(C)CO,0.3273
Cc1ccc([nH]1)C2CC2,0.2303
OC1(C#N)C2CN2C1=O,0.2146
OC(C1CN1)C1CO1,0.31
OC1CCC2COC2C1,0.313
OC1CC1C1=COC=N1,0.2185
[NH3+]C1(CCC1O)C([O-])=O,0.26
OCC1C2CC(CO)C12,0.3174
OC1COCCCC=C1,0.2535
CC(C#C)C1CC(=N)O1,0.2904
CC1(C#N)C2OC(=O)C12,0.2589
CC(O)CC1CC2CC12,0.3195
OC1(CC#N)COC1=O,0.2598
NC(C#N)C1C(O)C1O,0.2755
CC(CO)C(=O)CC#C,0.2192
CC1(C2(CC2)C(=O)N1)C,0.2788
CC1(CN1)C1(CO1)C#C,0.2727
c1cn[nH]c1OCC#N,0.2262
Cc1ncc(o1)NC=O,0.2375
OC1COC(=O)N2CC12,0.2669
CC1OC23CN(C2)C13,0.2565
CCn1c(nnc1O)O,0.2693
CCC1(OCC1C)C#N,0.2805
C#CCn1nc(nn1)O,0.2334
CC1(CC1)C1CO1,0.3588
CC12CC(=NO)C1C2O,0.2425
CC1(C)CN(C=N)C1=O,0.2263
CC1CCC(=O)CC1=O,0.2107
CC(NCC#C)C#N,0.2652
CC1OCCC1CCO,0.3156
CC#CCC(=O)NC,0.2745
OC(C1CO1)C1CCC1,0.3405
Cc1c(cnnc1N)F,0.1936
COc1coc(n1)N,0.2233
C#Cc1cc[nH]c1CO,0.2131
CCCCC(C)(C)O,0.3261
N=C1NC2CC1OC2=O,0.2391
C[NH2+]CC1OC1C([O-])=O,0.2573
Cc1cc(cnc1)C#C,0.2005
Cc1cncnc1C=O,0.168
CC12CC3(O)CN1C23,0.2933
C[NH+]=C(N(C)C)C([O-])=O,0.1902
CC(=O)C1CNC(=O)N1,0.2178
CC1C2CC2CC1=O,0.2224
CC1C2C3CC1C(=O)C23,0.2267
C#CCOC=NCC=O,0.2218
Cn1ccc(n1)C(=O)N,0.2284
CC1OC(C)C1(O)C=O,0.2104
C#CCC#CCC1CO1,0.2896
COC(=O)C1OC1C#N,0.2558
CC1C=C2COC3C1C23,0.1994
C(C#CC=O)OC=O,0.2034
CC(=NC1CC1)NC=O,0.2175
CC1(CCC1)C(N)C#N,0.2809
OC12CC(OCC1)C=C2,0.2479
CC12OCC3C1N3C2=O,0.2268
CC1CN2C(CO)C12C,0.2999
c1nc(no1)C(=O)CO,0.1942
CCC(C)C(C#C)C#N,0.2979
Cc1cnc(c(n1)F)C,0.2058
CCC(C)C1COC1C,0.3135
OC12C3C1C1=CCC2C31,0.158
CC(CO)C1CC(=O)N1,0.2828
C1CC2OC(C1)C=C2,0.2467
OC1CC(O)C1OC=O,0.257
OC12C=CC3C(C13)C2=O,0.2112
C1CC=C(CC=C1)C#N,0.2216
COC1CN=C(O1)C#N,0.227
C1C2COC3CCC3N12,0.2914
ON=C1CC(O)(C1)C#C,0.2457
N#CC12CC1OCC2,0.2834
CC1=CC2CC(C2)OC1,0.247
C1OCC2OC3C1C23,0.3086
CCNc1cc(co1)C,0.2209
CC1C2C1C1(C)C(C)C21,0.2792
CC1CC1(O)CC1CO1,0.3129
OC1C2C3C1C2C31CN1,0.3108
CC1CC2(C)CCC12O,0.3168
CC(O)C(O)CCC=O,0.2289
OC1C2CC1O2,0.3019
c1(=O)[nH]nnc(n1)O,0.1714
O=C1COC1C#N,0.2248
CC1C2C(O)C(=N)N12,0.2405
CN1CC(=O)C2CC12,0.2026
OCC1CC(O1)C1CN1,0.3058
CCNc1cnc(o1)C,0.2165
OCC1COCO1,0.3371
O=C1COC2CCCC12,0.217
COC(CO)C(=O)C=O,0.1446
CCC(OCC=O)C#N,0.2293
CCNc1nc(no1)N,0.2428
FC(F)(F)C1NC1C#N,0.3023
CC1CCC(C)=C(C)C1,0.2544
CC12CC(O1)(C=O)C2=O,0.2106
c1coc(c(c1=O)F)F,0.205
N=C1ON=NC(=N1)C#C,0.1471
OCCC(O)C#CC#C,0.2239
OC1=NC(=N)N=C(O)N1,0.2229
c1c(coc1CC=O)N,0.1746
C1C(CN1CC#N)C#N,0.266
Cc1coc(=O)c(=O)[nH]1,0.1764
CN=C(NC=O)N1CC1,0.2249
C1CN2C3C4NC4C1C23,0.2755
CC1OC11CCCC1C,0.327
CCCC1OCC11CC1,0.3158
CCC(C=O)C#N,0.2291
OC1C2CNC2=CC1=O,0.2009
O=C1OCC2N3CC12C3,0.2297
CC(=O)C1=C(COC1)N,0.1823
CCC(OC(C)=N)C#N,0.2933
COC1=CN(C)C(=N)O1,0.2208
OC1(CC1)C1CC(=N)O1,0.2871
CNc1nc(n(n1)C)N,0.2253
OC1CCCOC(=O)C1,0.2706
CC1CC2C1COC2=N,0.2788
CC(C)(C)C12CC1CO2,0.3076
CCCC1(CC1)C#C,0.2958
CC1CCC2C3OC1C23,0.3045
CC1C=C(C)C(=O)C1O,0.1969
c1c[nH]nc1C#N,0.2425
O=C1OC2CNC1CO2,0.248
CCC1(O)CCOC1C,0.3045
COC1C2CC2N2CC12,0.2922
OC1CC1C#CC=O,0.2005
CC1(C)CN=C(CO)N1,0.2541
COCCC1(CC1)C#N,0.2938
CC12CN3C1C2OC3=O,0.2622
CC(=O)C(O)CC#C,0.2347
OC1CCC2=C1C=CN2,0.2419
O=COC12C3C4C1N4C23,0.2215
OC1CC1C1=NC=CO1,0.2304
CC1CC2(C)C(C#N)N12,0.259
C1C2CCC3=C2N1N=N3,0.1852
COC12CC1C(O)C2,0.3142
O=C1CNC2C(C#N)C12,0.1977
C1C2CC11CCC3C1N23,0.2471
CCCc1c(cco1)N,0.2163
OCC1=COC(=N)C=N1,0.1592
CC1=C(C)C2(CO2)CC1,0.2442
CC1C2OCC12O,0.2887
CC(C)C(C)(O)CC=O,0.2215
C(CCO)CC#CCO,0.2786
COCC(=O)C1OC1C,0.2172
CC1=CC2(O)CC2C1=O,0.1874
CCCN(C)C(=O)C,0.2676
COC(C)CC#CC=O,0.2057
O=C1O[C-]2C[NH2+]CC2=C1,0.1114
CC1(O)C(O)CC1C=O,0.2185
C1C2C3C4CC=C3C2N14,0.1582
Cc1ncn(n1)CC#C,0.2645
CC1=CCOC1C=O,0.2014
CC1OC11C2CN2C1=O,0.2175
CC12CC1C1(CN21)C#N,0.2416
CC(O)C1(C)C(C)C1C,0.3214
CCOCCCO,0.3279
OC1(C#N)C2OC(=N)C12,0.2486
COC1CC1C(C)=O,0.2326
OC1C2CC3CC(O3)C12,0.2986
NC(=O)C12OC3CC1C23,0.2613
COC1(C)OC2CC1C2,0.34
NC1C=CCC1(N)C#N,0.2447
CCC1OC1CC=O,0.225
CC12CC(C1)(C=O)C2O,0.2162
Cc1cc(no1)C(C)C,0.2468
CCC12C3C4N3C1C24C,0.2729
CC12CC1C(=O)CO2,0.2159
C1C2CC11CC3OC2C13,0.2997
CC1COC(=O)N2CC12,0.2679
COC1OCC(=O)C=C1,0.1773
COC1(C)CC(C)CO1,0.3405
OC1CC2CC2C11CN1,0.3062
COCC#CC1CC1,0.2754
C1C2C3CC3C3OC3C12,0.3209
CN=C1OC(C)CC1O,0.2669
CC1(C)C(O)C1(C)CO,0.3116
CC1(C)C2C3N2CC13C,0.303
OC1CC11C2CC1C2,0.3136
CC1OCC2(CN2)CO1,0.3189
O=CNC1C2C3CN3C12,0.2526
CC(C#C)C(=O)C(N)=O,0.1737
C#CC1(CCC1)C1CO1,0.3024
OC12CC(C1)C(C2)C#N,0.3036
CC1C2N1CC21CO1,0.3101
CC1CC2(C)C(C=O)C12,0.216
CC1=C2C3C4C2C(C1)N34,0.157
Cc1ccoc1NC=O,0.2057
CC1=C(C)C2(C)CC1O2,0.2319
CC1C2OC3(C)CN1C23,0.2794
COC1CC1N1CC1,0.2928
C1C2C3OC4C1C2OC34,0.3045
CC1OCCCOC1=O,0.2551
OC1CC2OC1C(=O)O2,0.2645
CC1CC(C)(C)C2CC12,0.3429
OC12CCC1C=CCC2,0.2623
Cc1c2n(nn1)CCO2,0.2316
O=C1CNCC2COC12,0.1818
CC1CC(C#N)C1CO,0.2859
CC(C)C1(CC1)C,0.3443
N=C1OCC=C2COC12,0.237
Cc1c2c(co1)[nH]cn2,0.1833
CCC1N(C)CC1=NO,0.2186
N#CC1C2CC(C#N)N12,0.2614
CC1(O)C2OCC2C1=O,0.2028
CC1OC1C1CCO1,0.3229
CCc1c2n(cn1)CC2,0.2509
COCCOCC(C)O,0.3193
CNC(=O)N(C)CCO,0.2915
CCC(C)C1(CC1)C=O,0.2247
CC(C=O)C1=CC=NO1,0.2084
CC1CC2=CCCC12C,0.2439
O=CC(CC1CC1)C#C,0.2202
CC(CO)CCC=O,0.2291
CC1CN2C1=COC2=O,0.2316
N=COC(CC#N)C#C,0.2786
CC1=CC(O)(CC1)C#C,0.2472
CC1(O)C2C=CC1C2=O,0.2455
CC1N=COCC1=O,0.2027
CC(C)(O)C1NC1C=O,0.2243
COC1C2C3OC1C23,0.3054
CC(C)CN1CC1C#C,0.2629
OCCOC12CN(C1)C2,0.3223
CCOc1c([nH]nn1)C,0.2168
N#CCC1C2C3CC3N12,0.2619
NC(=O)C1CNC1C#N,0.2506
OC(CCC#C)C1CC1,0.3121
OC12CC(C1)OCC2=O,0.228
OC1C2OC3CC3(O)C12,0.278
OCC12CCC1(N2)C=O,0.2183
OC1CC11CC2(O)CC12,0.3007
COC(CCCO)C#N,0.2902
CC1CC11CC(C)C1O,0.3117
CN=C1CC2(O)CC2O1,0.2631
CC(O)COC(C)C#C,0.302
O=C1CN2CC11OCC21,0.1968
CC12CC(OC1)C2=NO,0.2466
CC1=CC(=O)N(C1)C=O,0.1959
CC1OC(C#N)C1(C)N,0.2641
CC1(O)C2CC1(C)C2,0.3272
CCN1CC1(CO)C=O,0.2089
CC1N2CC=CC12C#N,0.2269
CC1CC(C)C1CC#N,0.3335
O=CC(CC#N)N1CC1,0.2129
CC12CC(CCO1)C2=O,0.2045
C#CC1OC1C#N,0.2651
CC1OC=NC(C)C1O,0.2636
C1CC(C1)C=O,0.2229
CNC(=O)OCC1CC1,0.3155
CC(O)C12CC1(C)OC2,0.2906
OC1C2CC2C2CC12,0.3111
Cn1c(c(nn1)CO)N,0.2286
CC1(COC11CC1)C#N,0.2694
CCC(COC)N1CC1,0.3141
CCN(C)C(=[NH2+])C([O-])=O,0.1932
CC1C2C(=O)CC12C#N,0.223
CC#CCC1(CC1)O,0.2931
COCCC(=O)OC=N,0.238
CC1=CC2(CC2)OC1=O,0.214
CNc1ncc(=O)[nH]n1,0.1383
c1c(coc1N)CC=O,0.1759
NC(=O)C1(O)C2CC1N2,0.2422
c1cc([nH]c1)C#CCO,0.1941
c1cc(nc(c1N)F)O,0.1825
CC(O)CCC(O)CO,0.3154
FC1=COC(=O)OC1=N,0.2082
CCC1COC(O1)C#C,0.2937
N=COCC#CC1CN1,0.2562
OC1(CCC2CC12)C#N,0.3027
C1C=CC(=O)CC(=O)N1,0.1793
Cn1cnc(=O)nc1F,0.214
CCC1(O)C2OC2C1C,0.3186
OCCC1(O)CN2CC12,0.289
CC12CC1C(=CC2)C#N,0.2081
Cc1c(cccc1O)O,0.2159
CC1C2CC2C2COC12,0.318
FC1=CC(=N)C=NO1,0.1814
CN=C1OCC1(C)C#N,0.2696
COC1(C#N)C(C)C1C,0.2812
CCC1=CC2CC2C1C,0.243
OCC1=CN=CC(=N)O1,0.1597
C1C2C=CC(C12)N1CC1,0.2473
N#CC1C2CCC12C#N,0.2813
CC12OCC1(C#N)C2O,0.2646
c1(nnon1)NC(=N)N,0.1624
CC1CC1CNC(C)=O,0.2768
CC1N=COC1CC#C,0.2667
CCOCCCCC=O,0.229
CC12CN=COC1CO2,0.2637
CC1(OCC11CN1)C#N,0.2652
CCOC(C)C1CC1,0.3334
CC12CC3(C)C4C(C14)C23,0.3275
CN=c1cconc1N,0.1769
Cn1cc2c(c1)ocn2,0.2002
CC1C2CC1(C)C(O)C2,0.3372
CCC1=CC2CC1C2C,0.2367
OC1CCOCC1C#N,0.2998
CC(=O)NCC(=O)CO,0.2077
CN1CCC1=O,0.2809
CCOC(=O)N1CC1,0.2896
Cc1c(c([nH]c1O)C)N,0.2174
CC(O)C1CC(C)C1=O,0.2185
Cc1c(oc(n1)C#C)N,0.174
O=C1CC2C(C#C)N2C1,0.208
N#CC1OC2CC12C#N,0.2613
COC1C2OC2C11CO1,0.3144
CC12C3C1N1CC2C31,0.2912
c1c(nco1)N,0.2164
O=CC1CN(C=O)C=C1,0.1815
C1CC=CCOC1,0.2622
Cc1cc(oc1C=O)C,0.1825
COCC1(N)CC1C#N,0.2721
C1CC1(C=O)N2CC2,0.2014
OC1(C=O)C2C3C1CN23,0.1904
COC(=O)NCC#C,0.291
NC1=CNC=C1C1CO1,0.2262
CC1N=CN2C1CC2=O,0.2318
CC12CN3C(C13)C21CC1,0.3066
CC1OC1CC(C)=NO,0.253
c1c(con1)CCO,0.2461
CC1CCC1C(O)C#C,0.2895
CNc1c(nccn1)N,0.1809
CC12C3NC1C(=O)C23C,0.221
CCNC(C#N)C(C)N,0.2842
COC1(C)CC1(O)CO,0.3048
CC1OC1C1CCC1=O,0.2227
CC1OC2C(O)C1C2=O,0.2059
OC1CC2CC1(O2)C=O,0.2184
Cc1c(c(n[nH]1)O)CO,0.241
CN=CN(C)C=O,0.236
CC1C2OC1(C)CC=C2,0.2413
CC1C(O)CC1O,0.3141
CC1OC2CCC1C2O,0.3179
OC1C2OC1C2CC#N,0.2961
CC1(CC1)CC(=O)C#C,0.196
CC1=CC(CO)C(=O)C1,0.2165
COCC(=O)C(=O)C=O,0.1174
CC1NC11CC(O)C=C1,0.2295
CC1OC(C)C(=O)C1=O,0.1325
OC1=NC(=N)N=C(O)O1,0.2337
O=CC1CCN1CC#N,0.1909
O=C1CC2CC3CC3N12,0.254
CC(CO)(CO)C1CO1,0.3036
OC(CC=O)C1CCC1,0.2227
CC1CC(N)=CC1=NO,0.1898
OC1C2NC(=O)C12,0.2531
CN1C2CC3COC3C12,0.2794
OC1C2OCC3C2C13O,0.3198
CN1C2CC(CO)C12,0.3026
C#CC#CC1NC1C#C,0.215
OCCN1C2CC(O)C12,0.3009
CC12OC1(CC=C2)C#C,0.2415
CCC1CCC(O)C1=O,0.2195
NC(C#N)C1=CNC=N1,0.2536
CC1(CN1)C1NCC1=O,0.2152
CC(C)C#CC(C)C,0.3016
CC1COC(C)=N1,0.2709
OC12CC1C1NC21C#C,0.2344
OCC12CC3C(C1)N3C2,0.299
CCCCCC(=O)C#C,0.208
COC(C)C#CC#CC,0.2202
COC1C2CC(O2)C1=O,0.1924
CC1=CC(=O)NN=N1,0.1802
O=COC(C#N)C1CC1,0.28
CCNC(=O)N(C)C=O,0.2502
CCC12CCC=CC1O2,0.2393
C#CCCC(=O)C(=O)N,0.1769
CC(C=O)C1CC(=O)N1,0.2175
COC1CC(O)C(C)O1,0.3324
c1c(nc(c(n1)F)N)N,0.1745
NC1COC1=N,0.2687
CC12COCC1(O2)C#C,0.2717
CC1N=C(N)C(=O)C1O,0.1821
O=CNCC1NC1C=O,0.2208
C#CC1(CC1)CC#N,0.2833
CC12C3C1C1C3CC=C21,0.1614
CNC(=O)C1CCOC1,0.2721
CCn1cc(c(c1)O)N,0.2249
OC1CCCOC1C#N,0.2861
CCC(C)(C=O)C#N,0.2299
CC1C2C(O)C(O)C12O,0.3078
OC12CC1(CC=C2)C#C,0.2301
CC1=CCOC(=N)CC1,0.2502
O=C1OC2COC2C=C1,0.2088
CCCc1nc(on1)N,0.2509
CC1N(CC1(C)O)C=O,0.2642
CCNc1c(nno1)O,0.1835
C1CC1,0.393
CC1CC2COC12C,0.3118
OC1C2C(=O)C1C21CO1,0.2525
CCCCN(C)C(=O)C,0.2671
CC1CC1OC1CC1,0.318
CC1CC(CC1O)=NO,0.2497
O=CC1CC11COC1=O,0.2232
OC1C2CC1(O2)C1CN1,0.297
COCC(CO)OC,0.3355
CC1(CC1)OCC#N,0.2822
COC12CC(C1)C(O)C2,0.3201
CC(=O)N(C=N)C=O,0.2196
OCC1C2NC2C11CN1,0.296
CCNc1nc(co1)C,0.2324
c1nc2n(n1)C=CCC2,0.206
O=C1CN=CN2CC12,0.198
CC12CC1C1(NC21)C=O,0.1838
OCC1CN(C=O)C=N1,0.2185
CC1CC(CO)(N1)C#N,0.2608
CC1OC(=N)C2(CC2)O1,0.267
CCC1CC11C2CC1C2,0.3506
CC1(CC(=O)C(=O)C1)C,0.1445
CN1CCN=COC1=O,0.2495
C1COCC(CO1)C=O,0.2122
COCc1cnccn1,0.1973
c1cc(ncc1CO)N,0.1964
Cc1c(=O)[nH]cc(n1)O,0.1481
CC#CC(O)CC=O,0.2197
C(C#N)OCC(=O)C#N,0.2125
OC1CCC2(OC12)C#C,0.2708
C1CC1(CO)OCCO,0.3205
CC(=O)n1ccnn1,0.212
OC1CN2C(CC12)C=O,0.2034
OC1C2CC2C2OCC12,0.2995
CCC(CC)C1CO1,0.3458
OC12CC1N(CC#N)C2,0.2529
C1OCC11C2CCOC12,0.2969
CN=CNC(=N)C=O,0.1803
CC1OCCOC1CO,0.3203
Cn1c(=O)[nH]nn1,0.2255
C#CCC(CC#C)O,0.2862
CC1NC2(COC2)C1=O,0.2096
N=C1COCCN=CN1,0.227
CCCC(O)(CC)C=O,0.2251
OC12COCC1C2C=O,0.2184
OC1CN2C3CC=C1C23,0.2086
CCC(O)C1CC=CC1,0.2654
CCCC(=O)OC=NC,0.2442
Cc1nnn(n1)CC#C,0.2568
COC(=O)C(N)C1CN1,0.2417
CNC=Nc1n[nH]nn1,0.2095
O=CC12CC1NC(=O)N2,0.2095
CC(=O)NCC(=O)OC,0.2423
CCC12CC3C1CC23,0.3737
CC1C(O)C2CC2C1=O,0.2231
CC1COC11CC1O,0.291
N=C1CC2(CO2)CCO1,0.2828
OCC1(CCC1O)C=O,0.2178
CC12CC3C1NC23C#N,0.2553
CC(C)(C=O)C(O)C#C,0.2211
CC1CC(CC1C)C#C,0.3063
CC12CN3CC1C23C,0.3051
OCCOC1=NCCN1,0.2746
CC1(CO)CCC=C1,0.2539
CN=COC(=O)N,0.2659
CN1CC1C1=NNC=C1,0.2291
Cc1cncc(=O)n1C,0.1664
CCC(O)CCOC=O,0.2849
CCOCCC#CCO,0.2803
NC1=[NH+][C-](C#N)C(=O)N1,0.1724
CCC(C=O)(C#N)C#N,0.2221
CC1COC(C1)C#N,0.2968
NC(=O)NC1CN2CC12,0.2913
Cc1c2c(c[nH]1)ocn2,0.1952
C1C2OC2C2N=COC12,0.2681
O=C1C2CC1C1CC2C1,0.231
CC1(CC1C1CC1)C#C,0.2892
COCC(C)C(C)C,0.334
CCCCn1ncnn1,0.2664
CCc1c([nH]c(=O)[nH]1)N,0.2258
N=COC1CCC=C1,0.2587
CCC(C)C1=NNN=C1,0.2571
COC(CC=O)C(C)O,0.2274
CCC1NC11CCC1=O,0.2145
CCC1OC2C1C2(C)O,0.294
CCn1c(=O)oc(n1)N,0.2469
CNc1ccoc1CO,0.2006
CC(=O)COC(=O)C,0.2357
O=C1OC2C3CC1OC23,0.2483
C1CC(=O)CC(=C1)C#N,0.2072
C1C2C3CCCC1C23,0.3294
CC12CC1N=COC2,0.249
CC1COC(C1)C1CN1,0.318
CC12CC1(C)C(=N)O2,0.2786
c1c(=O)c(coc1N)F,0.2051
CC1(CC1)c2cc[nH]n2,0.2467
CC1(CN1)C#CC#C,0.2202
CCc1cnnn1C,0.2511
C#Cc1cnc([nH]1)C=O,0.167
OC1CC2OC2C11CN1,0.3182
OCC1(O)COC1=O,0.2563
CC(=O)C(C#C)C#N,0.2216
CCCC#CCC1CO1,0.2967
OC1C2C3C4C3N2CC14,0.301
CN1CC1C(C)(O)C#N,0.249
CC1(C)NC2(CC12)C#N,0.2441
CC(=O)NC(=O)C#C,0.1986
OC12CCC1C(=O)C2,0.2179
CC1(C)CC11CCC1=O,0.2164
CCC(=O)C#CC(=O)N,0.2021
NC12COC1C2C#N,0.275
C#CC#CC1CC2NC12,0.2214
CCOCC1OCC=C1,0.2357
C1COCC(=N1)NC=O,0.2206
CCCCC1CC(C)O1,0.3314
CC12CC3C(C#N)C1N23,0.2795
OCC(O)C1=NON=N1,0.2041
CC(C)n1cccc1N,0.2407
OC1COC1C=O,0.2023
CN=C(C#N)NCC=O,0.1969
CC1(C)OC2CC2C1=O,0.2185
CCCC1(C)OC2CC12,0.3183
C#CC12C3CC4C1N4C23,0.2522
CC1CC23CC(O)(C2)C13,0.3163
C1OC1C1C2CCC1O2,0.3264
C1CN(C1=O)C(=O)CO,0.2298
COc1c([nH]c(=O)[nH]1)N,0.2334
COC1C2CC1C2(C)O,0.3199
CC(C)(C=O)C1(CC1)O,0.2185
CC12C3CC1NC(=O)C23,0.2567
CC1=NC(=N)ON=C1,0.164
O=CC1C2C3C4C3N2C14,0.2002
OC1CCOC(C1)C#N,0.2914
c1c-2ncnc2n[nH]n1,0.1781
C1Cc2c([nH]nn2)NC1,0.2235
CC12C3C4C1C2(C)N34,0.2796
OC1C2CC3C2C(=O)C13,0.2292
C1CC(C1)C(C=O)C=O,0.2007
NC1C(N)C(=O)OC1=N,0.2392
CC(CO)C(=O)C(C)=O,0.1543
CC(CC1CC1)C1CC1,0.3557
CN(C)C(=O)OCCO,0.2976
O=CC12CC3OC1C3O2,0.2192
CC12CNC1=NCC2O,0.2499
OCC1=CC(=N)OC1,0.2162
OCC12NC1CCC2=O,0.2129
CCCCC(O)CC#C,0.3036
Cc1c(=O)onc(n1)N,0.1538
CC1(CN1)C1CC(=O)N1,0.2807
CC(C)(C#C)C1COC1,0.2919
CN=C(N)C(=O)C1CO1,0.1823
N#CC12CN1CCNC2,0.2638
OC1C2CC3COC3C12,0.2974
CC(C)(C)C#CC=O,0.2051
COCC(O)C(=O)OC,0.2638
CC(OC=O)C=O,0.2262
CC1CC11COC=N1,0.2499
CC(=O)C1C2CC1(C)O2,0.2089
CC1C2CNC(=O)NC12,0.2873
OCC(=N)N1CC1C=O,0.2144
CC1CC2(C1)COC2,0.3116
O=C(CC1CO1)C#C,0.2068
NC(=O)CC1C2COC12,0.2692
CC1(CC1)C1COC1=O,0.2812
C#Cc1ccn(n1)C=O,0.192
CC12C3CN1C3C2C#N,0.2715
C1COCCC12CO2,0.331
CC(C#N)C1=CC=NO1,0.2444
OC1C2C3C4C1CC4N23,0.2877
O=C1OC2COC1OC2,0.2571
OCC1COC1C1CO1,0.3148
CC1=CCC(=O)COC1,0.2032
CN1CC2(C1)CC(=O)O2,0.2376
C1OCC2(CCC=C2)O1,0.2593
C#CC1C(=O)CCC1=O,0.1857
CN(C=O)C1CN2CC12,0.2673
CC1CC(O)(CO)C1O,0.3018
CC1C2(C)COCC12C,0.322
CC(=O)c1c[nH]c(=O)[nH]1,0.1638
Cc1cc(ccc1F)O,0.2076
CC12CCC1C2(C)C#N,0.3064
CC#CC1OCC11CO1,0.2654
OCC1C=CC=CC=C1,0.1733
CCC12COC1C(=O)N2,0.2458
CCC1CC2OC3C2C13,0.3081
CC([NH3+])C1=C([O-])C=CO1,0.1716
CC1(COC1=O)C#N,0.2728
O=CC1OCOC1C#N,0.2189
OC12CC1CCC2C#C,0.3
CC12OC1C1(CC1)C2O,0.3296
CN=C1NN=NC(C)=N1,0.1581
CC12CN3CCN1CC23,0.2742
CCNC(=O)CC1CO1,0.2708
CC12OC1CC2CC=O,0.2266
CC1(C)CC1CCC#N,0.3124
C(C#CC(=O)N)OC=O,0.2298
CCCC1(NC1C)C=O,0.2264
N=C1OCC1(C=O)C#N,0.2222
C#CC1=CC=CCC=C1,0.1652
c1c(ncnc1O)C#N,0.2067
CC(C)Cc1[nH]ccn1,0.251
CCCC1CC=C(C)C1,0.2596
c1nn(c(=O)o1)CC#N,0.2442
CC(CNC=O)C#C,0.2754
C#CCOCCC1CC1,0.2888
OC1CC2=CCN3C1C23,0.2124
CCOC1CNC1=NC,0.2507
CC1(CC1)C(O)C=O,0.2269
CC12COCC1C1NC21,0.298
C1N2C3C=CCC=C1C23,0.1965
CCCN(CC=O)C=O,0.212
COC1C(C)C2NC12C,0.2948
N#CC12OC3C4C1N4C23,0.2537
CC1(CO)OC2C(O)C12,0.2954
OC12CC3CC1N1C3C21,0.2888
CC12C(OC1=N)C2C=O,0.2161
N#CC1NC2C3OC3C12,0.2618
CCc1c(nco1)O,0.2163
CC1CN1C(=O)N1CC1,0.2704
CCN1C2CC1C2(C)O,0.2752
CC12CC3C4C(CC13)N24,0.3272
N#CC12CC(N1)C1NC21,0.2462
COCC1(O)CC1C#N,0.2984
N#CC12CC1C1CC1N2,0.2609
CC1CC1C1=NNN=C1,0.2414
CC1C23CCC12N=CO3,0.2321
CC(C)OC1CC2NC12,0.3022
C1NC1C1=CC2CC2C1,0.2325
CCC1(CC1)N1CC1C,0.2955
C1OC2C1C1C3OC3C21,0.2877
CC(=O)C1(COC1)NC,0.2007
CN1C=CC=CCC1=O,0.1883
O=C1NCC1C#N,0.2778
CC(C)Cc1conn1,0.2291
COC1C(CO)C1CO,0.3034
CC(O)C(C)(C=O)C#N,0.2237
CC12C3C1C1=CC2C3=C1,0.1483
CN=C1CN(C(=O)O1)C,0.2586
CC12CC(CCC1)C=C2,0.2538
CCC(C)CC(C)O,0.3331
OCCOC12CC1CC2,0.3396
CC1(CC2(C1)CO2)C,0.3343
CC12CC1C1OC1C2,0.3309
C(C1CO1)C1CC=CC1,0.2646
CC#CCCC(O)C#N,0.262
C(CC=O)CC(=O)C#N,0.1697
Cc1cn(c(=O)o1)C,0.2333
c1c[nH]c2c1ocn2,0.2027
CC1CC2=CCCC12O,0.2449
CC12COC1COC2=N,0.2796
C1C2C1C1CC2C1,0.3478
COCCC(=O)C=O,0.1575
CC1C(O)C1(O)C#N,0.257
C1CC(OC1)(C=O)C=O,0.1907
CC1NC(C#N)C1N,0.2645
CC1C2C3C2C2(C)C3N12,0.2986
CN=C1OC2(CC2)C1N,0.264
N#CC1N2CC1(C2)C#N,0.2606
CC(O)C1(C)CC2NC12,0.2962
OC1C2CCC1C21CC1,0.3169
CCC1=CCOCC1C,0.2588
C1CC(C1)(CO)CO,0.3042
NC1=C(C=NN1)C1CN1,0.2402
CC(=O)C1OCC(C)=C1,0.2049
N#CC1CC(C1)N1CC1,0.2796
OC1C=CCC1CC=O,0.2291
CC1CC(=N)N1C(N)=O,0.2467
CN1C2CCCC(O)C12,0.28
Cc1c(nn(n1)C)O,0.2278
CC1OC11CCC(C)C1,0.3331
CC1OC1(CO)C(C)=O,0.2229
CCN(CCC#N)C=O,0.2698
CC1CN1CCN1CC1,0.3159
C#Cc1c(cncn1)F,0.1915
c1c2c(nc[nH]2)no1,0.1995
CC1(O)C2C3OC3(C)C12,0.3119
CC1C(C)C1C#CC=O,0.2029
CC1(C)CC2CCC1C2,0.3561
C1CN1C1CC2NC12,0.2911
N#CC1CC2NC2CO1,0.2785
CC(CN1CC1)C1CC1,0.3219
CN=C1C=NNC(N)=C1,0.1624
O=CC12COC(C1)C=C2,0.2167
CC1C(=N)OCC1(C)C,0.284
CC1C2OCC12N1CC1,0.2893
CC#CC1C2C3CC2N13,0.2635
CC(N)C(=O)OC=N,0.2285
OC1CCN2C1CC2=O,0.2525
N=C1OCC11CCN1,0.2512
CC12CC1(CO)N1CC21,0.3042
CCC(C)C12CC1OC2,0.3
N#CC1COCCCN1,0.2653
CCC1OC1(CC)CC,0.3325
O=C1CN2C3CC2C3N1,0.2395
OCC1CCC(C1)=NO,0.2508
ON=C1C2NC1C2C=O,0.1995
CC(C)(C)C(O)CC#N,0.3134
CCC12OC3C1N(C)C23,0.2877
CC1OC11C2CC2C1=O,0.2156
OC1COC(C1)C=O,0.2133
CC1(CC1O)OCC#C,0.2827
COC(=O)CCOC=N,0.2686
CN1C2C(O)C1C2(C)C,0.304
c1c(=O)c(c(on1)N)O,0.1569
CC1C2CC1(O)C(=N)O2,0.2847
COCC12CC(C)(C1)C2,0.341
CC1CC(C)(CO)C1O,0.3086
C#CC1C2CC1OCO2,0.2887
OC12C3CC1C(C#C)C23,0.2893
COC12CN3C4C(C14)C23,0.2926
CC1CC2(C)C1NC2=O,0.272
OCC1CCC=C1C#N,0.2136
O=C1NCC23CCC12N3,0.249
N#CC12CC(C1)C1CN21,0.2764
OCCC1CC(=O)C1O,0.2221
CC1=CC(O)CC1O,0.2579
NC(=[NH2+])N1C=C([O-])C=N1,0.1119
CC1OC1(C)CC#C,0.3039
OC1CC2C3CN=C1N23,0.221
CC(C)CCC(=O)C#N,0.2114
CCC1C2CC2C1O,0.3075
CCC1C=CC2CCC12,0.257
N=C1ON=CN=C1C=O,0.1359
CC12OCC1CC21CC1,0.3096
O=C(C#N)C12CC1CC2,0.1968
O=C(C#N)C1C2CC1O2,0.1661
CN(CC#N)CC#N,0.2529
CC1CC2=NC=NN12,0.2737
CC(C)(CO)N(C)C=O,0.2713
CC(NCCCO)C#N,0.2717
NCC(NCC#N)C#N,0.2648
Cc1nc(cn1C)C=O,0.2054
CC1NC(=O)C1CC#C,0.2746
CC1OC(=O)COC1=O,0.2672
CC(C)(CC#N)C#N,0.3302
CN=C1OCCC2CN12,0.2614
CC1(CN1)C#CCO,0.2713
C1CC1C2(CO2)C3CC3,0.3503
CC1C2CN2C1C#C,0.2632
CC(C)(C)CCOC,0.3224
C1CC1NC(=O)CCO,0.2719
COCC1CC2(C)OC12,0.3369
COC(C=O)C1OC1C,0.2106
CC1C2OC2C1C#C,0.2915
C#CCC1CC(O1)C#N,0.2678
CC1(CCC1C=O)C#C,0.2134
COC(=O)C(N)C#N,0.2587
O=COCC1NC1C=O,0.222
CC1=NNC=C(N)C1=N,0.1706
CC1(C#C)C2CCCN12,0.271
NCC(OC=N)C#N,0.2594
CC1CC(O)CCC1=O,0.2233
CCC(CO)NC(N)=O,0.3009
COCCN1CCC1=O,0.2777
COCC#CC(=O)C=O,0.1551
CCCC(=NO)CCC,0.2584
C1CC12CNC(=O)NC2,0.297
C(COCC=O)C=O,0.2259
CC1OC2(C)C1NC2=O,0.2512
COC12CC1C1OC21C,0.2809
CC1(C)CC2C(C#N)C12,0.3125
CC(=NO)C12CC1CO2,0.2185
CC12CNC1(CO2)C=O,0.1892
CC1C(CC#C)NC1=O,0.2794
C1OC1C1=NC=CN=N1,0.1645
CC1CC2(OC12)C=O,0.2205
O=CC1(CC#N)CO1,0.2219
CC1(CCCC1)NC=O,0.2767
N#CC12CC1C1OCC21,0.2694
c1n[nH]c(=O)n1C2CC2,0.2315
C1C2CC1C1=NNN=C21,0.2393
CC12CCC1(C)C1CC21,0.3364
CC1CCCC1C(C)=O,0.2304
CC12C3CC1CCCC23,0.3174
CN1CC1C1=NC=CO1,0.2201
CC12CC(C=C1)C2C=O,0.1991
C1CN(C1)CC#N,0.261
COc1nc([nH]n1)N,0.2499
CN1CC1(C)C(F)(F)F,0.3247
CC1=CC2OC2(C)CC1,0.2356
COC(C)C(C=O)C=O,0.2001
CC1CC=CC1C#C,0.2616
CCc1c(nc([nH]1)C)O,0.2183
NC(=O)NCC(O)C#N,0.2615
CC(CO)C1C(O)C1O,0.2815
C1CC2(C1)CCC(=O)N2,0.2714
CCCC(=O)CO,0.2349
CC#CC1COC1C,0.2911
C1CC2C=CC3C1C23,0.2392
COCC1C(C)C1C#N,0.2907
CC(=O)C1=NOC(=N)O1,0.1775
C#CC1CNC(=N1)C#N,0.2015
CCOC1C=CC2OC12,0.2385
[NH3+]C1(CC2NC12)C([O-])=O,0.2668
CC1(CC1)n2ncnn2,0.2576
OC1CC2CC3C1N3C2,0.2937
C1CC(=O)NC(=O)NC1,0.239
O=C1NCCC1CC#N,0.2706
CC12CN3CC(C)(C1)C23,0.2806
CNC12C(O)C1OC2=O,0.2304
C(COC=O)C(=O)C#N,0.1916
C1C2N1CC1=C2NC=C1,0.2295
CCC1C2CN2C1=O,0.2323
CC1NC1C(N)C#N,0.2825
C#CCC1CC2CC2O1,0.2949
NC1(CCC1C#C)C#N,0.2745
CC1(CO)OCC11CO1,0.3123
CC(CC(=O)C#C)C#N,0.2091
OCC1CC(O)(C1)C#N,0.2898
CC(C)C1COC=NC1,0.272
CCC(O)CC(C)C,0.3316
CC(C)CC1C2CCC12,0.3294
CCc1cnc(nc1)F,0.2132
CC12CN1C=C(C2)C=O,0.1828
c1cncc(c1F)N,0.2056
CC(CC#N)C1CO1,0.315
CC#CCn1cncn1,0.2716
OC12CC3(C1)N=COC23,0.2533
C1CC1(C#N)N,0.3012
Cc1ncc2n1C=CC2,0.1952
CC#CC(O)C(C)C#N,0.2836
O=CC1(CO1)C1CCC1,0.22
CCC1OC1C(=O)CC,0.2232
NC(=O)C1OC11CCC1,0.2562
CC1CC(=O)C(=O)CN1,0.1497
COC(=N)NC=O,0.2493
OC12CC3C1OC23C#C,0.2431
CN1C=NC2CC12C#N,0.2285
CC12NC3CC1C23C#N,0.2437
CCC1(OC2CC12)C#C,0.2692
CC1OC2C(=O)NC12C,0.2476
CCCC1(CC1)CC#C,0.312
CC1CC11CCC1C,0.3468
OCC1(CN1)C(O)C=O,0.2153
CC1(C#C)C2NC1C2O,0.2752
CC(=O)NC(=N)C#C,0.2022
CCCOC(=N)NC=O,0.2469
OC1C2CCNC(=O)C12,0.2479
OCCC1CC2CC12,0.3331
CCC1(C)C2CC(=O)N12,0.2339
CCC(O)C(O)CC#C,0.2989
N=C1OCCCC11CC1,0.2703
CCc1[nH]c(c(n1)O)N,0.2263
CC(C)(CC#N)OC=O,0.2782
C1CC2OCC3OC2C13,0.3021
CC1OC1CC(N)C#N,0.2928
O=C1C2OC1C1NC21,0.2445
CC12CC1C(=O)C=C2,0.1867
C#CCC1CN1CC#C,0.2683
NC1=[NH+]C(CC1)C([O-])=O,0.2489
CC1CN2N=CN=C12,0.2735
O=C1NCCC2CCN12,0.2926
CC1OC(=N)C(C)C=C1,0.2613
OC1C=CCC1NC=O,0.241
CC1N2CCC(O)C12C,0.2814
c1c(oc(nc1=O)F)N,0.2185
CC1C(=N)OC2CC12C,0.2713
N#CC1C2NC3(CC3)C12,0.2671
N=C1OCC(CO1)C#C,0.281
CC1=NC=CN=CC1=N,0.1649
Cc1c(ncc(n1)O)O,0.1767
CC1C(O)C23CC(C2)C13,0.2944
CN=COc1ncon1,0.2323
O=C1CCCOC2CC12,0.2264
CC1C2CC3OC3C12,0.3302
CC1OC(C=C1C)C#C,0.254
CC1=CC=CC2CC1C2,0.1775
CC1CC1C1(O)CC1C,0.3132
CC1(C)OC2CC12C=O,0.216
COC1CCOC(=N)O1,0.3005
CC12OC3CC1NC23,0.3115
CC1(C)C2CCC1CC2,0.3503
CC(C)CC1CN1C=O,0.253
CC12CN3C1CC23C,0.3137
c1c[nH]c(c1C#N)O,0.2221
CC(C)(CC1COC1)O,0.2958
CC1C(C2CN2C)N1C,0.2872
COC(=O)CNCC#C,0.2425
CC(CO)(C=O)C1CO1,0.2228
c1cnc([nH]1)NCC=O,0.1672
COCC1(C)C2CC1C2,0.335
OC12CCC11CCN1C2,0.2721
O=C1OCCCC1C#C,0.2558
CC1(CC1)OC(C)(C)C,0.3205
CCc1c(cno1)CO,0.2412
C#CC12CCC1=CCC2,0.2452
C#CCCC(C#C)C#N,0.2779
C1CC12C(=CC(=O)O2)N,0.2169
CC1=CCCC11CO1,0.2501
CC12OC1(CO)CC=C2,0.2457
O=C1NCC2CC2C=C1,0.208
CCC1OC1C1(O)CC1,0.3244
O=COC12CC1C=CC2,0.2484
OCC12CC(C1)OC2=N,0.2761
NC12C3CC1(OC23)C#N,0.247
c1cc2c([nH]cn2)nc1,0.2038
CC1=CC(O)C2(CN2)C1,0.2505
CNC(=O)C(OC)C#N,0.2506
OC1C2C=CC1C21CN1,0.2356
OC1C2NCC2(O)C1=O,0.1977
CC#CC1(CC1)CO,0.2843
CC1CC(CN)(N1)C#N,0.2607
OC12CCC1(O)C2C=O,0.2226
CC1OC1CCC1CO1,0.3565
CCC(=O)C1(C)CC1C,0.2298
c1c(c(=O)onc1O)N,0.1746
OC1=NOC(=N)C=N1,0.1548
CC1C(CO)C1(C)C=O,0.232
C1C2C1C13CC4C1C2C34,0.3379
COCC1(OC1C)C#C,0.284
c1[nH]c2c(n1)c([nH]n2)N,0.1973
CN1C2C=CCC12C#N,0.2339
CC(C)(C#C)C(=O)NC,0.2745
c1cnc(c(n1)C=O)O,0.1691
CC1(C)CC2CCC12C,0.3318
CC(O)(CCC=O)C#C,0.2292
O=C1OCOC2CC2O1,0.2967
CCC1C(N)C1(N)C#N,0.2567
CC12NC1C(O)C21CC1,0.3027
CC12C3OC1(C)CC23O,0.2868
CC1CN1C(CO)C#C,0.2774
CC1COC(C=O)C=C1,0.2081
COC(=O)C12CCC1O2,0.256
CCN1CC(C1)(C#N)N,0.2513
Cc1c(cc[nH]1)C(=O)C,0.1938
O=C1NC2CC3(CO3)C12,0.2681
COC1CC1(O)C=O,0.2198
CC(=O)C1(C)C2CCN12,0.2109
O=CNCC1CN1,0.2776
c1c[nH]c(=O)cc1C=O,0.1461
NC1=CC(=N)C(N)=NO1,0.1878
CC#CC(CO)OC=N,0.2744
OCC1OC(=N)NC1=N,0.2531
OC1CC2C(C1)C2C=O,0.2229
CC1(C(=NO)CCO1)C,0.2515
CC12CC(O)C(N1)C2=O,0.2309
NC(=[NH2+])C#CCC([O-])=O,0.1721
CN1C(=O)CC=CC1=N,0.2051
CC12OCOC1C2C#N,0.2743
O=C(C#C)C1OC1C#C,0.1945
CC(CO)C(C)(O)C#C,0.2973
CN1C2C3(CN3)CC12C,0.3087
c1c([nH]nc1N)CC=O,0.1747
O=COC1CN2CCC12,0.2302
CCN(CC(=O)C)C=O,0.2112
CC1=CCC(C1=O)(C)C,0.1947
C(#N)c1c(non1)C#N,0.2249
CCCCN1CC1C#C,0.2631
C1OC1C1CC2COC12,0.3117
O=C1CC2NC12C1CN1,0.2086
c1c[nH]c(c1N)CC#N,0.2334
CC1(CC2CC12)C1CC1,0.3379
C#CCC1COC2CC12,0.2839
c1cnn(c1O)CC=O,0.1969
C1CC2OC1C1OC21,0.341
CC1=CN=NNC1=N,0.1673
CC1OC(=N)C1(C)CO,0.2856
O=C1CCNCC1C#N,0.2116
NC12CC1CC2(O)C#N,0.2453
C#CC1CCOC11CC1,0.2807
CC12N=COC3C1NC23,0.2531
Cc1c(n(cn1)C)O,0.2394
CC#CC1C(C)OC1=O,0.2597
CC1COC(C)(O1)C#C,0.2976
OC1(CCC1C=O)C#C,0.2198
CC1C2C(O)C2CC1=O,0.2282
CC1C2N=COCC12O,0.2421
ON=C1CCC1N1CC1,0.2254
CC1COC2(CC2)C1=O,0.2148
Cc1cc2n(c1)CC2,0.2505
CC1CC(C)(C)OC1=O,0.2766
NC(=O)C12CC1C1OC21,0.2523
c1(c(n[nH]n1)N(=O)=O)N,0.1607
CC1CC2(C1)C1CC2C1,0.3634
C#CC(=O)C#CC1CC1,0.1887
COC=NC1CC1C#C,0.2401
c1c(nc(o1)C=O)C=O,0.1786
CC1(C#N)C2OC=NC12,0.2473
CC1OCC(=O)C11CO1,0.1969
CC1(CC2CC2C1)C#N,0.3257
Cc1c(c[nH]n1)C(=O)N,0.2339
O=CC(CC1CO1)C#N,0.2262
CC1(CO)CCO1,0.3184
CC(C1CC1)C1CCO1,0.3248
CC1COCC2(CN2)C1,0.3155
CNc1coc(c1O)N,0.2216
CC1=CCNC(=O)CC1,0.2485
CCC(=O)C1C(C)C1O,0.217
CC1OC(=N)C2COC12,0.2772
CC1=CCC2(NC12)C=O,0.2121
C1C=CC2CC1OC=N2,0.2465
OC1COC2CN3C2C13,0.2957
C(=O)C(=O)N(C=N)C=O,0.1534
CCCC12CC1COC2,0.3325
COC(N)=[NH+]CC([O-])=O,0.2727
C#CC1CC2(CCO2)C1,0.293
CC(CCC[NH3+])C([O-])=O,0.0483
OC1C=CC2=C1N=CN2,0.1728
OCC1CC2C(C=O)N12,0.1944
CC12CCC1(N)C(=N)O2,0.2656
CC(C=O)C(C)C#N,0.2237
CC(CCO)(C#N)C#N,0.2792
C#CC(C#C)OC1CC1,0.2619
N=C1N=NNC=CC1=O,0.1648
CC(O)CN1C=CC=C1,0.2433
CC(C)COCC#C,0.2889
O=C1CC2CC2C11CC1,0.2245
N=C1NC(=O)N=NO1,0.1723
NC1CC1(NC=O)C#N,0.2699
C1CCC2(C1)COC2,0.3065
OC1C(CC1=O)C1CC1,0.2201
CC1C2C3OCC1(C)C23,0.3095
CC(C)N1CCOC1=O,0.2977
N=COCC#CCC#C,0.2789
CC#CC1OCC1CO,0.2695
CC(O)C1=C(C)OC=C1,0.2283
CC1C2C(=O)OC12CO,0.2732
O=CC12CC1(CN2)C#N,0.2
C(C(=O)N(C=N)C=O)O,0.2193
CCC1CC(CO)C1=O,0.2157
CC12C=CC34OC(C13)C24,0.2166
CC1=C2CCC2C2CC12,0.2341
CN=C1C=C(C)ON=N1,0.1522
CC1(O)C2OC(N)=NC12,0.2656
CCN(CC#C)C(=O)C,0.2669
CC#CC1C=CC2NC12,0.2366
O=C1C2CC2C1N1CC1,0.2198
C1C2OCC=CCOC12,0.2377
CCC=O,0.2295
CN=COC(=O)C1CC1,0.2414
CCC(O)C1(C)CC1C,0.3239
Cc1c(=O)[nH]c(cn1)F,0.1752
CC12OC1C(O)C2=O,0.2035
CCCCC#CC1CC1,0.2807
CC1CCC2(CO2)CC1,0.3345
COC1CC(C)(O)CO1,0.3227
C1OC2CCCCC1O2,0.3223
O=C1CN2CC2C1=O,0.1391
CC12CC(CN1)OC2=O,0.2515
O=C1CC2CN3CCC123,0.1922
CC#CC1OC1(C)C#N,0.2573
CC12CC3C(CC1)N3C2,0.2906
[O-]C(=O)C1(CC1)NC=[NH2+],0.2528
CC1C(C)C1C(N)C#N,0.2792
CC1CC=C(C1)C#N,0.2199
CCCn1cncc1O,0.2443
C1CC11CC2CC12,0.3409
CC1NC1(C)CNC=O,0.2748
CC1OC2C3CC(=C1)C23,0.2102
CN1CC1C1CC(=O)C1,0.209
OC(CNCC#N)C#N,0.2787
CC1CCNC(=O)C1O,0.2629
CC1(C)CC=CC1C#N,0.2632
NC1=CC(F)=NOC1=N,0.1707
CC1C2OC2C=CC1=O,0.1817
CCc1cnc(o1)C=O,0.1806
CC1OCC1(CO)C=O,0.2232
C#Cc1cn2c(n1)CC2,0.2154
CC1C2OC3(C)C2OC13,0.3091
CC12COC1COCO2,0.3202
CN1CCC1(C)CC#N,0.2491
OC12C3OC(C13)C21CN1,0.2665
CCc1c(nco1)OC,0.2113
N#CC12OC3CC1OC23,0.2592
NC(=O)C#CC(O)C=O,0.2074
CC(C)C12CN1C1CC21,0.2896
CC1N2CC2C1=NO,0.2322
FC1=NOC(=N)NC1=N,0.1884
CC1CCC2CC12C#N,0.309
CC1C2C3C(=O)C1C23O,0.2397
CC12CC1C1(CO1)C=C2,0.2321
CCC1OC2C(O)C12O,0.291
CC1(O)C2C3NC1C23O,0.2825
CC12C3CC(C1O)C2O3,0.3069
CC12C3C1C1C3CC21,0.3318
C1CC23NC2CCC3=C1,0.2392
C1C23CCC12CCCC3,0.3084
CCC1(CCO1)C1CN1,0.3064
C1NC11CCC2NC12,0.308
CC1CC(C=C1C)C#N,0.2577
CCCC1OC1C#C,0.2806
CC(CO)(CO)C1CC1,0.3086
CC(=O)C(O)C(O)CO,0.2399
NC1=COC(=N)C(O)=C1,0.1569
COCC12NC1C1OC21,0.2733
CN1CC(C1)(C#C)OC,0.2487
CC#CCCC(F)(F)F,0.3067
C1C2CC11NC1CCO2,0.3187
CC(=O)C(O)C(N)=O,0.2166
CC1C=CC(C)C1=NO,0.2444
NC12CC1(OC2=O)C#C,0.2239
CC1=CC(C)(O)C(=O)N1,0.2125
Cc1c(onn1)C=O,0.1868
CC1CC2C1N2C(N)=O,0.2676
OC1CCCC1CC=O,0.229
CN1C2CC(N)C12C#N,0.2496
CC1CCC(=NO)C1=O,0.165
CCC(C)C#CCOC,0.281
OC1C(O)C23CN(C2)C13,0.2408
CC12OC3(C#N)C1CC23,0.2509
CC1C2C3CC3(C=O)N12,0.2058
CCCn1nnnn1,0.2731
CC1CC(C)(C)C1(C)C,0.3432
c1[nH]c(=NCC=O)on1,0.2175
CC1CC2(CN12)C1CO1,0.3144
CC(=O)Cc1c[nH]nn1,0.2297
CC1C2CC3(O)CC1C23,0.3186
CNCC1(NC1C)C#N,0.245
O=C1CC=C2COCC12,0.2252
CC(C=O)(C#C)C#N,0.2182
Cc1ccnn1C(C)C,0.2551
Cc1c(ocn1)N2CC2,0.2293
c1c2c(c[nH]1)oc(n2)N,0.2151
COCCCC1CCO1,0.3296
N=C1OC2=C(OCO2)O1,0.1895
OC12CC1CC1CCC21,0.3104
Cc1c[nH]c2n1cnn2,0.2184
C(C1CCOC1)N1CC1,0.3166
C1COC(O1)CC=O,0.2294
c1c(c(c(=O)[nH]n1)F)F,0.1832
CCc1c(cn[nH]1)OC,0.2271
COC1OC(=N)CC1=O,0.2159
CC1CC23COCC12O3,0.3157
C1CC1C12CC1N=CO2,0.2581
Cn1c(ccn1)O,0.2546
CC1COC11CCOC1,0.3218
CC12CC3N(C1)C23C#N,0.2613
c1c(c(n[nH]c1=O)N)F,0.1619
CCOCC(=O)CC#C,0.2321
C1C2C3CC3C3(CC3)C12,0.3207
CC1COC(CO)C1C,0.3166
CC(O)C(N)C(F)(F)F,0.3273
C1NC11C=CC2CC1C2,0.2396
CC1OC(=N)N2CC12,0.2843
CC1OCCC2(C)CC12,0.3272
CC1CC(O)CC=C1C,0.2593
CC(C)C1C(O)C1CO,0.3055
CC1OC1C(C)(O)CO,0.3285
CC(O)C12CCCC1O2,0.3202
NC1C[NH2+]C1CC([O-])=O,0.2702
C1CC11C2C3OC1C23,0.3073
CNc1cc(oc1O)N,0.2096
CCC1C(C)C=CC1O,0.2621
CCC(=O)C1CN1C=O,0.2117
CCCc1c(nn[nH]1)C,0.2434
CC12CC1(O)C1CC1C2,0.3251
CCOC(CC)C#CC,0.2942
O1C2C3C2C2C=CC3C12,0.2556
CC1NC1C(=O)NC=N,0.2307
c1cn(nn1)C(=O)C#N,0.1848
CN=c1c(ncno1)F,0.1719
OC1C2CCCC12C#C,0.2853
OCCC(C#C)C#N,0.2921
N#CC1CCCCN1,0.2672
O=CC12C3NC1COC23,0.202
CC#Cc1ccc([nH]1)N,0.1877
CC1(C)CC=CC1C=O,0.2097
COC1OCCNC1=N,0.2586
CCC(=O)NC(=N)N,0.2281
CC12CCC(CO1)CO2,0.3185
C1C2N1CC1=C2N=NO1,0.1573
N=C1OCC(CC#N)=C1,0.2107
[O-]C(=O)C1C2NC(=[NH2+])C12,0.2517
CCOC(=O)CC(C)O,0.2602
CC1(Cn2c1cnn2)C,0.2597
CCCC1(C)CC(=O)O1,0.2845
CC1C(=N)OC1(C)C=O,0.216
CC1(CN1)C(C=O)C#N,0.2187
COCC1CC2(CO2)C1,0.3334
CC1OC2=C(O1)C=NN2,0.2232
CCOC1C2CC1CC2,0.3333
CC1=NC(=N)C(N)=NN1,0.1878
C1OC2CC3OCOC123,0.3124
CC1C(O)CCC1C#C,0.2979
CC1OC2CC3C1C23O,0.2998
COc1ccccc1N,0.2046
O=C1CC2OCOC12,0.1939
OC12CC3(C#C)C1CC23,0.2871
COC1CCCC(C)=C1,0.257
COC1(CO)CC2OC12,0.3168
OCCNCC(O)C#N,0.2793
CC(=N)OC12CC(C1)C2,0.2868
NC(=O)C1(N)CC1C#N,0.251
O=CC1NC11CCC1=O,0.1992
CCC1(O)CCC(C)C1,0.3238
OC1COC(=O)C1,0.2803
COc1cc(no1)N,0.2453
CC1C(C=O)C1(C)C=O,0.2037
OC1C2CCC(C#N)C12,0.3023
O=C1CC23CC(C=C2)C13,0.2033
N=C1N=CC=NNC1=O,0.1673
OCC12CC(O)(C1)CO2,0.3066
CC1=CC(=N)N=C(C)O1,0.2064
O=C1NC2CCC2C1=O,0.1708
CC1C2CCC1C(=O)N2,0.2656
C1C=CC=CC#CC=C1,0.1459
CC#CCC(=O)C#CC,0.1976
C1C2CCC3(COC3)C12,0.3167
O=CC1CC(CC#N)C1,0.2284
O=C1C=CC2C(C#N)C12,0.185
CC1OC1C1(C)CO1,0.3411
CCC(OC)C(C)=NO,0.2547
CC1=C2CC3C2C3(C)C1,0.1731
CN=C(CC1CC1)OC,0.2578
OC1CCC(=N)NC1=O,0.243
CNc1cnccc1O,0.198
CC1CC11C2C3OC2C13,0.3155
CC#CCCC1(CC1)C,0.3026
OCC1(CC1C=O)C=O,0.2084
CCOC1CC(O)C=C1,0.2519
O=CC1CC1C#N,0.2263
CC1(CCO)CCC1O,0.3269
OCC12CC(C1)C(=O)C2,0.2289
COCC(CO)C(C)O,0.3122
CCCc1c(onn1)N,0.2081
CC(C)CC#CC#C,0.2305
CCC1C(C)C1(C)C#N,0.3114
CC1(CC(=O)OCO1)C,0.2732
NC12CC1(C#N)C1OC21,0.1775
OC1CN2CC1C2C#C,0.2648
OCCC1CC(CO)O1,0.3175
CC(C)C(=NO)CC#N,0.2515
CC12CC=C(C=O)C1N2,0.1788
CC1N(C)CC11CCO1,0.28
OCC1CC2C(O)C12O,0.3019
CC(O)C1OCC1C,0.3068
C#CC(CC#N)C1CC1,0.3041
CC12C3CC=C1C(O)C23,0.1801
NC1=C(O)C=NOC1=N,0.155
OCC1CCCC1C=O,0.2251
N=C1OCCC11COC1,0.2654
COC1CCC=CC1=O,0.1759
CC(=O)C1(C)CCC1O,0.2186
Cc1c(nn[nH]1)CC=O,0.2134
C1C2NC2C2=CC=CN12,0.2305
CN(C=O)c1n[nH]nn1,0.2099
CC1COC(=N)OCO1,0.2899
CC1CCC2C1CC2=O,0.2187
COC12CC1CCC2C,0.3187
CC1N=CN(C)C1C#N,0.2331
CC1(O)CN2C3CC3C12,0.2792
CC12OCC11CCC2O1,0.2767
CC12CC3C1CN23,0.3268
C1CC2(C1)C=CNC2=O,0.2065
CC1C2C3NC3(CO)C12,0.3371
CC1C2CC3N1C23C,0.326
Cc1[nH]nc(n1)N,0.2339
CCC1OC1(C)C#CC,0.2786
OC12COC34CN(C13)C24,0.2961
CC1(CC(=O)C1)C,0.2215
CC(C)c1cnc(o1)O,0.2428
CC#CC#CCC=O,0.2006
CC1=CCn2c1cnn2,0.1969
CC1(O)COC1C1CC1,0.307
CC(C)(CC#N)OC=N,0.2838
CCC12OC1C1CC21C,0.2896
O=C1C2C3CC2CC1C3,0.2175
C1CC2C1N1N=NC=C21,0.255
O=CCCC12CC(C1)C2,0.2289
COC12C3CC1(C)OC23,0.3032
CC1N2CC(=O)C12C=O,0.2092
NC1(C2C[NH2+]C12)C([O-])=O,0.1824
CCc1cc(n[nH]1)OC,0.2423
CC#CC1=CC2CC1O2,0.1881
CCC1OC1C#CC#C,0.2148
NC(C#N)C1=NNC=C1,0.258
OCC(O)C#N,0.2839
CC12COC1C1CC21O,0.3106
CC1CC2OC1(C)C=C2,0.2562
O=CC12CN3CC(O1)C23,0.1765
C1NC1C1OCC11CC1,0.3063
CC12NC3C1NC(=O)C23,0.2358
c1cc(n(c1)CCO)O,0.24
OCC1N=CNC1C=O,0.1951
CC1(CC#C)CC1O,0.3071
CC12OC3C1C2(O)C3=O,0.2145
C1C=CC23C=CCC2C13,0.2244
COC=NCCNC=O,0.2594
CC1CC(C)(O)C11CO1,0.3168
CC(=O)C1CN1C=O,0.2105
OC1C2CCC1N1CC21,0.2853
O=C1OC=NCC2CC12,0.2377
c1cnn2c1C(=O)CC2,0.2034
N#CC1C2CC3CC3N12,0.2548
CC([NH3+])C1=CC=C([O-])O1,0.168
CC1NC(=O)C1(C)O,0.2657
CN=CNC=O,0.2236
N=C1CC2C3NC2C3O1,0.271
CC1CC11OCC2CC12,0.3091
N#CC1NC2CCOC12,0.2699
Cc1cc(cc(n1)C)F,0.2369
Cn1cnc(n1)N=CN,0.2098
C#CC(=O)NC(=O)N,0.2114
OCC12CN3C(C13)C2O,0.2974
CN(CC#N)C1CC1,0.2486
OC1CCC2OC2C1O,0.3268
CCC(CC)C(C)CO,0.337
OC12CN3C1C2C3C#C,0.2594
OC12CC1C(O)(C2)C#C,0.2866
NC1(CNC1C#N)C#N,0.2517
CCC12CC(C1)C=C2,0.2389
NC1CCC2NC12C#N,0.2546
CC1OCC2OC=NC12,0.2721
O=CC12CC1C(C2)C#N,0.2259
CC(C)CC(C=O)C#C,0.2202
O=C1CNC(C#C)C1=O,0.1267
CC12CC(=NO)C1(C)N2,0.2359
C1OC2CC=CC1C=C2,0.2395
COC1C2CC2NC1=O,0.2436
CC(OCC1CC1)C#C,0.2919
C1CC23CCOC2CN13,0.2878
CC12CC3CCOC1C23,0.3062
CC(C)(C#N)C1(C)CO1,0.3129
CCN=C1C=CNC=N1,0.1834
CC12CCN=C1N1CC21,0.2336
CC1CC2CC1C=CC2,0.2597
C1CC2C1C=C1COC21,0.2405
CC(C)C#CC(=O)NC,0.2348
CC(C)C(C)(O)CO,0.3151
CNCc1nccnn1,0.1514
C#CC12CN3C1CCC23,0.2745
CN(C=O)C1COC1=O,0.2462
CCC(=O)CC(=O)NC,0.2098
CC12NC3C1(O)CC23O,0.2856
C#CC1(CC1)CN2CC2,0.2661
c1c([nH]nc1C#N)CO,0.2352
CNC(=O)OCCCO,0.3156
CC(=O)C1CCC2OC12,0.2268
C1CC2N=COC2C=C1,0.252
OC12CC(CC=C1)C2=O,0.2129
[O-]C(=O)C[NH+]=C1CCN1,0.2548
C1C2COC3CC3OC12,0.3024
O=C1C2OC1C1OCC21,0.2331
CCOc1cc(n[nH]1)N,0.2475
CC1NC(C)=CC1=NO,0.1753
C#CC#CC1(CC1)O,0.2104
CCn1c(cnn1)C,0.2504
C#CC1(CC2OC12)C#N,0.2767
c1c(nc(nc1O)N)N,0.2247
C1NC11CCCOC1,0.3192
CC(=O)C1NC1(C)C=O,0.193
NC(=O)C1C2C=CCN12,0.2287
C1CC2OCC3OC1C23,0.3234
CC12CC3OC(CC13)C2,0.3241
CN(C)C1=CC(=N)OC1,0.2048
OCC1(O)CC=CC1O,0.2582
O=C1C2CCCCC1O2,0.2225
CC1CC1C(=O)OC=N,0.2488
CC1(C)CC2(O)C(O)C12,0.2992
OC1C2C3COC1C23O,0.3043
CCC1NC1CC(N)=O,0.2703
CC12CC1C1C3CC1C23,0.3438
COC1(CC1)C2CCC2,0.3104
OC12CC3CC1C2OC3,0.2944
OC1C2C=CC1C=C2,0.2237
CC1=C(CCC1)C1CO1,0.2387
C1CC1CC#CCC=O,0.2188
O=C1C2CC2N2CCC12,0.1961
C1C2CCC=CCOC12,0.2428
CCC(C)C12CN(C1)C2,0.2947
C1C2C=C3C=C1C1C2C31,0.1447
C(#N)c1nc([nH]n1)N,0.2179
CCC1COC(O1)C=O,0.209
O=CC1C2CC=CC1O2,0.2156
OC12CC1C1C2N1C=O,0.2351
CC1CC2(OCC12)C#N,0.2685
OC12CCC1CC=CC2,0.2612
CC12COC(C1)C(=O)O2,0.2536
CC1CC23COC2C1O3,0.2746
CC(C)C1C2CC1C2,0.3773
CC(C)C(C)(O)C=O,0.2249
CC12CNC(=O)C1(C)N2,0.2557
CCC1OC1(C)C#C,0.2862
N=CN(CC1CN1)C=O,0.225
N=C1OCC2CCCC12,0.2824
C1C2CC3=C(C=CN3)C12,0.2328
C1C2OC1C1CC2C=C1,0.224
N#CC1C2C3C4C3C2C14,0.2893
CN1CCC(=O)C2CC12,0.1998
C1CC2(C1)CCC=CC2,0.2679
CC12CC1(O)CC2CO,0.316
CC1C(CNC=O)N1C,0.2467
CC(O)C1OC1C(N)=O,0.2612
C#CCC1C=CC2CC12,0.2467
CC1CN2C3CC(O1)C23,0.3175
COC1CC2NC12C=O,0.2063
N#CCC1=CCC2NC12,0.2413
CC(=O)CC1(CC1)CO,0.2258
NC(=O)C12OC1CC=C2,0.2383
CC1CC2CC12C(N)=O,0.2657
CC(C)(CC#N)O,0.3105
C=O,0.2263
Cc1cc(n(n1)C)C,0.2572
O=C1CN2C3C4CC13C24,0.1979
C1CC2C1CC1COC21,0.3113
CC#Cc1cnoc1C,0.2096
FC(F)(F)C1NC1C#C,0.2871
CCC1OC(C)C2NC12,0.3104
CCC1CC(C1)C1CO1,0.3479
C1CC(=O)COCC=C1,0.2054
ON=C1C=CCC2OC12,0.1923
CN(C(=O)C#N)C(=N)N,0.1795
O=COC(C=O)C1CC1,0.2224
CC(O)C(C)(O)C1CO1,0.3158
CC1OC2CCC2=C1C,0.2343
O=CC1CC2NC12C=O,0.1923
CC1NC(=O)C1(C)CO,0.2757
CC1CN1C1CC1(C)O,0.3051
Cn1c(=O)n(nn1)C=O,0.2036
CCC(CC#N)C(N)=O,0.2728
CC1(O)CC2CCC12O,0.2922
CC1=C(OC=N)OC=C1,0.2227
CCCCC1COC=N1,0.2696
CC1C2C3CC3(C)C12C,0.3376
CC(CN1CC1)C#C,0.2956
CC(CO)CN1CC1C,0.2999
OCC12CCC1C=CC2,0.2614
C1CC(O1)C1=NON=C1,0.2233
CC(CO)CC1CC1O,0.3315
O=C1NCC2CCCN12,0.2997
CCC1CC2(CO2)CO1,0.3252
CC1=CN(CCC1=O)C,0.1763
CCC1OC(C)CC1=O,0.2192
COC(C=O)C#CCO,0.2039
OC12C3OC1C=CC23,0.2267
c1c2c(ncn1)ocn2,0.2065
OC1C2C3C1OC23C=O,0.2154
OC(CCC=O)CC=O,0.2235
OC12CC1(NC2=N)C#C,0.2103
CC1CC2(O)COC12,0.3012
CCCC1=CCC(C)C1,0.2577
CC(O)C(C)C=O,0.2293
O=CCC1OC1C1CO1,0.2248
C1C(=C(CO1)CO)CO,0.234
CC1=CCC2(C)OC12,0.2446
CNCc1nnon1,0.172
CC12CN(C1)CC(=O)N2,0.2407
O=C1CC2C3OC(C1)C23,0.2167
OCC1COCC(=O)C1,0.2113
OCC1OCC(C=O)=C1,0.1791
C1CC2=CC=CCCC12,0.1866
CCOCCCC#N,0.3011
CC(O)C1C2OC(C)C12,0.3066
OC12C3CC3C1C2C#C,0.2548
CC1C2CC1(C#C)C2O,0.2844
O=CC1C(=O)C=CC1=O,0.1552
CC12OC(=O)C1C1OC21,0.2696
CCC(C)C1(CC1)OC,0.3119
c1c(c(co1)C#N)C#N,0.2243
CC1CC2C(NC12)C#N,0.261
CNCC(=O)C(F)(F)F,0.1815
OC(C#N)C(=O)C1CN1,0.2157
OCC1(O)CC1C#C,0.2911
C1C2(N1)CN(C2)CC=O,0.2016
C(c1c(c(n[nH]1)N)N)O,0.2111
OC1(C=O)C2C3CC1C23,0.2236
CC(O)CN=CNC=O,0.2242
OC12CCC1OC2C#N,0.2601
O=CC1COCC11CN1,0.2196
O=C1OCOCC2CN12,0.2714
OC1CC11CCC1C#N,0.2904
C#CC12CC(N1)C21CO1,0.268
c1cc2c[nH]cc2nc1,0.1586
OC1C(=O)CNC1=O,0.214
Cc1cc(=O)c(n[nH]1)C,0.1905
CN=C1N2CC3C2C13O,0.2511
CC(C)C(=O)OCC#N,0.2822
COC1C2CC3OC3C12,0.3155
NC1=C(COC1=N)C=O,0.1677
CC1C2C3C4C1C2CN34,0.3282
NC1=CC=NOC1=N,0.1687
CC12OCC1=CCC2=O,0.2107
C1CC2C3CCOC2C13,0.3187
C1CC11C2OC2C11CN1,0.3055
Cn1cncc1COC,0.2435
CC1(C=O)C(O)CC1O,0.22
CC1(C)CC(C#N)C1O,0.2979
C1C2N1CC21CN=CO1,0.2593
CCC1C2OCOC12,0.3345
CCC(C#C)(C#C)C#N,0.291
OCC1=CCC(O)C1O,0.259
COC(=O)C1CC2CN12,0.2353
CC(C)C1(C)CC1C=O,0.2258
CC1CC2=CC(N)=NN12,0.2272
CCC1(O)CC(O)C1O,0.3018
C1CC11C2C3CCC2C13,0.3591
CC(O)C1(OC1C)C=O,0.2086
CNc1cn[nH]c1NC,0.2325
CC1=CCC(O)(C1)C#N,0.2629
CC1=CCCCC1CO,0.2586
CC12CC(C1)C21CCO1,0.3221
CCc1c(ocn1)CO,0.232
C1OC11C2C3OC2C13,0.3167
c1c2c(c(o1)N)nco2,0.1748
COCC12CCC1O2,0.3289
CC1=CC(C)(OC1)C=O,0.1988
C1COCC2(N1)COC2,0.2849
O=C1NC(=O)C2CC1O2,0.2256
CCC1NC1(CO)CO,0.319
CC(CO)OCC1CC1,0.3331
CC1=CCCOC1=O,0.2228
CC(C#N)C1OC1(C)C,0.3061
c12c(noc1nno2)N,0.1813
OC1C2C(=N)OCC12O,0.2642
CC(=O)Oc1cocn1,0.2419
CNC(=O)NC(=O)N,0.2711
N=C(OC=O)C#CC=O,0.1924
CNC(=O)C(=O)OC=N,0.202
OCC1OC2(CC2)C1=O,0.2152
OCC#CC#CC1CO1,0.2105
COCC1C2OC2C1O,0.3262
CNc1nc([nH]n1)C#N,0.1727
C12C3C4C5C(C1N35)N24,0.2235
c1c(cn[nH]1)C2CC2,0.2465
OC1C2CCOC1C2=O,0.2042
CC1CC2=NC=CN12,0.2564
CCCC(=O)CC#C,0.2328
O=C1CC23CC12CCC3,0.2313
OCC12C3C4C3C1CC24,0.2988
OC1CC2CCC2C=C1,0.2549
COc1cccc(c1)N,0.2109
CC(C=O)C1C(O)C1O,0.2265
COC1CCOC1OC,0.3317
CC#CCCC(C)CO,0.3034
CNC1=CC(=O)N(C1)C,0.2114
C1COc2c1onn2,0.1841
C[NH2+]C[C-]1NC=CC1=O,0.1501
CCC1(CC2OC12)OC,0.3242
CC(=NC)NC(=O)N,0.2423
Cc1nc([nH]n1)NC=N,0.2149
CC(CO)[NH2+]CC([O-])=O,0.2662
CC1C2CC1C2CC#N,0.3437
Cn1ncc(n1)N=CN,0.1973
CC1NC11COC1=O,0.2662
OC1CN2C=NC=C12,0.2506
CC(C(C)=O)C(C)=NO,0.2219
C1C2C1C1OC1C1NC21,0.3015
NC1(C#N)C2OC=NC12,0.2522
CC(O)CC(=O)C=O,0.154
COC=Nc1cnon1,0.2088
CC1CC11CC2OC12,0.3381
Cc1c(onc1NC)C,0.2297
CC12COCC(O1)C2O,0.3181
CC1COC(=N1)C1CO1,0.2518
N#CC12CCOC1CO2,0.2738
CC12CCC1=CCC2,0.2439
N#CC12NC3C4C1N4C23,0.2447
CC1(OC1CCO)C#C,0.2865
CCC1C2CC2(C)C1=O,0.2244
OC12CCN3C1CCC23,0.2915
CCn1cc(c(n1)N)N,0.2185
CCn1ccc(c1)C#N,0.2269
O=C1C2OC2CC11CC1,0.2124
OC12CC1C1CC2O1,0.3159
CC(O)CN(C)C(C)=O,0.2664
C#CC12CCC(CC1)C2,0.3072
c1c(n(c(=O)[nH]1)C=O)O,0.184
CC12CC1CC2C1CO1,0.3281
C#CC1OC=NC11CC1,0.2497
CC1(C)OC1C#CCO,0.2641
CCCCOC=O,0.2865
O=C1CC2CC3C(O1)C23,0.2721
c1(c(c(oc1N)N)O)N,0.2143
Cc1ncc(c(n1)N)N,0.1989
OCC1C2CC2C1CO,0.3224
C1CC23OC2CC2C3N12,0.3061
Cc1c[nH]c(c1O)C=O,0.1811
CC(C)OCC(C)C=O,0.229
COC(=O)C1(CC1)N,0.2425
CC(C)C(C=O)C1CC1,0.2241
CCCC#CCCC,0.2997
C1C(CC1(CO)CO)O,0.309
CC12CC1(C)C1(C)NC21,0.3058
CCC1COC(=N)OC1,0.2874
CCC(=O)C(O)COC,0.2386
OCC12C3C=CC1CN23,0.2292
COC(CCO)C(C)O,0.3226
CC1NC=CC(=O)C=C1,0.1678
CC12C3C1C1C3COC21,0.3328
CC1(C=O)C2NC2C1O,0.2233
CC12C3N1CC2OC3=O,0.253
CC(CC#CC#C)C#N,0.2278
O=CC12C3CN(C13)C2=O,0.2082
N#CC1C2C3C=CC1C23,0.2367
ON=C1COC1C#N,0.247
CC1=C(CC2CC12)C#C,0.1983
Cc1ccc2n1CCC2,0.2369
CCC(O)COC(C)C,0.3252
CC1C2CC11OCCC21,0.325
CN1CC2CC12C(N)=O,0.2449
CC(=O)OC1CC1(C)C,0.2744
CCC#CC1OC1(C)C,0.2726
CC1COC(CN1)C#N,0.2474
CC1C2CC(CCO)C12,0.3293
CCC1CCOC(C)O1,0.3468
CC(=O)C1(CC1)OC=N,0.2241
CC12COC(C1)CCO2,0.3212
N=C(OC(=O)C=O)C#C,0.1776
FC1=NNC(=N)N=C1,0.1393
C1C2COC=NC1C=C2,0.241
CCN1CC1C#N,0.2692
COC(=O)NCCO,0.308
ON=C1COC1C=O,0.2035
Cc1c(ccn1C)NC,0.2148
c1c(onc1O)CCO,0.2466
CCN1CC1CC(C)O,0.3022
CC(O)CCC(C)C=O,0.2264
CC1C2OC=NC2C1=O,0.2042
O=CC12CC1CN1CC21,0.2081
CC1OC1C(=O)CC#N,0.2186
c1cnccc1CC=O,0.2119
CCC1C2NC2C1C=O,0.2068
CN=C1C=CNN=N1,0.1611
CC12CNC(C=O)C1O2,0.2067
COC(=O)C1C2CN1C2,0.2305
CCc1nc([nH]n1)N,0.2542
COC1(C)C2OC2C1C,0.327
N#CC1C2NC3C2NC13,0.2695
CCC(=O)NCC#N,0.2733
CC1(C)C2C3NC3C12C,0.2732
CCOC(=O)C(=O)OC,0.2102
O=CC1CN2C=CN=C12,0.1869
CCC1C2C3CC1C23C,0.3202
CC12C3OC1C3C2C#C,0.277
COC1CCC1(C)C#N,0.2978
CCC1OC11CNC1=O,0.2596
[O-]C(=O)C(=[NH2+])N1CCC1,0.1881
CC(O)CCOCC#N,0.2865
OC12CC1NC=C2C=O,0.1724
CC#CC12CC1(O)CN2,0.2367
CC(C)C1CNC(=O)C1,0.2738
OCCC(=O)OC=N,0.2525
CCC1(CO1)C1CN1C,0.3103
C#CCC12CC1C=CC2,0.248
CC1C(C#N)C1(C)CO,0.3057
CC1OC2(C)CC1CO2,0.3284
C1OC2COCC=CC12,0.2322
C#CCNc1c[nH]cn1,0.2223
c1cn2c(c1N)CCC2,0.2225
COC12C3CC1COC23,0.3019
CC1NCC(C#N)C1=O,0.1996
CC1C2C3(C)OC3C12C,0.286
CC1(C)C(O)COC1=N,0.2877
O=CC1COC(=N1)C#C,0.2013
NC(=[NH2+])[C-](OC=N)C#N,0.2038
CCC(=O)CC(C)C,0.2341
CC1=CC2OCC1(C)O2,0.2437
C(C(CO)C=O)O,0.2288
c1c(nncn1)C(=O)N,0.1649
Cc1ccn(n1)C(=O)N,0.2376
COC(C)C1OCC1C,0.3118
O=CC12CN=C3NC1C23,0.1697
CC(C)C12CC1N1CC21,0.2866
CC(=O)OC1C2CC1O2,0.2555
c1c[nH]c(c1CCO)N,0.2345
CC(C)(CC1CO1)C#N,0.3187
CCC1(CCC1)C(=O)N,0.2707
OCCC(O)C(O)C#N,0.2827
CCC1OC(C)C(C)=C1,0.2491
NC1=CC=C([O-])C(=[NH2+])N1,0.1468
OCC1CC1(C#C)C#C,0.2635
CCC1CC=C(C1)C#C,0.2093
CNc1c(cc[nH]1)C=O,0.1783
CCOC1C2OCC12O,0.2915
C1C2C1C13CC21OCO3,0.2617
O=C1OC2CC3CCC123,0.2672
C1C(=O)CNC(=O)N1,0.2119
CC(O)(C#N)C1CCO1,0.276
CC(=NO)C(C)(C)C,0.2586
COC1C2C(C1C)N2C,0.3
CCC1=CC(CC1)C#C,0.2571
CC(O)C(=O)CC#C,0.2267
CCC1(CO)COC1=O,0.2766
C1OC2CCCC3NC123,0.3111
C1CC1(CO)C(=O)N,0.2661
COC1C2C3CN2C13,0.3047
CC(=O)C1(C)NC1C#C,0.2191
CC1(CO1)C=O,0.2218
CC1COC2=CC=NN12,0.247
OC1C(=O)CC11CCO1,0.2041
C1C2CC1C=CCCO2,0.2503
CC12C3CC(CC1O)C23,0.3241
CC12CC1N=C(N)C2=O,0.171
C#CCN1CC(C1)C#N,0.2628
CC1CCCC(N1)C#N,0.2662
C1CC2OCCCCC12,0.3163
O=CC12CC1CCC2=O,0.2122
CC1OCC2=C1CCC2,0.2492
O=C(CN1CC1)C1OC1,0.2118
C(C(CO)(C#N)C#N)O,0.2969
c1c2c(co1)CCC2,0.2343
CC1OCC11CCC1O,0.3019
O=CC1C2CC2C1C=O,0.2026
CC1CN(C(N)=N)C1=O,0.2303
CCC1C2C1C1CC2O1,0.3375
O=CN1C2C3CC2C13,0.2524
CC1N=C(C)OC1(C)C,0.2711
CNc1c(onn1)CN,0.2156
NC(=O)NC1CC1C=O,0.2249
CCC1COCC1=NO,0.2503
CN1C2CC2C1=O,0.2486
COC12CCC1C2C=O,0.2166
C1CC2(C1)CCC2,0.3563
O=C1CCN2CC(C2)O1,0.2279
CC1CC2CC2(C)CO1,0.3269
CCC12CCC1OC=N2,0.263
N#CCC12OC3C1OC23,0.2825
CCC(=O)c1ccn[nH]1,0.2028
Cc1c(c(c([nH]1)C)O)O,0.2205
CC(O)(C1CN1)C1CO1,0.3143
CCC1C=C(C)C2NC12,0.245
CCc1cocnc1=O,0.208
CC1CC2CC(C)C1O2,0.319
O=C1OCOC1C1CN1,0.2493
FC(F)(F)C1CCO1,0.3309
CCC1C(C)OC1C,0.3177
CCC1=CC(=NO)CN1,0.1742
C1CC2C3OC(C1)OC23,0.3047
CC1=CNC(=N)O1,0.2224
CN1C2CC2C1(C)C=O,0.1999
COC1COCCOC1,0.3177
CCC(=O)C1C2CC1C2,0.2241
CCOCCC(=O)CO,0.2351
CC1=CC(O)=COC1=N,0.1577
CC(C#C)C(F)(F)F,0.3162
NC1=NC2C3OC2C13O,0.2329
CC(C)N1CCCC1=O,0.2664
C1C2CCC3OC13C=C2,0.2303
CC12CC3C1N2C3C#N,0.2777
CC1C2CC3(CN3)C1O2,0.3116
CCOC1CN2C(C)C12,0.2982
CC12CN1C1CC1C2=O,0.2097
COC1C2CC2C11CC1,0.3258
CCC#CCC(=N)OC,0.2681
CC1CNC(=O)C(=O)C1,0.1799
O=C1NC2CC2CO1,0.2899
CC1(C)OCC2NC12,0.311
CCC1CCC=C1C=O,0.1934
CCC1CC(C1)NC=O,0.2796
CCC1NC(C)C1=O,0.2177
O=CC12C3C1C1C3OC21,0.2236
NC1(C=CC2NC12)C#N,0.2271
NCC(C#N)C(O)C#N,0.2514
OC12CN(C1)C21CC1,0.3159
N#CC1CN2CC12,0.2772
Cn1c(=O)c(=O)[nH]nn1,0.2023
C(c1c(c(n[nH]1)O)N)O,0.2282
CCNC(=O)N(C)C=N,0.2515
CC1(CC([O-])=O)CC[NH2+]1,0.2728
CC1C2CC(O)C1C2=O,0.2309
CC1(C)N=COC1C#N,0.2704
CC(C)OC(C#C)C#C,0.273
c1c(c(c(=O)[nH]n1)N)O,0.1681
COC1C2C=CC1N2C,0.219
CC1CC1CCCC#N,0.3141
[O-]C(=O)CC1C[NH+]=CN1,0.24
FC1=CC(=N)C(F)=NO1,0.1876
N=C1COC(CC=O)O1,0.2228
CC12CCCC1(C)O2,0.3333
CC12CC1C1CN1C2=O,0.2361
CCOC(=N)C(=O)C#C,0.1859
CC1C(NC1=O)C(C)=O,0.2202
[NH3+]CC#CC1=CN=N[N-]1,0.1272
CC(=O)CNCC(=O)N,0.2091
C1CC2C=CC3OC2C13,0.2344
CC1(CC1)CCCC#N,0.3133
c1cc(oc1)NC=N,0.2366
C#CC#CC12CC1OC2,0.2039
O=CCC1CC11CCC1,0.2242
COC1CC2(C)CC12C,0.3207
C1C2CC3(OC4CC34)C12,0.3103
OC12C3NC(C13)C2C#N,0.2535
CC(C)NC(=O)CC=O,0.2207
CC1CCC2CC2CC1,0.3363
COC1CC(C)C1C,0.3222
O=C1OC(C#C)C2CC12,0.272
CC1=NC(OC=N)=CN1,0.2264
N=C1OC(=O)NC11CC1,0.2488
CC(CC#N)C1CC1O,0.3109
C1OC2CCCCC2O1,0.3275
O=CC1CC2OCC2=C1,0.2131
CCOC1CC1CC,0.3324
CC12CC1C(=N)N2C=O,0.2332
OCC1(COC1)C1CN1,0.3075
OC1CC2COC12C=O,0.2044
CC(O)COC(C)CO,0.3189
COC1=CC(=N)NN=N1,0.1513
CC1C2OC1(C)C2CO,0.2969
CC(C)(c1ncno1)O,0.2478
COc1cn(cn1)C=O,0.1659
CC1C2CC(C2)C1=NO,0.2569
CC1=CCCCC11CO1,0.2492
c1c2c([nH]n1)CC=C2,0.203
CN1C(CO)CCC1=O,0.2701
OC1COC2CCC2C1,0.3097
OC1COCC1(O)C#N,0.2753
N=C1C=CNN=CC1=O,0.151
CC1OC(=N)C1(C)C,0.2924
CC12CC=CC1C2C#C,0.2395
CC1=CCC23CC(C2)C13,0.2535
OCC1C(O)C1C1CN1,0.2803
C1C2C3N4CCCC13C24,0.2884
CCC1OC11CCOC1,0.3252
CC(C)C12CC(C1)CO2,0.314
CC12NC1C1COC21,0.2903
CC(O)C(CO)CC#N,0.2947
CC(C)COC(C)CO,0.3312
O=C1C2C3C1OC23C#C,0.2131
CCC(=O)CCOCC,0.2352
OCC12COCC1O2,0.3258
C#CC1=CC2(CO2)CC1,0.201
CC(C1C[NH2+]1)C([O-])=O,0.2771
CC1C(C)C1OCC#C,0.2672
CNC(=O)OCCC#C,0.3032
CCn1cc(cn1)N,0.2208
CC1C2CC(C#C)N12,0.26
C1C2C=CC3C=CC2N13,0.2024
CCC12OCC1C2C#C,0.2773
CNc1coc(=NC)[nH]1,0.2235
OC12C3OC1C3C21OC1,0.3046
O=C1C2C3N2C1C31CO1,0.2323
CC(C)(C)OCC#C,0.2883
CC12C3C4CC1C4(C)N23,0.3122
C1COC(O1)C(=O)N,0.2546
CCC(=O)C(O)C1CN1,0.2142
N#CC1C=C2CC3C2N13,0.1649
CCC(CN)(OC)C#N,0.27
C(COCC(=O)N)C=O,0.2087
CC1C2CC1(C#C)N2C,0.2462
CCN=COC(C)C#N,0.2642
CCC1CC1(C=O)C#N,0.2255
CC(O)(C=O)C1CC1O,0.2168
COC=Nc1conn1,0.1995
CN=CN1CC(O)C1=N,0.2153
CCOC1C2C3OC1C23,0.3064
CCC(OC(N)=O)C#C,0.298
C1C2OCC3C=CC2C13,0.2351
Cc1c(c(n[nH]1)C#C)N,0.1996
CC1OC(=O)CCC=C1,0.2543
C1C2C3CCC2C13,0.3897
NC12COC1C(=O)OC2,0.2435
CC1=CC2(CC1C2)C#N,0.238
OCCC#CC1CO1,0.2747
CCC1(O)C2OC(=O)C12,0.2641
CCNc1cnn[nH]1,0.2296
c1c2n(nc1N)CC=C2,0.1692
COC1CC11CC(O)C1,0.3071
O=C1CC2CC11CCN21,0.1954
CC([NH3+])C(C)C([O-])=O,0.2766
OCC1NCC(=O)C=C1,0.1843
CCC1C2NC2C11CO1,0.3034
CC1(O)CC(=O)C11CO1,0.204
CC1(O)CC2CC(C1)O2,0.3115
CC(O)C1(C)CC2CN12,0.2925
C1CC1NC(=N)C=O,0.1699
CCC1(CCC1)C1CO1,0.341
CC1(O)CC2OCC=C12,0.2285
OC1C=CC2CCC12,0.253
C1COCOC(=O)C1=O,0.1885
C#CC1CC2OCC2O1,0.2854
Cc1c(nc(o1)C)NC,0.2013
CC1C2N1C1C(O)C21O,0.278
CC1C2N=COC(=O)C12,0.24
C1CC2C1OC21COC1,0.3096
CC#Cc1cnc(o1)C,0.1959
COC1OCCC(C)=C1,0.2608
Cc1c(c[nH]c1O)NC,0.2193
C1OC2CC3CC1C2C3,0.3143
CC1CCC=CC=CC1,0.2053
C#Cc1c([nH]c(=O)[nH]1)O,0.1894
CC#CC1=NCC(=O)N1,0.2046
CC1OC(CC=O)C1O,0.2238
CC1(CN1)C(=O)NC=O,0.2155
CCC1(C)C2OC(=O)C12,0.2731
CC#CC(C)C(=O)C#N,0.1791
CN(C)c1[nH]nc(n1)N,0.2378
CC1C(O)C11CC(O)C1,0.3124
CC12CC(=O)C1C=CC2,0.2076
OCC#CCC1CO1,0.2839
CC#CC(C)(C)OC=N,0.279
CC(=O)C1COC1=O,0.2286
O=C1OC2C3OC1C23,0.2393
CC1OC2(C)CC12O,0.2973
CCC1OC11CC2CC12,0.334
CC1COCC(=O)C=C1,0.1818
CC(O)C1(O)COC1=N,0.2698
CC1(CC1)OCC1CO1,0.33
NC1=CN2CC(O)C2=N1,0.2068
CC12C3N1CC2=CC3=O,0.1545
CCOC1C2CC1C2,0.344
N=C1OCC=CC1C#N,0.248
CCC1CCC(C1)C#C,0.3115
C1OC1C1=CC2CC1O2,0.2211
CCCC(CO)COC,0.3238
CC12CN1CC21CCC1,0.3023
CC1(N)CC2OC12C#N,0.2516
OC1=CNC(=N)C(O)=N1,0.1412
COCC(=O)OC=N,0.2492
CC12C3C4C3C1C(=O)C24,0.2148
OCC12CC3NC1C3O2,0.2986
COC(C#C)C(O)CO,0.2756
C#CC1C2CC1N2C,0.2614
CC1CNC(=N)N1C=O,0.2358
[NH3+]CC(O)C#CC([O-])=O,0.1118
O=C1CC=C2CC3C2C13,0.1976
COC1CN=COC1=O,0.2301
O=CC1(CN1)C#N,0.2263
CN1C=NC2CC12C=O,0.1927
N#CC1CC2(CC12)C#N,0.2815
OC1C2CC3CCC3C12,0.3128
CC(C1CC1)C(=O)C=O,0.1523
CCCOC(C)(C)C=O,0.226
C1CC11C=CC2OC12,0.2366
COC1CN2CCC12,0.2776
CC1C2C3CC1CN23,0.3211
CCC(C[NH3+])C([O-])=O,0.2745
CC1CC1(OC=O)C=O,0.2205
C1C2CC1N=COCO2,0.2441
Cn1ccnc1COC,0.2395
CC1CC2C3OC(=N1)C23,0.2028
CCC1OC(=N)C2OC12,0.2669
c12c([nH]nn1)nc([nH]2)O,0.2114
OC1C2NC(=O)COC12,0.2482
OCC(C#N)C1CCO1,0.2891
CC1OC(CC=C1)C=O,0.2251
c1cocc1OCCO,0.2348
COC=NC12CC1OC2,0.2308
Cn1cc(c(n1)O)OC,0.2231
C1CC2(CC2)C(=C1)C=O,0.1835
CC(O)(CN1CC1)C=O,0.223
FC1=NOC(=N)N=C1F,0.1669
CC1(C)CC(O)CC1O,0.3187
c1cnc(nc1)OC=O,0.2115
CC1CN1CCC#N,0.2792
C(C#CC#N)C(=O)C#N,0.1951
CC1NC1C1(CO1)C#N,0.2707
CCC(=O)CN=COC,0.2218
c1nc(nnn1)CO,0.1615
C#CCOC1CC2OC12,0.2838
CN=C1CC(CC#C)O1,0.2774
OC(C#C)C1=CN=NN1,0.2494
CC12CC=CCC1(C)O2,0.2702
CC1OCC1([NH3+])C([O-])=O,0.2595
CCN=CN(C)C(=O)N,0.2453
CCN=C1OC(C)C1N,0.2633
N=COC(CC=O)C=O,0.2068
CCn1cncc1C#C,0.2061
C(C(=O)OCC(=O)N)O,0.2719
CCN=C1NN=CC=C1,0.1527
C(C1CN1)N1C2CCC12,0.3032
CCN(C)C(CO)C=O,0.1774
CCC1=CC(=NO)CC1,0.1908
Cn1cccc1O,0.24
CC1CCC2(CC2)O1,0.3115
CC1=CCC(O)C1=NO,0.1946
c1cc(nnc1O)O,0.1839
CC1C2NC2(CO)C1C,0.2818
N=C1NC(C#N)C1C#N,0.26
CCC1(CO)CC1CO,0.329
CC1C(O)C2(CN2)C1=O,0.1992
CC12CCC1(O)C=CC2,0.2538
CCCC(CO)C#N,0.3091
N#CC12CC1CC1OC21,0.2958
CN1C2C3(O)CC1C23O,0.2679
CC12CN1C(C)(C)C2=O,0.2164
C1C2CC3=CCOCC123,0.2493
CC(O)COCCC#N,0.3059
C#CCC12CC1C1OC21,0.2766
CCOC1C2CC1(C)C2,0.3436
COC(C)C(O)C(C)C,0.3245
c1c(=O)c(=O)oncn1,0.1542
CC1(OC1(C)C#N)C=O,0.2163
C1C2CC3COC3=NC12,0.2554
CCN=CNC(=O)C#C,0.2022
c1c-2cnnoc2cn1,0.1038
OC1C2COC1C2C#N,0.2887
OC1CC=C2C3CC3C12,0.2423
CCC1OC(=N)CC1O,0.2848
CC1(C)C2OC(=N)C12,0.274
CC12C3CC1=CCOC23,0.2103
CC#CCOC1CC1,0.2839
C1NC11CCC=C1,0.2385
OCC12CN1CC=CC2,0.2478
CC1=C(C#N)C2CC1O2,0.1972
OC12C3CN=C1NC23,0.1605
[NH3+]CC1=C([O-])ON=C1O,0.2451
CC1CC2C1C2(C)C=O,0.2317
CCC1(C)CCNC1=O,0.2721
CCN1C2CC(C=O)C12,0.2125
C1CN2C1C21CC2OC12,0.313
OC1C2C3CC4C1C2C34,0.3103
CN1CC1CC1(O)CC1,0.301
C1C(=NO)C=CC1=NO,0.1575
C1CC(C1)N2CCC2=O,0.2688
OC12C3C4C1C4(C#C)C23,0.2498
C1OC23C1OC1C2OC31,0.2762
CCC1CCC(C)C1,0.3778
OC1C(NC11CC1)C#N,0.2453
NC1(C#N)C2CC1(O)C2,0.2913
NC(=O)CC1CNC1=O,0.2493
CC1OC1C1=CON=C1,0.2379
N#CC12C3CC1C=CC23,0.2312
CC(=O)N1C2CC(=O)C12,0.21
CC1(OCC1=O)C#C,0.2138
CCC1OC1(C)C(N)=O,0.2639
Cc1cnoc1N(=O)=O,0.187
CC1C(=O)OCC1=NO,0.2428
CC1(CC(=O)C1(C)C)C,0.2193
c1c(c(nc(=O)[nH]1)N)N,0.1815
C1CN1C1C2C3CN2C13,0.3049
N=C1NC=NC(=C1)C#N,0.162
c1([nH]nc(n1)O)O,0.2615
CC12CC3C(N13)C21CN1,0.3022
O=C1CC2OC2(C1)C#C,0.2261
O=CC1(CC#C)CN1,0.2197
CC1CC(C)C1(C)C=O,0.2229
O=C1CCC2CN2CC1,0.2219
OCC1C2CC(=O)CN12,0.2059
OC12CC1(OC2)C=O,0.2015
OCC1(CO)NC1C=O,0.2197
N=C1CC(O1)C1CN1,0.2734
O=C1CC2C3CN3C2C1,0.2131
C1OC2CCCC1CO2,0.3139
CNC1CC1(N)C#N,0.2656
CC(=O)C12CCC1CC2,0.2273
CC1CC2=C(O1)N=NO2,0.184
OC1(CC#N)CC2OC12,0.2866
O=CC1CN2C=CC=C12,0.1775
CC12CC=CC(CO1)O2,0.2552
CCC1(CCC=O)CO1,0.2293
NC(=O)C(CO)CC=O,0.2266
NC12COC1CC2C#N,0.2709
CC(OC(=O)CO)C#N,0.266
c1coc(=O)c(n1)O,0.1728
CCOCCC(=O)C#C,0.1973
C1CN1C(=O)CCC#N,0.2536
CC1NC2C(OC12)C#C,0.2515
CC(C)C(OC=O)C#N,0.2788
CCNC(=N)C(=O)C#C,0.143
CCCC(CC)C#N,0.3461
CC1NC1(C=O)C(C)=O,0.2168
CC1CC2(CC3OC23)C1,0.3279
CC1NCC2OC12C#N,0.2406
CC1(CO1)C1COC1,0.315
O=CN1C2C3NC2C13,0.2528
COC1=NC=NNC1=N,0.1707
Cc1c[nH]c(n1)CC=O,0.1696
CC(C)CC(C)C#C,0.3117
N#CC1CC2(CO2)CN1,0.2787
COCC1(CO)CN1,0.3098
CC12CC3=CC(=O)C1C23,0.1602
COCCC(=O)C(=O)N,0.1784
CCCC1(CO1)C#C,0.2862
OC1(CCNC1=N)C#N,0.2516
CC(C)C1CCN=CO1,0.2726
COc1nc2n(n1)CC2,0.2408
N=C1OC=CC(=C1)C#N,0.1485
CN1CC1C1=CC=NO1,0.2128
CC(C)C1COCC1O,0.3045
c1c(c(c[nH]1)O)C2CC2,0.2333
CCC(OC)C#CC#N,0.2366
OCC1CC1C1CC1O,0.2707
c1c(c(c([nH]1)N)CO)N,0.2135
NC1=CNC(=N)NC1=O,0.1652
OCC(O)C1OC2CC12,0.2941
COC1C(=O)NC11CC1,0.2558
CC1C2C3C4CC4C2C13,0.3478
COC1CC=CCC1=O,0.2146
C1C(=O)C(=O)CO1,0.1354
OCC12CN(C1)C2C=O,0.1962
CC#CCC(C)C#N,0.2887
c1c(c(n[nH]1)N=CN)N,0.182
CC1C2CC2OC1=N,0.2735
c1c(nc(c(n1)O)N)N,0.1678
COC1C(C)CC1=NO,0.2439
OC1CCCCC=C1,0.2548
N=C1OC2CC2(O1)C=O,0.2132
N=C1NC(=CO1)C#C,0.1763
CCC1=CC2C3OC1C23,0.2251
COC1(C)CC1C#C,0.2896
CC(CN)(OC=O)C#N,0.2497
COC1C2NC1C=C2,0.2212
CC(C)(C)OC(=N)C#N,0.2393
c1cc(=O)[nH]nc1,0.1759
OCC1=CC2COC1O2,0.2462
CC#CCC1OC1(C)C,0.3008
N#CCC1OC11COC1,0.2897
Cc1cc2c([nH]1)cco2,0.1985
CC1COC(O1)C1CO1,0.333
CCC(=O)C1OCC=C1,0.2054
OC1C2C3CC3C12C=O,0.1969
c1c(nc(c(n1)N)O)F,0.1748
C1CC23CC(CO2)C13,0.3041
CC1=NOC=C(F)C1=N,0.1841
O=COC1CC1C1CO1,0.2646
COC1C2OCC(O)C12,0.2981
CC1C=CC2CC1O2,0.2392
CC1OC11C2CN2C1=N,0.2394
c1cc([nH]c1)CCO,0.2431
CCC1(C)OC2CCC12,0.3149
CC12CC(CCC1)C2=O,0.221
CC12CC1OCC2=NO,0.2362
Cc1c([nH]nn1)N(C)C,0.2216
CC12OC1CCC2C=O,0.2221
C1C2CC34CCC23N1C4,0.2627
CC(=O)C1(C)COC1=O,0.2219
CNC(=[NH2+])CCC([O-])=O,0.244
OC1C2N=CNC12C#N,0.2301
CC1C(O)C2C3NC3C12,0.2898
NC1=NC(CCO1)C=O,0.2082
CC1(O)C2OC(=O)C12N,0.2334
O=C1CC2CC1C=CC2,0.2129
CC1C2CC(C2O)C1=O,0.2224
CC1CC2OC2CCO1,0.3248
O=COC1CNC1C#N,0.2553
O=C1CNC1C1CN1,0.2096
O=C1NCC2NC2CO1,0.301
CC12CCC(C)(C1)C=C2,0.2562
O=C1NCC11CC2CC12,0.2657
CC1OCC(C=C1)=NO,0.1949
CCC12CC1C(C)O2,0.3121
COC1C2NC2C1CO,0.3026
c1c(n(nn1)CCO)O,0.246
C#CCC12COC1CN2,0.2667
OC1CCC11CC1C#N,0.2964
CC12CCC1(CC2)C=O,0.2157
CCCCOC1CCC1,0.3309
C1NC1C1=NON=N1,0.2047
CNc1c([nH]nn1)CO,0.205
CC(=O)C1(C)CCO1,0.2168
CCCC1CC(O1)C#N,0.2802
O=C1C2CN3CC3C1O2,0.2125
CC(C#N)C(C)(O)C#C,0.297
CC1COCC1=O,0.2177
CCCC(CC)C1CC1,0.3511
COC(=O)NCCC=O,0.222
FC1=CC(=N)ON=C1F,0.1681
Cc1c(oc(n1)N)C=O,0.1793
C1C2C3CC4C(C3)C4N12,0.2968
CC(C)C1OC1C=O,0.2164
OC12CC(C1)C1CC1C2,0.3296
CC(C)(C)N(C=N)C=O,0.2331
CC1=CC=C(N)OC1=N,0.1637
C1CC2C=CC1CC=C2,0.242
CC1(C)N=CNC1C#C,0.2459
OC1CCC2C1CC2=O,0.2159
CC1CC=CC2(C)NC12,0.2431
CCCOC,0.3426
CC1OC1C1COC1C,0.3288
Cn1c2c(c[nH]n2)nn1,0.1962
CC(C=O)C1OCCO1,0.2265
N#CC12C=CC3CC1C23,0.2352
CC12C3N=C4OC1C4C23,0.152
CC12C3C4C3C1CCC24,0.3189
CC1CC2(C)CC1(C)C2,0.3609
c1c(nc(c(=O)o1)O)N,0.1459
OCC1C2NC2C1C#N,0.2668
C(C(CO)(CO)C#N)N,0.2919
O=C1NC2CCC(=O)C12,0.2155
CC1CCCCCCO1,0.3198
CC(C)C(C)CC(C)=O,0.2341
COCC(=O)NC=N,0.2292
OCC12OC3CC1NC23,0.2983
C1CCOCC1,0.3324
CN1CC1CC1COC1,0.3021
OC1C2C3NC3C12C#C,0.237
C1NC11COC2CC12,0.3048
CCC1OC23CN(C2)C13,0.2552
C#CC12CCOCC1N2,0.2787
c1cnc([nH]1)CN2CC2,0.2501
CCn1c(cc(n1)C)C,0.2552
CCCCC1(CCC1)C,0.3562
CC(=O)C1(C)NC1CO,0.221
CC(CC1COC1)C#N,0.2868
CCN(C)c1cnoc1,0.1945
CNC1=NN(C)C(=N)O1,0.2262
CC1C2C3CC3CC12C,0.3106
CCCCN(CC)C=O,0.2705
CCNc1c[nH]c(=O)o1,0.2326
CC1OCC(C)=CC1O,0.2525
CC1C2OCC2OC1=N,0.286
OC12CCC3C4C1C2N34,0.2784
OCC12OC1CC2O,0.3081
CCC1=CC2C3CC1N23,0.216
C#CCNC1(CC1)C#N,0.2627
OC1C=CC2C1NC2=O,0.2341
CCCOCC#CC#C,0.2215
CC12CNC1C(=O)O2,0.2411
CC1OCOCC=C1,0.2618
OCC1CCCOCO1,0.3368
CC(CO)CC1COC1,0.3139
CC1CC2(COC2C)O1,0.3165
CNC(=O)CCCO,0.2799
CC12C3C4C(N13)C24C#N,0.2371
CC1CC1(NC=O)C#C,0.2648
CNC(=O)C1COC1C,0.2619
O=COC12CC3C1NC23,0.2495
O=CC1CC2C3CN2C13,0.2142
OC12C3CC3C3C1CC23,0.3264
CN(C)c1conc1N,0.2181
COC1(C)CC(C1)C#C,0.2941
CC(C)(C)C([NH3+])C([O-])=O,0.264
COC1C=CCC2NC12,0.2613
Cn1ccc(n1)NC=O,0.2231
NC1C2NC(=N)C12O,0.2493
O=C1CC2OC3CNC123,0.198
COC1C2NC1C2=NO,0.2456
C1OC2=C(O1)N=NO2,0.1356
c1c2n(nc1C=O)CC2,0.1995
COC12COCC1C2C,0.3275
C#Cc1ccc(nc1)N,0.1871
CC1CCC11OC1C#C,0.2756
O=CC1NC1(C=O)C#N,0.2083
CC1C2OC1C=C2,0.2367
C#CC1C2N1CC21CC1,0.2664
O=C1CC(=O)C2(CN2)C1,0.1964
CCC1(O)CC2C(O)C12,0.3074
C#CC#Cc1ccc[nH]1,0.1688
CC(CCC=O)N1CC1,0.2238
CC(C)([NH3+])C1=CN=N[N-]1,0.255
C1CC1OC2CC(=O)C2,0.2193
CC1C2CC3(C)C2C13C,0.3226
CC12C3CC=C1CC23O,0.1744
O=COC1CC2CC2O1,0.2636
CCN1N=CC(=N)C=N1,0.1748
O1C2C3C4N=C1C2C34,0.1547
O=C(CC#C)C1CN1,0.2292
C1CC2(CC2)CCOC1,0.3165
C#CC1OC1CC1CC1,0.2802
CN=C1OC=NC(N)=C1,0.1672
CC(O)CC(=O)N1CC1,0.2477
O=CC12CCC1(O2)C#N,0.2113
CCC(NC(N)=O)C=O,0.2187
CN=C1OC2C1C2(C)C,0.2667
c1nncn1CCC#N,0.2558
OC1CC(=O)C1(O)C#C,0.202
OCC1=CCCC2NC12,0.2489
CC12C3C4C1CN=C2N34,0.1518
c1c(c(nc(n1)N)F)O,0.1834
CCC(O)C1(O)CC1,0.3163
CN1CC2OC3C1C23C,0.2778
OC1C2C3NC1C23O,0.285
CC12C3CC1OCC23O,0.2971
CC1C2C=CC1C2=O,0.2481
CC1=CC(=N)ON=C1N,0.1589
CC(CO)N1CC1C=O,0.2116
CCc1cc(no1)N,0.2342
CC1(C)C2C3CC2N13,0.3088
CC1OC(N)=NC1C=O,0.2008
CC1C(C)C1O,0.3165
CC(C)Nc1nc[nH]n1,0.2224
C1C2CCC3OCC3C12,0.3114
OCC1(CN1C=N)C#N,0.2542
C1OC11CC2OCC2=C1,0.2321
O=C1CC2(OC12)C#C,0.2093
OC1CC11COCO1,0.3146
NC12C3CN(C13)C2C#N,0.2493
CC1CCOCC1,0.3328
CC1(O)C2C3C=CC1N23,0.2061
OCC1C2N1CC21CO1,0.3105
Cc1nc(=O)nc(o1)F,0.2195
c1c[nH]c(c1CC#N)O,0.2172
CCC1N=COC1C#C,0.2663
C#CC(C#C)C(=O)C=O,0.1497
CC1C=CCCOC1=O,0.2517
C1CC(=O)COC1,0.2111
C1C2NCC3=C2N1C=N3,0.1802
C#CCOCCCC=O,0.23
CCCCCC(C)C=O,0.2267
Cc1c(=O)cc[nH]n1,0.1919
CC1(C#N)C2CN2C1=N,0.2491
Cc1ccc([nH]1)C(C)C,0.2338
OC1C(COC1=N)C=O,0.229
CC1CCC23CCC12N3,0.283
C1OC2C1N1CCN=C21,0.2317
CC1CC2CC2C1=NO,0.2424
Cc1c(c[nH]n1)N,0.2274
OCC(=O)C1(CO1)C#N,0.2218
CC1(C)CC2CCC1O2,0.3243
NC1=NNC(=N)N=C1F,0.14
C1C2CCC3(COC3)N12,0.305
C1OC1C1C2COCC12,0.3303
Cc1[nH]cc(n1)N(=O)=O,0.1882
COC12CN(C1)CC=C2,0.2212
OCC1CC1C=O,0.2288
CC1COCCOC=N1,0.2605
COC1OCCC1C#C,0.3066
CC1(CO)CC1NC=O,0.2718
O=CC1C2CN1C2C#C,0.2061
O=C1CN2CC(C#C)C12,0.2026
NC1(COC1=O)C#C,0.2379
CC(C)C1(C)CCC1=O,0.214
CC1(C)COCC2NC12,0.309
[NH3+]CC(C1CN1)C([O-])=O,0.2676
O=C1C2COC2C11CN1,0.2066
CCC12CC1OCC2O,0.2971
OC12CC34OCC(C13)C24,0.2965
CC1(CCC(=O)C1=O)C,0.1417
OCC1CCC(=C1)C#N,0.2197
O=CC12CCC1C=CC2,0.2238
CCc1ccc([nH]1)OC,0.2327
CN=C1NC(=O)NC1C,0.2479
CC1OCC(C)=CC1C,0.2618
O=C1OC2CN=COC12,0.2516
COCC12CC(C)C1N2,0.3289
c1coc(=O)c(n1)CO,0.1742
CCOC1CCC(=O)O1,0.278
OC12CC1(O)C1CC1C2,0.2944
OC12CNC1C2(O)C#C,0.2487
CCC1C2C3OCC3N12,0.2721
CC(N)(CNC=O)C#N,0.2743
OCC1OCC2(O)CC12,0.3105
Cc1ccccc1F,0.2335
CC(C=O)C(C)(O)C#C,0.2206
CCC(O)CC(O)CO,0.3113
CC1C(=O)NC1(C)C=O,0.211
CC12OC1C1CC21CO,0.2906
CCOc1ncno1,0.2575
C1C2NC22CCOCC12,0.3397
O=C1CNCC2CCN12,0.2421
N=C1OC2C3CC12CO3,0.2635
OC1C2NCC(=O)C12O,0.1988
CC1(O)CCNC1C#N,0.2697
CC1COCC=CCO1,0.2293
OC1CC2OCCC2=C1,0.2535
CNC(=O)C(CN)C#N,0.2663
CC(O)C1OCC1=NO,0.2398
Cc1c(c(no1)C#N)N,0.1799
CNC(=N)C=O,0.1707
COc1cc([nH]n1)C#N,0.1987
Cc1cccc(c1)C,0.2371
CN1CC2C=CC(=O)C12,0.1637
CCOCC(C)(C)C#C,0.312
OCC1OC1CC1CC1,0.3383
CN(C)C(=O)C1CO1,0.252
N#CC1OC11CN2CC12,0.2473
C1CCC2(CC2)C(=O)C1,0.2239
c1c2cn[nH]c2[nH]c1N,0.2152
N#CC1=CCN2CCC12,0.1885
CCCC1NC1C#CC,0.2765
CC(=O)CC1C2COC12,0.2293
COC1C2OC(=O)C12C,0.2649
COC(C#N)C(C)CO,0.2906
CC12C3NC1C(=N)OC23,0.2402
O=C1NCC2OC2C=C1,0.2084
CCc1cc(on1)CC,0.2463
CC1CN2C=C(N)C=C12,0.2182
CC1CC(CNC=O)C1,0.2827
O=CC12CCC(=O)C1O2,0.196
CC12C3CC1(C3)CC2=O,0.2147
CNc1c(n[nH]n1)C#N,0.1886
COC1=NC=NC(=N)O1,0.194
COC(C)(C)C(C)C=O,0.2221
CC12NC1CC2(C)C=O,0.2077
C(CC(=O)C=O)C=O,0.1514
OC12C3C4CC1OC2C34,0.3033
CC1(CC(C1)C#N)C#N,0.3174
CCC1(CC(C)=O)CN1,0.2242
c1c(nc(c(n1)N)N)O,0.1706
CCC12C3C(O)C1CN23,0.2946
Cc1cc(c([nH]1)N)O,0.2273
c1c([nH]nn1)N2CC2,0.2343
N#CC12CC1CCC=C2,0.2473
Cc1ccn(n1)C(=O)C,0.2196
CC1NC1C(=O)C(N)=N,0.1873
CN(C)Cc1[nH]ccn1,0.2475
CCCCCC=O,0.229
CC12CNC(C1)C(=N)O2,0.2584
O=C1C2CC1(C=C2)C#C,0.2364
CC(C)C#CC(=NO)C,0.2024
CCOc1c(con1)N,0.2199
CCC1CC(=O)C1CC,0.2193
CC(CN(C)C=O)C#C,0.2646
COC1(CC1)CN2CC2,0.2982
CC1(CNC(=O)N1)C#C,0.2813
COC(=O)NC(C)C=O,0.2191
CC1C2C3CC2(O)C13,0.3323
CCCC(NC)C#N,0.2743
c1nc(on1)N,0.249
CCOCC1OC1CO,0.3337
CN1CC2(C)CC12C=O,0.1955
CCC1NC1(CN)C#N,0.2691
CC(O)C12CC=CC1O2,0.2469
CCOC(C)CC#CC,0.3004
OC12C=CCC1N1CC21,0.2365
CCC1CC2CCC2=C1,0.2453
CCCc1c[nH]cn1,0.2524
CC12OC1CCC1CC21,0.336
CC(C)(O)C1(CN1)C#C,0.2813
OC1CN(C=O)C2CC12,0.2599
CC1OC1(C=O)C1CN1,0.2071
Cc1c2c(no1)OCC2,0.2402
Cn1c(nn(c1=O)C)N,0.24
N=C1OC2C3OC1OC23,0.2608
N=C1OCOC(=O)C1=O,0.1602
CN1C(CO)C1(C)C#N,0.268
C#CCCc1nc[nH]n1,0.2607
C1C2COC3C=CC1C23,0.2556
Cc1c([nH]nn1)C(=O)C,0.1984
O=C1C2C3C(C#C)C2C13,0.241
CC#CCOCCCO,0.2839
C1C=CNC(=O)OC=N1,0.2323
Cc1cc(nn1C)CO,0.2548
CC(C)C1C(C)C1O,0.3122
CC(O)C1(COC1)C#C,0.2847
OC1CC2C3CC3C12O,0.2857
CC1C(O)C11OCC=C1,0.2238
CN1C2C(O)C2(O)C1=O,0.2309
CC1C2(C)OCC12C#N,0.2677
CC(C)C1CC1CC#C,0.3139
N=C1CNC(=N)C(=O)N1,0.1889
C#CCc1c(con1)N,0.2109
Cc1c(onc1OC)N,0.2373
CC#CC12CCC1N2,0.2687
CC1C=CCC(O)C1C,0.2626
C(C(CO)(CO)CO)O,0.3095
O=C1COCC2COC12,0.1924
CN=C1CC(CO1)C#N,0.2634
O=C1OCC11CC2OC12,0.2625
CC(O)C1C2NC2C1=O,0.2161
N#CC12OC1CC1NC21,0.2584
CC1(COC1=N)OC=O,0.2706
CNC(=O)C1(CCC1)O,0.2768
N=C(C=O)N1CC=CC1,0.1715
CC1CC2C1OC21CC1,0.2977
CC1=CC(=N)OC1CO,0.2141
CC#CC1=CCC(O)C1,0.2061
CC1COC(CC#C)O1,0.3048
OCC12CC1C1(CC1)C2,0.3181
CN1CC1CCCCO,0.2997
CCN1C=CC(=N)N=C1,0.186
OC1C2CC(C=C2)C1=O,0.2035
C1C2(COC2)OC(=N1)N,0.2809
CCOC(C#C)C#CC,0.2694
CC1OC(=O)C(O)C1C,0.2611
CC1=CC(O)CCC1O,0.2513
CCCOCC(=O)C,0.2324
O=CC1=NC2CC(C2)O1,0.1919
CC(C)C1CC(=O)C1,0.2233
OC1COCC1N1CC1,0.3121
N=C1CCN1C(=O)C=O,0.1692
COC1=NNC(=N)N1,0.2434
CC1(C)C2CC1C(=O)C2,0.2266
CC1N(C)C1(C=O)C#N,0.1973
CC1CC11CC2(CC2)O1,0.29
OC1CC1(CC=O)C=O,0.2186
CC#CC1=CC(C)OC1,0.2041
COC1C(O)CC11CO1,0.3076
CC(=O)C1C2CC1CC2,0.2269
OC1CC2(C1)CN1CC21,0.299
C#CC#CCC(F)(F)F,0.2295
CC1=CCC2OC2C=C1,0.1999
CC(CC#N)C(=O)CO,0.2358
C1NC11CC2OC2C=C1,0.2215
CC(C)(CCO)OC,0.3223
C1NC11CC=CC11CO1,0.2447
CC1NCC2NC2C1=O,0.197
CC#CC(CO)OC=O,0.2614
N=C1C=CON=N1,0.1662
COC1(C)CN2C(C)C12,0.2988
OCC12OCC3C1NC23,0.3146
CC(O)C1(O)CC1,0.315
COC(C#N)C(=O)OC,0.2784
COC1CCOCC1,0.3338
OCC12NC1CC1CC21,0.2876
N=C1OC=NC=NC1=N,0.1932
c1c(nc2n1CCO2)O,0.23
O=C1OC2C3C2C2C3N12,0.2631
c1cc(ncc1N)O,0.1797
C#CC1C2C=CC3C2N13,0.2276
C1CC=CN(C1)C=O,0.2142
ON=C1CC2(CC12)C#C,0.2319
COC1=NC(=N)C=CN1,0.199
Cc1ccn(n1)C2CC2,0.2479
C(CO)N=COCC#N,0.247
CC1OC1(C)C(C)(C)O,0.3313
CCc1ccn(c1)C,0.2445
CC1C(C)C2=CN=CN12,0.2555
COc1c([nH]nc1N)N,0.2392
CN(C)CC(=O)C(=O)N,0.1564
CC12C3CC1C(=O)N23,0.2495
OCC12CC1NC(=O)N2,0.2851
CC1C2C3OC1C23,0.3119
O=CC1C(C=O)C1C=O,0.216
CC(=O)C1COC(=O)C1,0.2257
C#CC(C1CC1)N1CC1,0.2839
CC1C2OC=NC1C=C2,0.2371
N#CC12CC3C(C1)C3C2,0.3261
CC1(COC(=O)O1)C=O,0.2216
CC1(CCC1O)C(N)=O,0.2739
CN(C)c1ccoc1N,0.2198
COC(C)CC(N)=O,0.2736
ON=C1C=CC2C(O)C12,0.1749
CCC1C2C=CC(=O)N12,0.1942
Cc1c([nH]nc1N)C=O,0.158
CN1CC(C#N)C1C#N,0.2479
OC1=CC=C(F)C(=N)O1,0.1656
CC(C)COC(=O)C=O,0.1808
O=C1C2OC3COC1C23,0.1834
c1c(nnnn1)C=O,0.1397
NC1CN2CC2C1C#N,0.2653
CN1CCC1CC#N,0.2595
CCOC1=NCCC1O,0.2763
CC(C=O)N1CC1,0.2244
CCC12COC1C1NC21,0.2922
CCC1(CO)OC1C,0.3351
C1C2N3CC4OCC24C13,0.3048
CC#CC12CC1C1NC21,0.2409
CC1NC1C(C)(O)C#C,0.2887
OC1CC2CC1COC2,0.3215
OCCC1(CO)CCO1,0.3159
CC12CC3C(CO1)C23,0.3289
CC1=C(NC=N1)C1CO1,0.2342
CN1C2CC1(C2)C1CO1,0.2959
CC(COC=O)CC#N,0.2861
CC1(C)OC(=N)C1C=O,0.224
CC1OC11CCC1(C)C,0.333
CC(C)NC(=N)C#N,0.2093
OCC1=CN=CC(=N)N1,0.1538
CC1OC(=O)CN2CC12,0.2439
c1c(c(cn1C=O)O)N,0.1787
CC1OC2(C)CCC=C12,0.2415
CCCc1c(cc[nH]1)C,0.2404
CC1CC(=O)N1C1CC1,0.2699
C1C(CO1)N=CNC=O,0.2186
OCC1C2OCOC12,0.3285
CC1NCC2(NC12)C#N,0.2446
O=C1CCC=C2COC12,0.2072
OC1CCC2=C1C=NN2,0.2534
C1CN2CC3OCC2C13,0.3032
CC(C)(C1(COC1)O)O,0.3066
OC1CC2CN2C(=O)C1,0.2468
OC1CNC1C(=O)C=O,0.1349
O=CCCC12CCC1N2,0.2265
CC1N2CC3C2C13O,0.2865
OC12CC3OC1C23O,0.2786
COCCC(C)(N)C#N,0.2892
O=CC1C2C=CCCN12,0.2002
OC1COC=NCC1O,0.2492
CC1=CC2CC1C=C2C,0.2151
CC12C=CCN1CC2=O,0.2037
c1c(c([nH]n1)C2CC2)O,0.2226
CNC(=O)C1CC1O,0.2541
CN1C2C3CC4C1C2N34,0.2513
CC1(CO)C2CC1C2=O,0.252
COCC(CC=O)OC,0.2228
CCC#CC1CCC=C1,0.2585
CC1CC11COC(=O)O1,0.3155
CCC(O)C1NC1C,0.3144
N=CN1C=NCC1=N,0.216
CN1C=NC(OC=N)=N1,0.2411
CC1N2C(=O)CC12C=O,0.2045
N=C1CNC(=O)O1,0.2726
CC(O)COC(=N)C#N,0.2299
O=C1C2CC=CC1CO2,0.2108
COc1cc([nH]c1O)N,0.2293
O=C(OC1CC1)C1CN1,0.2583
C#CC1CCC2NC12,0.2952
CN1C2CC(=O)C12C#N,0.2103
C#CC1=CCCCOC1,0.2033
CC#CC(O)C1CN1,0.2679
C#Cc1ccc(=O)[nH]c1,0.168
C1C2C3C4C(CC=C24)N13,0.1664
CCOCC(=NO)C#C,0.209
NC(=O)C1CCC=CC1,0.26
CC1=CCCN(C1=O)C,0.2069
C(CO)c1c(nno1)O,0.2017
N=C1C=COC(=O)C=N1,0.1612
COC1(C)COCC1C,0.3094
Cc1c2c([nH]n1)COC2,0.2494
CC1([NH3+])C(N)C1C([O-])=O,0.1447
CC1(C=O)C2C3CC1N23,0.2207
Cc1coc2c1cno2,0.2192
OCC12C3CN=C1NC23,0.168
NC1=NC23CC(C2)C3O1,0.2663
COC(C)(C#N)C(N)=N,0.2507
CC1OC=NC1C(N)=O,0.2468
CCC(O)C1OCCO1,0.331
O=C1CCC11COC=N1,0.2058
CC(O)C1=C(C)NN=C1,0.2505
Cc1cc(=O)onc1N,0.1671
NC1=NC(CO)CCO1,0.2738
O=CC1CC2CC=CC12,0.2217
CCC(C)(CO)CCO,0.3107
OCC1NC1CN1CC1,0.3067
OC12COC11CC2CC1,0.2938
CC1(CC#N)NC1C#N,0.2817
C1CC2C1C1CCC2O1,0.3223
CC(=O)C1CCC1,0.2295
OC1(CC1C#C)C1CC1,0.2744
C1c2c(onc2O)CO1,0.2392
C1NC1C1COC=N1,0.2694
CN=c1cnc(c[nH]1)F,0.1321
CC1COC(=O)CC1=O,0.2237
CN=C1COCC(=N)N1,0.2318
CC1N2CC1(O)C(=O)C2,0.2051
c1(nc(no1)N)C(=N)N,0.1932
CC1C(O)C11OC2CC12,0.2917
CC(N)C(N)C#N,0.2587
CC12OCCC1C2C#N,0.2733
C1C2C1N1CC3OC2C13,0.2845
CN(C=O)C(=N)N,0.238
CC1OCC(C)C(C)=C1,0.2595
C#CC1C2CC1C2,0.299
CC1CC=CC1=NO,0.1933
NC(=O)OC12CC1OC2,0.2856
C1C23COC12COCC3,0.2928
CC(C)C1NC11COC1,0.2998
CC(=O)CC1=CCOC1,0.2024
C1OC2C3CC4CN3C124,0.2529
CC(CO)N1CC1,0.3281
COC1=CNC(=N)C=N1,0.1277
CCC1(CO)NC1CO,0.3025
c1c(c(c[nH]1)O)C#N,0.2086
CC(O)C1(CC#N)CC1,0.3033
C1OC2C3C4CC12CN34,0.3089
C1C2OCC3CN3C12,0.3012
N#CC12OCC3NC1C23,0.2472
Cc1c(cc([nH]1)O)N,0.2295
CN1CC1C(CO)CO,0.2827
COC(C#CC)C(C)C,0.2924
CC1OC(C2CC2)C1O,0.3
N=COC(=O)C#N,0.2154
OC1CC2(CO2)C1,0.3262
CC1=CCC2COC12C,0.2551
COC1(C)CC11COC1,0.31
CCC(=O)OCCC#N,0.2861
CCC12CCCC1CO2,0.3171
CC(O)(CO)C1(C)CC1,0.3147
CNc1cc[nH]c1C#C,0.1818
CC#CCC1C(C)C1C,0.3027
OC1(CCOC1)C=O,0.2237
CN=C1NC(=N)CO1,0.2443
CC1(COC1)C#C,0.2941
Cc1coc(c1NC)C,0.224
CC1(O)C2CC1C21CO1,0.3207
C(CO)C#CC(=O)CO,0.2098
COC(=O)C1NC1(C)C,0.2562
C(c1c(oc(=O)o1)N)O,0.2329
C#CC12CC3N=CN1C23,0.2263
CC12CC1C1OCOC21,0.3336
CC1C2OC1(C)C2C#C,0.2751
OCC12CN1C(C2)C#C,0.2731
O=CC1=CC2CC1O2,0.1812
COC1CCCC1(C)C,0.3219
CN(C)c1cc(no1)N,0.2282
OCC(=O)C1OC1C=O,0.1967
Cc1nc(on1)CN,0.234
C1CC23COCC12CO3,0.3033
OC12CC1N(CC=O)C2,0.1958
COC1(C)CC=CCO1,0.267
CN1C2CC1(CC=O)C2,0.1934
CC1C2C3C2C2C3C12C,0.3015
CC1NC11C2CC1O2,0.312
N#CC1NC2CCNC12,0.2561
O=CC1CN2CC=CC12,0.1957
c1c(cn(n1)CC=O)N,0.1671
CC1(C)C2OC2CC1=O,0.2244
O=C1CC2(O1)C1CC2N1,0.2554
NC1=[NH+]C(=N)C=N[N-]1,0.1772
CC#CC12CC1C1OC21,0.2457
CCC(O)C(C)(C)C,0.3265
CC(O)C1=COC(C)=C1,0.2339
N=C1OC2CC2C=C1,0.2005
CCc1c(=O)[nH]ncn1,0.173
C#CC1CC=CC2OC12,0.24
NC1=C(OC=N)OC=C1,0.2128
CC1N2CC2CC1(C)C,0.297
CC1CC1(C#C)N1CC1,0.2796
CN1CC1(C[NH3+])C([O-])=O,0.2569
CC1CC11CCC1(C)C,0.3339
c1c2c(c(no2)N)on1,0.1983
CC(C)(C)c1cnc[nH]1,0.2505
CC12OCOC1C1OC21,0.299
NC1=NC(C#C)C2OC12,0.2464
CC12OC3CC1(CO)C23,0.2861
O=C1CC23CC(C2)C3O1,0.2781
CC1CC11NC(=N)C1O,0.2521
N=C1C=NN2CCC2=N1,0.1766
CC(C)CCC(O)C=O,0.2354
OCCOCCC1CO1,0.3437
CC1C2C1C1(O)CCC21,0.2962
c1c(oc(c1N)O)CO,0.2069
CC1C2C3NC3(C=O)C12,0.2218
CC(C1CC1)C2CC2,0.3523
CN1CC(C1)N=COC,0.2355
NC1=NC2COC2CO1,0.2747
NC1=CC(OC=N)=CO1,0.208
COCC(C)CC#CC,0.3017
CC(C#C)C(=O)OC=N,0.238
CC12CC1OC1CC1C2,0.2974
CC1(CC1)CC2(CC2)C,0.3381
Cn1cnc(c1CO)N,0.2097
c1cc(n2c1CCC2)N,0.2334
CC1CCC(C)C1=O,0.2189
CC1=CC2CC2(O)CC1,0.2351
OC1CC=C2COCC12,0.2485
CC1CC(=O)N1C(N)=N,0.2312
CC(C)N=C(C#N)NC,0.2032
C1CC11CC2(CO2)C=C1,0.2359
CC1OC2CC2C11CO1,0.3163
O=C1N2C3CC1(C#C)C23,0.2387
OC1C2C3C(C2=O)C13O,0.2436
CC1(CO1)C1(C)CCC1,0.3405
CC1(C)C2C3CC3C12O,0.279
CCN=C1C=COC=C1,0.1922
CC(C#C)N(C)C(N)=O,0.2745
C1CC=C(C1)C(=O)N,0.2194
CC12C3CN1C(=O)CC23,0.2323
OC1C=CCC2CC12,0.2639
O=C1C2C3OC4C3C2C14,0.2215
N=C1CCC=CC(=O)O1,0.22
CN=C1COC(=O)N1,0.2545
COC=NCCC#N,0.2696
O=C1C2CC1(O2)C#C,0.2325
CC1C2CC2C1CC=O,0.226
C1C23CC=CC12C=CC3,0.2287
CC(C)(C)C(C=O)C#C,0.2168
Cc1cc2c([nH]1)cn[nH]2,0.2093
CC1(C)CC2OC(=N)C12,0.2828
OC12C3C1N1CC2C31,0.2804
C1C=Cc2c1n[nH]c2O,0.2014
C1NC23CNC12C1NC31,0.2633
C1CN1C1CCC2OC12,0.3155
CC(=O)C1(C)OCC1O,0.2142
CCC1(NC1C)C1CO1,0.3207
c1cncnc[nH]cn1,0.1682
O=C1CC(=O)C2CC2N1,0.217
[NH3+]C12CC1(OC2)C([O-])=O,0.1784
CCCC(C)C1(C)CO1,0.3419
C(C=O)C(=O)CC(=O)N,0.2094
NC(=O)C12CC(=O)C1N2,0.2136
CC#CC1CCC(=O)N1,0.2665
O=C1C2C3NC1C1C3N21,0.2082
CCC#CC1(COC1)C,0.2922
NC(=O)C1CCC2CC12,0.2725
OCC1=NC(=N)ON=C1,0.1646
CC(C)(O)C1CCOC1,0.2984
CC1C(C)C1(C)N1CC1,0.3006
OC1CCC(O)C1O,0.2938
O=CCCC12CN(C1)C2,0.2088
CN1CC23CC(C12)N3C,0.2752
CC1(O)COCOC1=O,0.269
CCCC(O)COC=O,0.2852
CC1(O)CCC1(O)CO,0.3126
CCC12CN1C=CC2=O,0.1881
NC1=CC(=N)C=NO1,0.1693
COC(C#C)C(=O)C#N,0.1946
OCC12CC1OC(=O)C2,0.277
COC1C=CNC1=O,0.2058
COCC1C2OCC12O,0.2891
CC1C2N3CC1(O)C23C,0.2851
CCC1=CC(C)COC1,0.2576
O=CC1=CC(=O)C2OC12,0.1438
OC1CC=C(C#C)C1O,0.2075
CNc1nc([nH]n1)C=O,0.1487
CC1CC23COC2CC13,0.3052
OCC12CC1(O)C1NC21,0.3017
CC1OC2CC2(O)C1C,0.2884
C(C#N)NC(=N)C#N,0.2181
CC12OC3C(OC13)C=C2,0.229
C#CCCC(=O)NC=O,0.2195
CC#CC(O)C(=O)C=O,0.1481
COC=NC1CC1OC,0.2524
CCCN=COCC,0.2699
CCC12COC(=N)C1O2,0.2674
CN=C1OCC=C1CO,0.2128
O=C1C2CC1C1(CC1)C2,0.2272
CC12OC1C1COC21C,0.3
OC1C(CC#C)OC1=O,0.2606
C1C2OCCCCOC12,0.2968
C#CCNc1cnon1,0.2095
CC#CC(C#N)(C#N)O,0.2543
OC(CCC#N)C1CC1,0.3211
CCCC(CO)(CO)O,0.3187
COC12CC1C1OC1C2,0.3258
C#CCC(=O)COC=O,0.2264
CC1CC2OCCCC12,0.3126
CC1CN2CC12CO,0.3108
C1C2OC11CC=CC21,0.2356
NC(=NCC=O)C1CO1,0.2249
O=CC1CCCC2NC12,0.216
CC(=O)c1c(nco1)O,0.1808
CC(C)Oc1cnon1,0.2275
c1(c(=O)nc(on1)O)N,0.2
N#CC1OC2C3NC2C13,0.2603
CC1(O)CC2C3CN3C12,0.2925
C1CN1CCC#CCO,0.2717
CCC12CC1CCOC2,0.3266
CC12NC1C1(C)CCC21,0.2965
CC1(C)C2C3CC1N23,0.3202
OCC1C(O)CC1=NO,0.2407
CC12OC1C1(C)OC21,0.2959
CC(O)C1=C(N)N=NN1,0.2212
O=C1CC2COC(=O)N12,0.2528
CCn1cccc1C,0.2389
CNc1c(nn(n1)C)N,0.2037
CC1C(O)C2CCC12C,0.3079
ON=C(C1CC1)C1CN1,0.2324
O=C1C2NC2C1C#N,0.2179
CC1(CCC1)C(=O)C#C,0.2018
Cc1c(c([nH]n1)N)OC,0.2371
CC(C)(C)OCC(=O)N,0.2809
CC1(C)C2CC2C1C=O,0.2202
COC1CC2(C1)COC2,0.3133
CC1C2CC1C(C)=C2C,0.2351
C1CC1(COCC=O)O,0.2221
Cc1c(c(=O)cno1)F,0.1852
N#CC1C2C3NC3C12,0.2553
CC1(O)CN2C(CO)C12,0.2938
CC(=O)C(=O)N,0.1784
CC1(CC2(CN2)C1)C#N,0.2881
CCCC1C2NC2C1O,0.3096
CC(C)NC(C)C#N,0.2724
C1C2CC3=CCCOC123,0.2422
CC12C3OC1C1CC3C21,0.2945
O=C1OC2CC2C1=O,0.1742
OC1CC2OCCOC12,0.2903
C1NC1C1=CN=NC=N1,0.1667
OCC#CC1NC1C#N,0.2597
OC1=NC(=O)C=NC=N1,0.1534
CC12CC1C(=O)NCC2,0.2641
c1c(c([nH]c1N)C=O)N,0.1676
c1nc(on1)C2CCC2,0.2547
C(C1OC(=O)C(=O)O1)O,0.2114
OCC1OC11CCC1O,0.3088
CC12CN(C1)C2CC#C,0.2803
OC1CC2OC2C1=O,0.2081
OC(CCNC=O)C=O,0.2156
c1c(oc(=O)o1)N,0.2512
OC12CC3OCC1C23,0.3163
CC12CC(=O)C1(O2)C=O,0.1972
CC12C3CC=C1CN23,0.1728
CCC12CC(C1)C1CC21,0.3391
CC1C2OCC12CO,0.2998
CC1=C2C3CC3C2CC1,0.2358
O=CC1OC2CCC12,0.2156
CC1(C)CC2(CN12)C#C,0.2544
COC1(C)CC1(C)OC,0.3275
COC1C2CC1CC2,0.3345
OC1C2OC3C1C2C3=O,0.2128
c1c(c(c(cn1)F)O)F,0.235
OCC12NC3C1OC23,0.2889
O=C1C2C3CN2C3C1=O,0.1431
C(=O)NC(=O)NC=O,0.2167
C(CO)NC(=N)C#N,0.211
CN1C(=N)ON=CC1=O,0.1864
Cc1ncc(cn1)CO,0.2068
CC12CCC(C)(C)C1O2,0.3317
OCC1OCCC2NC12,0.3056
C1C2NC22COCC=C12,0.2474
CC1OC2CCC1O2,0.3302
CC#CC#CCC1CN1,0.2257
OCCC1CCOC=N1,0.2639
Cc1c(cc(o1)NC)O,0.2125
CC1C2NC1(C)C2=O,0.2473
N=C1NC(=NO1)C1CO1,0.2144
CN1C2CC(CC=O)C12,0.2139
CCC(OCC#N)C#C,0.2834
CC1(CN1)C([NH3+])C([O-])=O,0.2641
C#Cc1ccccc1F,0.1992
c1cc(oc1)C#CC=O,0.1588
O=CC12C=CC3C1CN23,0.1877
CC(C)(CC=O)COC,0.2253
CC1N2CC2(C=O)C1=O,0.1982
COC1CCC=C(C)C1,0.2619
CN1C2CCC1C(=O)C2,0.2108
Cn1c(cc(n1)C#C)N,0.2142
CCC1CC11CCC1O,0.3258
CC1N2CC(=O)C12C,0.2164
CC1CO1,0.3685
Cc1c(c(co1)N)NC,0.2223
CC1OC1(C#C)C1CO1,0.2779
OC1(CNC1=N)C=O,0.2051
CC1(CC1)N(C)C(=O)N,0.29
NC(=O)C1(O)CCC1=O,0.2156
CC1(O)C2CN2C11CC1,0.3004
CC1(O)C(CC1=O)C=O,0.2051
CNc1c(=O)ccon1,0.1758
O=C1C2CC2C1C#C,0.2208
CCC1(CC1)OCC#C,0.2869
CC1COCC1(O)C#N,0.2746
CC12OCC11CC2CO1,0.2806
N#CC1C2N1CC21CC1,0.2688
OCC1COC(C1)C=O,0.2137
CNCC(NC)C#N,0.266
CC12C3CCN1CC23O,0.2889
C1NC1C1(CN1)C1CO1,0.3155
Cc1c(c(ncn1)F)F,0.2278
CCC1(CC1C=O)C#N,0.2207
CC12CC1C=CC(O)C2,0.2373
CC1(O)C2CCCOC12,0.2897
CC12OC3C1OC2C3=O,0.195
COC1(CN2CC12)C#C,0.2637
CC(=N)N(C=O)C(=N)C,0.2219
O=C1NN=NC=CC1=O,0.1489
COC1C2CC2OC1C,0.3049
N=C1OCC2OCC1O2,0.28
C#CC(=O)NC1CCC1,0.2271
[NH3+]C1CC1(C#N)C([O-])=O,0.1624
OCC12COC1CCC2,0.3085
Cc1cn(nc1OC)C,0.2369
C1CC2(C1)C1CCC2O1,0.322
CCOCC(CO)C#N,0.3008
CCC(CC#C)C#N,0.3052
CC(C#N)C12CN(C1)C2,0.2712
CCC12CC1C1C(O)C21,0.2738
O=CN1CC2OCC12,0.2657
CC(C)(C1CC(=O)C1)O,0.2251
OC1CCC2=C1NN=N2,0.2379
CC1CC2OC11CCC21,0.291
c1cnoc1CC2CC2,0.2438
OCC1CC2(CN12)C#N,0.2593
O=C1CC2CCCC2N1,0.2761
OCC(O)C1(CC1)C#N,0.2811
CC1(CN1)C12CCC1O2,0.3212
NC1=C(NC=N1)C1CN1,0.2156
CNC(=O)c1ncco1,0.2106
OC1C=CC(=O)C2NC12,0.1857
C1CC2(C1)CCNC2=O,0.2672
CCN(C)CC(=O)OC,0.2311
OC1CC2C3CC(C3)C12,0.3215
COc1c(cco1)C#C,0.21
CC1(Cc2n1cnc2)C,0.2574
CC(C)(C)COC(=O)N,0.3229
CC1OC(=O)C1N1CC1,0.241
CCN1C2CCC(O)C12,0.2824
CCC1C2COC12CO,0.3001
CCC(=O)CC1(CC1)C,0.2253
OCC1(O)CN2CC12,0.2803
c1cncc2c1CCN2,0.1906
C1CC23OCOC2(C1)C3,0.317
CC(=N)OC1=NON=N1,0.212
COC1CC(C1)N1CC1,0.3091
C1C(=O)NC=N1,0.2318
CCC1(O)CC2CC1C2,0.3269
CC(C)(C)COC=NC,0.2724
CC(C)CC(=O)NC=O,0.2203
CC1(CCC(=O)N1C)C,0.2705
O=CC12CN3C(CN1)C23,0.1898
OC(C=O)C1OC1C#C,0.2146
CC1=CC2(CO)OC2C1,0.2427
CN(CC(=O)C=O)C=O,0.1343
CC1OC2C3NC3C12O,0.2857
C1C2OC1C1=CNC=C21,0.2534
C1C=CCC=CC=C1,0.1852
CC(C)N1CC1(C)C=O,0.2165
c1cn(c(n1)O)CC=O,0.172
C(CC(=NO)CO)CO,0.2584
OC1CC11N2CC2C1=O,0.2141
O=CCC(CC#C)C#N,0.2244
OCC12CC3C4C3C1C24,0.2898
NC1=CC(N)=NOC1=N,0.1685
COCC1CCC2OC12,0.3443
CCC(C)(CC#N)C#N,0.3379
OC1CC11OC2CNC12,0.2854
CCC1C2CNC(=O)N12,0.2821
CN1CC=CC1(C)C#N,0.2199
C1CC2(C1)CC3(O2)CC3,0.297
CCNc1[nH]c(=O)[nH]n1,0.2488
CCNc1[nH]nc(n1)N,0.2424
CC1(O)CC1([NH3+])C([O-])=O,0.2454
OC1C2CN3C2C(=O)C13,0.2172
CC(C)C1CC11CCO1,0.2963
CC1CC(C)=CCO1,0.262
CN1CCCCNC1=O,0.2855
CC12N=COC3C1CC23,0.2633
O=CC1C2CNC12C#N,0.2003
OC1C(O)C1(O)C#N,0.2688
CN1CC(C#N)C1CO,0.2611
CC(=O)CC(C)(C)C#N,0.231
CC(CO)CC(N)=O,0.2785
CC(CNCC=O)C#N,0.2204
[NH3+]C(CO)(CO)C([O-])=O,0.2618
C(CNC=O)CO,0.2838
COC1C2C3OC2C13C,0.3126
COC(=O)C1=CNCC1,0.188
C1CC(=O)C(=C1)CCO,0.1971
CC12CN1CC2O,0.2949
CC1(C)OC1C#CC#C,0.214
C(=O)N(C(=O)N)C(=O)N,0.2358
O=C1NC2C3OCC1C23,0.2523
CC1=CNC(=C1)C1CO1,0.2287
CC12CC1CC(O)CC2,0.3296
C#CC12CCC1(N2)C#C,0.2395
N#CCC12C3CC1CC23,0.2937
c1c(nc(=O)on1)C#N,0.1528
C#CC(C#C)N1CC1,0.2659
C#CCC1OCC1C#C,0.2772
CCC1CC2(C)CCC12,0.3362
CC(=N)OCC1CC1,0.2941
C(C1CO1)C12CC1OC2,0.3064
CC1(O)C=CC2COC12,0.2556
CCn1cc(nn1)C#C,0.2268
Cc1c(=O)occn1,0.1738
CC12C=CC3C(C13)C2=O,0.2034
OCC1C2CN2C11CC1,0.2924
CC1CC2C(OC12)C#N,0.2763
CC12CC1CC(O)C2O,0.3049
CC1OC2C1COC2=N,0.2615
C(C#CC(=N)NC=O)O,0.2113
Cc1c(ccn1C)OC,0.2235
CC12CC(C1)OCC2,0.3152
CC1C(C)C1(O)CCO,0.3072
O=C1OC2C3C4C3C1C24,0.2571
C1C2C3C1C21OCC=C31,0.2532
CC1CC(OCO1)C=O,0.2149
CC1CCC(=O)C=CC1,0.19
C1C2CN1C1=C2NN=C1,0.2357
N=C1CC(CCC#N)O1,0.2916
OCC1=CCCC2OC12,0.2459
CC1=CC(=NO)CCC1,0.1921
OC1CC11CC=CCO1,0.2644
C1CCCC(CC1)CO,0.3404
CCC1(CC=CC1)CC,0.2652
c1c2c([nH]c1O)OCO2,0.2045
CC(C=O)N1CC1C,0.2161
CN(C)C(=O)COC=O,0.247
CCN(C=O)C(=N)OC,0.2429
CCC12CC(C1)OC2,0.3125
CC1(NC1CO)C(N)=O,0.265
CCN(C)C(=O)N,0.2915
O=CCC1CC(=O)CO1,0.2112
OCC12CC1OCC=C2,0.2493
CN1C2CC(C2)OC1=O,0.2889
CC1CN1C=O,0.2544
OC1C(O)C11CCCC1,0.2822
CC1CC(C)=CC1O,0.2572
CC1C2C3OC3C(=O)C12,0.2023
CC1N2C3CC=C1C23C,0.1738
c1c(nc(c(n1)O)F)O,0.1782
OC12CC3C(C13)C21CO1,0.3326
C1C2C3C4OC4CC1C23,0.3259
C1C2C3C2C2C1C32,0.3111
OC1C2CC1C(=C2)C#C,0.193
Cc1c(c(co1)CO)N,0.2277
CC(=O)N1CC2CC12,0.2586
OCCCC1CC1C#N,0.3002
CC1(O)C2NC11CNC21,0.261
CC1=CC2OC2C2CC12,0.2379
C1CN2C1C21COC1,0.3048
C#CC1=CC2OC1C=C2,0.1759
CC12CC(CC1)C2=NO,0.2629
C1CC2C3CCC2C13,0.3664
COCC12CC1C(=O)N2,0.2557
C#CC12COC1COC2,0.2859
CCOc1c(cn[nH]1)N,0.2391
CC(C#N)C1C(C)N1C,0.261
O=CC1CCC2(CO2)C1,0.2277
CC(C)C1C(C)OC1=N,0.2883
C1C2C3C2N2C4C1C4C32,0.2803
OC12CC3C1NC23C#N,0.2598
CC1=CC2C(O)C2(O)C1,0.2328
Cc1cn(c(n1)CO)C,0.231
C1CN1c2c(nno2)N,0.1831
CC1CC2OC=NC12C,0.2622
CC1C2C3C(CN23)N1C,0.2834
CC(COC=O)NC=O,0.2696
CN1CC1C1=CON=N1,0.19
O=C1OC2CCCNC12,0.2364
CCC12CC3C(C1)C23O,0.298
OC1CCCCC11CN1,0.302
N=C1CC=CC=CCO1,0.1996
CCCCCC(=O)C#N,0.2108
CC12CC1(CCO)CO2,0.3026
CCOC1CC1C1CO1,0.3347
CCC1(C)NC=CC1=O,0.19
OC12CCCC3C1OC23,0.3105
O=C1C2OC3CCN1C23,0.2333
OC1(CC1)C1(CN1)C#C,0.2732
CCOCC1COC1C,0.326
COC1CCCN=CO1,0.2664
C1C=CC2C=CC3OC123,0.2413
CC1C2CC1CCCC2,0.3543
CC1COC2OCC=C12,0.2514
CC1CC23CCC2C1O3,0.2935
C#CCOC(=O)CC=O,0.2265
CCOCCC1CC1,0.3407
c1c2c(n[nH]1)CC=CC2,0.2494
CC1C2CC3(CO3)C12O,0.3138
CC1NC2CC1OC2=O,0.2491
CC(C)C#CCO,0.277
C(CC(=O)NC=N)CO,0.229
OC1COC2CC(C2)C1,0.3088
C1C2CC3CCC2CC13,0.3599
C1CC11OCC11CN1,0.2929
C1CC2OC12,0.3468
C1C2OC3C4CCC12C34,0.3074
CC(C)C1(CCCC1)C,0.3635
c1concc1=O,0.1836
COC1OC(=N)CC1O,0.2853
CC1(C)C2CN2CC1O,0.2896
OCC1COC1=O,0.2782
CC1(C)N=COCC1O,0.2646
CCCC(C)OCC=O,0.2284
CC1OC11C2OC2C1C,0.3211
COC12CC1C1CC21C,0.2828
C[NH2+]CCC(=O)C([O-])=O,0.1052
CC1OCC=C1C=O,0.1817
CC12C3OC3C1N2C=O,0.2443
NC1=CC(=NO)C(O)C1,0.1888
OC1C2CCC1C=C2,0.2604
CC(C)CC#N,0.3507
CN1CC2(CC2)NC1=O,0.2872
COC12CC1(O)C1NC21,0.3096
NC1=COC=C1C1CN1,0.2187
CCN(C)C(=O)N1CC1,0.2743
OC1C(O)C1(C=O)C#N,0.2086
OCC1CC2(CN2)CO1,0.3114
NC(=N)C1(CO1)C(N)=O,0.2444
C1CC23CC4N2CCC134,0.2814
c1coc(nc1=O)C=O,0.1567
OC1CCC11CCC1=O,0.2104
CC1CC11CCC1C#N,0.3052
OC12CC1(OC2)C1CO1,0.2818
CCC1CC(O)C2CN12,0.296
O=CC1OC11CC2OC12,0.2192
NC1(CC1)C1(CN1)C#N,0.2827
CC1CC2(CCC2)C1O,0.3092
CC12CC=CC1(C)O2,0.2474
CC1N2CCC12C(C)=O,0.2076
O=C(C#C)C1OC1C#N,0.1975
O=C1COC(=O)C2NC12,0.2152
CCC1(C)CN2CC12,0.3083
COC(C(C)O)C1CO1,0.3242
OCC12CC3CCC1N23,0.3172
CC1C(O)COC1CO,0.2985
CCc1cc2n(c1)CC2,0.2477
C1COCC(=O)CC=C1,0.2069
CC1C2CC1C2OC=O,0.2865
CCCC#CC(C)OC,0.2886
CC12OC3C1OC23C#N,0.2502
NC(=O)OCC1CO1,0.3231
OC12COCC1C1NC21,0.2903
ON=C1CC2C(O)CC12,0.2468
CCC1C(O)C1CC#C,0.3029
CCC1NC1CCC#N,0.2991
CC1(C)OCC2CC12O,0.3132
CCC1(O)CC1NC=O,0.2686
OC1CC2(OCC12)C#C,0.2712
CC(CCO)N1CC1,0.3094
N#CC1C2CCC1C=C2,0.2509
CCC1(COC=N1)CC,0.2706
CC(=O)C(=O)C1CCC1,0.1555
CCC(O)C([NH3+])C([O-])=O,0.2554
CCC1COC(=O)C1N,0.2476
O=C1CC2NC2C=CN1,0.2173
C1OC2CC3OC=NC123,0.2478
OCC1CN2N=CC=C12,0.2632
OC1C2CC(C#C)C12O,0.276
C1CC1(C(=O)CO)O,0.2321
CC12CCC1CC(=O)O2,0.2789
Cn1cnc2c1cc[nH]2,0.2079
CC1(C)CC2C3CC1N23,0.3078
CC12CN1CC2(O)CO,0.2829
c1c(c2c(o1)ocn2)N,0.2049
CNC12C(O)C1CC2=O,0.2167
CN1CC2(CC2)C1C#N,0.2482
CC12C(CO)C3C1CN23,0.2943
CCC12CC1(CO2)C#N,0.2672
C1COC=NCC(=O)N1,0.2313
O=C1NC2CCC=CC12,0.2436
CC12C3CC1=CC1C3N21,0.1751
CC#CC12CC1OCO2,0.2551
CC12C3NC1=CC(=O)C23,0.1532
COCC1CC(O1)C=O,0.2139
CC1(CCN1)C#N,0.2702
CCC12C3C(CN13)C2C,0.3123
CC1CC(=N)NC(=O)O1,0.2581
CC(CC#C)(CC#C)O,0.2836
Cc1c(n[nH]c1O)C,0.2542
O=CCC12CN1CC=C2,0.2034
CC1CC(O)C2CCC12,0.326
OC1C(O)C1C#CC#C,0.2071
N#CC1NCCC11CC1,0.2741
N#CC1=CCN2CC12,0.1923
COC1=NCC(=O)CN1,0.2085
CC(O)(C#N)C1(C)CN1,0.2696
CCOCCC#CC=O,0.2053
CC(O)CC1(C)CC1C,0.321
COC1CC1C(=O)C#C,0.2031
COC(C)C(C)C#C,0.307
O=C1OCOCC2OC12,0.2479
Cc1c(=O)occ(n1)N,0.1406
CC12C=CCN1C2CO,0.2268
O=C1OC2C3COC3C12,0.2654
CCC1CC11CC(=O)C1,0.221
CC1(C)C(O)CN1C=O,0.2675
OCCC(C=O)C#C,0.2205
COCC1OC(=O)C1O,0.26
CC1CN1CC(C)(C)C,0.2998
COC1C2(O)COC12C,0.2874
CCN1C2CC1C21CN1,0.2926
C(C=O)C(=N)NC(=O)N,0.2196
Cc1c(nno1)C#N,0.2212
C1CC(O1)C12CC(C1)O2,0.3135
CCCOC=NCC#C,0.2709
CCCOC=O,0.2866
Cn1cc(c(n1)O)N,0.2161
CC1OC1CCC(N)=O,0.279
O=CC(=O)CCC1CO1,0.157
C1C(=O)OCOC(=N1)N,0.2432
CC1CC1N1CC1C=O,0.2093
O=C1NC=NC2COC12,0.2141
CC(NCC#N)C#C,0.2626
COC1C2C3OC2(C)C13,0.3125
CC1OC11CCCC1O,0.3066
Cc1c(cno1)C(C)C,0.238
CC(O)(C#N)C1CC1,0.315
CC12C3C4CN1C2C34,0.3018
CC1CC2OC2C11CC1,0.3386
OC1CC23CC12OC=N3,0.2327
O=CC12CC(C1)OC2=O,0.2204
C1CN2C1=NCCN=C2,0.2146
COC1C2C3CC1OC23,0.311
OC1COCC11CCO1,0.2884
CCCc1c([nH]cn1)O,0.2396
CC1N2C(C)C1(O)C2C,0.3061
CCC1OCC2COC12,0.3184
C1CC1C1OC1C1CC1,0.3415
N1C2C3OC4C1C2OC34,0.2722
c1nc2c(o1)COCO2,0.2183
CC(=O)C1CC1C=O,0.2039
CCC12C(C)C1C1CC21,0.2778
O=CN1CC2OC2C=C1,0.2006
OC1C2CN2C1C#C,0.2561
CC(O)C(=N)OC(C)=O,0.2309
OC12CNC1C(=O)OC2,0.2447
CC(C=O)C1CC1C,0.2244
OCC1C2C3OC3CN12,0.2783
CC1OC2CC2C1(C)O,0.2959
c1c2n(c(n1)O)CC=C2,0.1738
COC1COC1C(C)O,0.3088
ON=C1C2OC1C1CC21,0.2544
O=CC1OCC11CO1,0.2172
OC1(CC=O)CC1C=O,0.2085
CC(CNC=O)CC#N,0.2783
O=C1C2C=CC1C21CO1,0.2414
CC1=C2COC2CC1=O,0.1933
c1c(non1)N2CCC2,0.1983
CN1C2CC2N=C1C#N,0.183
CCC12C(C)C1N1CC21,0.2809
CNC(CCC#N)C#N,0.2676
CC12C3CN4C(CN13)C24,0.3005
C1C2C3OCC=CC2C13,0.2453
C1OC23C1CC21CC3C1,0.2828
O1C2C=CC3OC2C13,0.2293
Cn1cnc(n1)C(=O)N,0.2231
Cc1cn[nH]c1C#N,0.2198
CC1CC2N1C2(C)C#C,0.2743
CC12CC(=O)C1CCO2,0.2108
OCC1(O)COC1C=O,0.2105
OCC1CC2CC2C1=O,0.2213
NC(=O)C1N2CC1(O)C2,0.2671
CC1C(C)(O)CC1(C)O,0.314
COC1C2C3OC1OC23,0.318
C#CCc1cn[nH]c1N,0.2378
CC(=O)C1CC(C1)(C)C,0.2311
c1c(n[nH]c1N)CO,0.2403
OC1CCOCC(=O)C1,0.2125
CC12C3C(CN13)C2=O,0.2281
CCN(C(=N)C)C(=O)C,0.2364
CC(CC#C)C(N)=O,0.2717
CCC1(O)C2OCC12C,0.2865
O=C1CCC2CC2CC1,0.2255
OC1CCC2(CN2)C1=O,0.21
CC1C2C=CC1N2C=O,0.2214
CC(C=O)C1=NON=C1,0.2079
CC1=C(COCC1)CO,0.2512
CCCC(C)(O)C=O,0.2257
OCC1CC=CC2CN12,0.2355
OC1CCC(C1)C1CO1,0.3297
OC12CC(CC#N)(C1)C2,0.3033
CC1C2N1C(C)C21CO1,0.3111
CCC1CCC(C)=CC1,0.2614
O=CC12CC=C3CN1C23,0.167
CCC1(CC=CC1)OC,0.265
CC1(C#N)C2NC2C1N,0.2773
CCC1C(=O)CCC1=O,0.199
NC12CCC1(O)C2C#N,0.2619
CC12OC1C1=CCOC21,0.2252
CCC(=NO)C1(CC1)C,0.2492
CC1CC2=CCOC2=N1,0.2064
C1CC11C2CC1C21CC1,0.3613
Cc1cc(ccc1O)O,0.1969
CC1OC1CCO,0.3388
CN1CC11COC1C#N,0.2536
Cc1cc[nH]c1N,0.248
COc1c(c[nH]n1)O,0.2317
CCC12NCC1OC2=O,0.2449
CC1CC2CCC=C2C1,0.2498
C#CC12OC3C4C1N4C23,0.2567
CCCCC1OC2CC12,0.3209
COC12CC1(CC2)C=O,0.2012
CC(C)(C)C1(CN1)C#C,0.2862
Cn1cnc2c1non2,0.2008
CCC12COC1C1CC21,0.3106
COC(=O)CNCC#N,0.251
CC1=CC2OC2C11CC1,0.234
CC1CN1C(C=O)C#C,0.2067
CC12C3CC(C)(C13)C2O,0.3229
CC1C2CCC(C2)C1O,0.3209
O=CC1N=CNC1C#C,0.2128
c1c-2nconc2cn1,0.1274
OCC1CCOC1CO,0.3257
CC(CC#C)C#CCO,0.274
CN=C1OC2COC12C,0.2611
OCC12CN3C(CC13)C2,0.2892
CC1CN2CC12CC=O,0.2108
OC1(CC2CC12)C#N,0.2938
Cc1c(c([nH]c1O)O)N,0.2135
C1CCC(=O)NC(=O)C1,0.2276
N=CNC(=O)OC=N,0.2418
C1C(CO1)(CCO)CO,0.303
C1CC(C1)(C=O)O,0.2304
CC1CC2(C1)OC2C#N,0.2855
CN1C2C3CC3(CO)C12,0.301
CCOC1CNC(=O)O1,0.317
OC1CN2N=C(O)N=C12,0.237
CC(C)N1CC(=NO)C1,0.2258
COC(C)CC=O,0.2235
CC(C)C1(C)CCC1C,0.3466
CNc1conc1N,0.2201
O=C1CC2(CC2C#C)C1,0.2197
ON=C1CC2OC2C1,0.2526
CC1OC2C3OC2(C)C13,0.3079
OCC1CC2COC1O2,0.3328
CCC#CC1(CC1)C#N,0.2651
CC1OC2(CCC12)C#C,0.267
CC1OC(C)(CO)C1O,0.2996
OCC1CC11CC(=O)O1,0.2808
CC12CC3CN1C23C#N,0.2619
CC1=C2CCC2CC1O,0.2425
COC(CO)C1COC1,0.3035
OC1C2C(O)CC12C#N,0.2682
COC12C=CCC1C2O,0.2302
CNc1cncc(=O)o1,0.1527
c1c2c(n[nH]1)COC=N2,0.2116
OC1CC23COC2C1O3,0.271
C1CC1N=C(C=O)N,0.1714
CC12NC(C1O)C2=NO,0.2489
O=C1CCC2OC2C=C1,0.1807
O=C1CC2OC12CC#N,0.218
c1cnc([nH]1)CCC#N,0.248
CC#CCC1(CC1)C#N,0.2864
C(Cn1nnnn1)C=O,0.22
CC1(O)CN=C2OCC12,0.2655
CC1(OCC1=O)C=O,0.193
OC12CC(C1)C21CCO1,0.3116
OC1COCC11CC1,0.3276
OC1C(O)C(=O)NC1=O,0.2279
CC(O)CCC#CC#N,0.241
C1C2CC3(COC3)N12,0.3063
CC12CCC1(O)CC2O,0.3156
OC1C(O)C1C#C,0.2706
CCc1c[nH]c(=O)nc1,0.1749
OC1CC(C#N)C2NC12,0.2923
CN1CCCC(=O)C1=N,0.1673
OC1C(O)C11OCC1=O,0.2033
OC1COC2C3CC1C23,0.2985
C1OC2CC1CCCO2,0.3217
Cc1c(c(=O)nno1)N,0.1467
CCN1CC(=O)C1CO,0.217
OC1COC11C2CCC12,0.2819
C1C2CC3C4OCC13C24,0.3199
OC1C(O)C1C(F)(F)F,0.3093
O=CC1C2CC(C#C)C12,0.2185
OC1CC2CC=CC2=C1,0.1942
CNC(=O)CC1(C)CO1,0.2716
CC12C3N1CCC2C3=O,0.2193
OC1C2C3C4CCC13C24,0.3207
C1C2CN=COC12,0.2736
c1c2c(c[nH]1)COCC2,0.2418
NC1=C2CCN2C(=N)O1,0.2144
CC#CC#CCO,0.2161
C1CC1C12COCC1N2,0.3334
Cc1cncn1CC=O,0.1756
OCC1NC1C(O)C#C,0.2751
Cc1cncc(n1)N,0.1866
OCC1(CC1O)C1CN1,0.3011
C1CC(C1)C2(CC2)C=O,0.2244
OCC1CC11COC1,0.3032
O=CNC1C2OC(=O)C12,0.2465
COC1CCN=C1OC,0.2641
OC1C(O)C2(CN2)C1=O,0.1965
CCC(O)C1=NOC=N1,0.2445
OC1C2CC3(O)CC1C23,0.3141
OCC1OC1CC#C,0.3079
FC(F)(F)C1CN1C=O,0.2596
C1C2OC3C4NC13C4O2,0.1909
OCC1OC2CC12O,0.299
O=C1NC2CC2CC=C1,0.1969
CCN1N=COC1=N,0.2156
CC1N2CCCC2C1=O,0.1988
[NH3+]CC(CC([O-])=O)C#C,0.2681
c1cn(nc1O)C(=O)N,0.2219
CC(=O)C1CCC1=NO,0.2184
COCC1=CCOC1=N,0.2205
O=C1C=CC(=O)C2CC12,0.1621
[NH2+]=C1NC=C[C-]1C#N,0.2135
OCC12CC1C(=N)O2,0.2789
O=CCC12CN1C(=O)C2,0.216
COC(C1CC1)C2CC2,0.3364
C1C2C1C1(CC1)C1CN21,0.3029
C#CC1OC2CCC2=C1,0.2358
CC12CC(CCO1)C=C2,0.2477
O=C1OCC11CN2CC12,0.2424
C1C2CC3=CCCC1C23,0.2442
CC(C)(C)C12CC(C1)C2,0.3542
CCCC(O)COC,0.3298
C1CCC(CC1)O,0.3384
N=C1OC2C3CC12NC3,0.2507
C1OC11C2CC1OC2,0.3158
CCC1C2COCOC12,0.3278
CC(OCCO)C=O,0.2271
OC1(CCC11CN1)C#C,0.2664
N#CC1COCCCO1,0.2834
CCC(CC)CCC=O,0.2289
OC1COCCC2CC12,0.3273
C#CC12C3C=CC1CN23,0.2206
CC12C3CC(O)(C13)C2=O,0.2411
Cc1concc1=NO,0.1635
OC12CC1C1(CO1)C2=O,0.2075
C#CC(=O)C#CC=O,0.1852
C1CC(C1)(CO)N2CC2,0.2954
O=C1CC2C3CN2C3C1,0.2202
COCC1(CO)NC1C,0.3143
Cc1ncc(cn1)NC,0.1828
CC12OC1(C)C1CCC21,0.3197
C#Cc1ncc(=O)on1,0.1572
CC(=O)C1(C)CC1(C)C,0.2253
CC(O)CN1N=CN=N1,0.2629
O=CC1CC2OC12C=O,0.1995
O=C1CC2OC2C11CN1,0.2199
CN(C=O)c1cc[nH]c1,0.2211
CN1CC(=O)CNC1=O,0.2085
CC1=NC2C(O1)C2C#C,0.2459
CC12CC(C)(C1)C2C#N,0.3212
CC(C)C(=NO)CC#C,0.2536
CC12CC3C4C(C3C1)N24,0.3266
CCC1CC2OC12CO,0.3373
c1cnc(nc1)CC#N,0.2107
OCCOC1CNC1=O,0.2581
CC1OCC2OC1C2=O,0.2314
CC#CCn1nnnn1,0.2341
CCN=c1nn[nH]nn1,0.1591
COC1C(=O)CN=C1N,0.1936
OC1CCN2C=NC=C12,0.2473
CC12CC1CC21CCC1,0.3252
c1c([nH]nn1)CCC#N,0.2515
CC1(O)C(O)C1C#C,0.275
CCC(=O)c1ccco1,0.1912
N#CCC1CCOC1,0.2947
OC1C2C3CC2C(O)C13,0.3081
C1CC12COCC=C2,0.252
Cc1cc[nH]c1NC=O,0.1875
C1CC2(C1)CC(=O)O2,0.2853
C1C2CC1C=CC2,0.2535
CC12CC(=O)N1C2CO,0.2342
CC(O)C12NC1C1OC21,0.2703
CCC1OCOCC=C1,0.2612
CC(=O)C1C2OC(=N)C12,0.2212
O=C1CC(C#N)C11CO1,0.2054
O=C(C#C)N1CC1C#C,0.2144
CN=c1[nH]c(co1)O,0.2252
c1c[nH]c(c1O)CC=O,0.1721
CN1CC1C1(CO1)C=O,0.1891
C(=O)C(C#N)(C#N)C#N,0.2256
C1OC1C1=CC=NO1,0.2323
COc1[nH]c(=O)ccn1,0.2018
O=CC12CCC1N2,0.2211
OCC1OC2C3CC1C23,0.3185
COC(C)(CO)CC#C,0.298
CCc1cc([nH]c1)OC,0.2412
N#CCC12CC1N1CC21,0.2606
C(=N)NC=O,0.2276
CCOC(=N)C(N)C#N,0.2583
OCC1(O)C2CC1C2O,0.2972
CC1=CC(O)C2(O)CC12,0.2366
OC1COC1CNC=O,0.2787
O=CC1C2CC3NC3C12,0.2253
CN=COC1CCC1=O,0.1983
C1C2COC=NCCN12,0.2626
C1C(=NO)C=C(C1=O)N,0.1501
CN1C2CC1C1CC2O1,0.2517
NC(=O)C1(CO1)C#C,0.2521
CC1=C(C)C2NC2CC1,0.2381
COc1ccccc1O,0.2149
CC1OC(=N)C2NC12,0.2655
CN1CC1CCC1CC1,0.3035
O=C1C=CC2=C1ON=N2,0.1399
CC1OC2(CO)CC1C2,0.3281
O=C1C2CCC2C11CC1,0.2154
OC1CC2OC1C1NC21,0.2943
C#CCCOCC1CC1,0.311
CC(C=O)C(O)C1CN1,0.2199
c1(c([nH]nc1O)N)O,0.2318
C1CC1C1COC=NC1,0.2701
C1C2C=CCC3CC12O3,0.2293
OCC12CN1C(=O)C=C2,0.1987
C(CC#CCC=O)C=O,0.2185
NC(=O)C1(O)C2CC1C2,0.2547
N=C1OCC1C#CC=O,0.2031
CC1=CC2C3OCC1C23,0.2285
OC1=CC(=N)NN=C1,0.1589
OC1CCC1C(=O)C=O,0.1511
CC12CC(N1)(C=C2)C#N,0.2357
CCCCc1[nH]ncn1,0.2695
Cn1cc(cc1O)C=O,0.1821
CNC1=CC(=O)C(=O)C1,0.1531
CC12C3C1N1C3C21C=O,0.1864
CNc1c(cc(o1)N)O,0.2151
CC12C3OC1(C)C(O)C23,0.2892
CC12NC1COC2CO,0.3019
CC(=NO)CC(=O)C=O,0.1423
OC12COC1COCC2,0.3039
CC(N)C(N)(CO)C#N,0.2737
CCC1(OCC1O)C#N,0.2786
O=C1OC2=NCC3C2N13,0.1994
OCC(O)C(=O)CC#C,0.2315
CC(=O)NC1CC(=O)C1,0.2148
N=C1CCC(O1)C=O,0.2179
c1coc2c1C=CC2,0.1933
N#CC1CCC11CCC1,0.314
c1ncoc(=O)n1,0.2008
c1c(nc2n1CCC2)N,0.2204
OC1C(CC11CO1)C=O,0.2249
OCC1(CC1O)C#C,0.2653
CCC12CC3(C)C1CC23,0.3659
OCC(=N)N1CC1C#C,0.2545
OC1CCOCC1O,0.3259
c1cnn(c1)C2CC2,0.2536
CC1C2NC2C11CN1C,0.2972
C1N2CC3=CCOCC123,0.2373
c1c(=O)nc(oc1F)O,0.2235
CCOCC(O)CC=O,0.231
CC12C3C4CC1N2C34,0.3033
OC1CC11COCOC1,0.3224
CC(=O)n1c(=O)onn1,0.217
O=CCC1OCCC=C1,0.2231
CC1OCCC2(CC2)O1,0.3377
C(COC=O)C#CC#N,0.243
OC12CC3C1N3CC2=O,0.2136
O=CCC1OCC1C#N,0.2215
C1CC2=CCC3C1C23,0.2203
C#CCc1c(cn[nH]1)O,0.2246
[NH3+]CC(=N)[N-]C(=O)C#N,0.1903
CC1C(=O)CCC11CN1,0.2189
N#CC(C1CC1)N1CC1,0.2845
CC(C)C1(CO1)C(C)O,0.3407
CC1(OC=N)C2CCC12,0.2782
C#CCc1cnc[nH]1,0.2498
OCC1OCC=CCO1,0.2627
NC1=NC(CO1)C#N,0.2678
CC1OC2CC(O)C=C12,0.247
CC1=NOC(=C1)C1CN1,0.225
C1CN2CC=CC(C2)O1,0.2084
OC1CN2C(CC#C)C12,0.2837
CCCC(O)(CO)C#N,0.3106
CC12CCC11OCC1O2,0.2839
CC1C2CC1(CO)OC2,0.3255
C#CC(=NO)CC=O,0.1935
CC1C2OCC3C2C13O,0.31
COc1cnc[nH]1,0.2449
COc1c(onn1)C#C,0.1732
COC1CC=CNC1=O,0.2097
CC1CC(=N)OC1(C)C,0.2842
C#CC12C3CC1CN23,0.257
CC1=COC=C([O-])C1=[NH2+],0.1359
COC(CC#N)C#C,0.2926
CC1CC11C2CC1C2C,0.349
CC1OC11COC(=O)C1,0.2743
OC12CC(C1)CC21CO1,0.3216
CC1CC=CNC(=O)N1,0.229
CC1C2CC1C(C=O)=C2,0.1884
CC1C2CCC1C2C=O,0.2251
CN1C(CCC1=O)C=O,0.2005
CCC(C)(O)CC1CC1,0.3147
OC12C3NC1C(=N)OC23,0.2365
C1CN=C(N(C1)C=O)N,0.2279
CC1=CC2CC1(C)C2=O,0.2409
CN1C2CC3C2(C)C13C,0.2925
OC(CCCC=O)C=O,0.2069
OC1CN2CC3CCC123,0.2692
CC12C3C4N1C2C34CO,0.2695
C1CCC(C1)(C#N)C#N,0.3182
CC#CC(=N)OC1CC1,0.237
CC(C)C(=N)OC=O,0.2603
C#Cc1coc(n1)C#C,0.1899
NC1=CC(F)=NC(=N)O1,0.186
COC1=NCC2CCN12,0.2665
C1C=CC2OC3C1OC23,0.2349
C#Cc1cnc(=O)[nH]n1,0.1565
N=COC1=CC=CN1,0.2145
OC12CC1C(C2)NC=O,0.2784
OC1(C#N)C2CC1N2,0.2674
CC1NC1C1(CN1)C#C,0.2783
CC1NC11CC(C1)=NO,0.244
CC1(O)C(O)C1(C)C#C,0.2874
O=CC1C2OC(=O)OC12,0.2219
CCC1OC1CN1CC1,0.3247
CC1C(=O)CCC1=NO,0.2118
C(C#N)C(=N)NC=O,0.2325
CC1OC(=N)C(C)=C1,0.2197
OC1C2(O)CC2C11CO1,0.3051
CC12OCC(CC1O)O2,0.3144
OC1C=C(C#N)C2OC12,0.2067
CC1=CC2CC1N2C=O,0.2288
CN1CC11CCC1(C)O,0.2949
NC1=NC(=N)C=CN=C1,0.1499
CC1=C(CN(C1)C=O)C,0.2462
CC1CCC=C(C)C=C1,0.1914
CC1C2CC(C#N)C12O,0.2925
COCCC1CCCO1,0.3262
Cc1c(=O)[nH]ccn1,0.1738
CNc1c(nc(o1)N)O,0.2231
CCN(C=O)C1CC1,0.2666
N#CCC12CCCC1N2,0.295
CN1CC2NC2C1C#C,0.2572
CC1(CCO1)C(=O)C=O,0.1499
CC12CC1C(C#C)C2O,0.2893
CC1OC(C)=NC2CC12,0.253
N=C1OC2CC3CNC123,0.2489
CC1C2(C)OC(=O)C12C,0.2698
C(C=O)NC(=O)C(=O)N,0.2081
CC12CC3C(CC=C1)C23,0.2571
O=CC1COC1C#N,0.227
CC(C#N)C1CC=CC1,0.2642
C1c2c(onn2)CN1,0.2019
c1c(c[nH]c1N)C2CC2,0.2368
C#CC12CC1C1CC1C2,0.2757
CC1OCC1C1(C)CC1,0.3235
CCCC(OC)C(C)C,0.3271
CC1(CC(=CN1)C=O)C,0.1796
CC1(CN(C1)C=O)C#N,0.2672
OC(CN1CC1)C1CC1,0.294
C1C=CC2C3OC3CN12,0.2258
CC(=N)OC1CCOC1,0.2739
CC1C2C1C(=O)C2C,0.2263
CC1=NON=C(N)C1=N,0.1722
C#CCC#CC(=O)C#N,0.1801
CC1(C)C(O)C1(O)C=O,0.2158
CCCC1OCC1=O,0.2246
CCn1ccc(n1)C#C,0.2224
C1C2CC3OC3C=CC12,0.2528
Cc1ncc(o1)C#C,0.1988
Cc1cc2c([nH]1)ocn2,0.2105
OCC1CNC(=O)CN1,0.253
CC#CC#CC#N,0.1947
C1CC1C1=CC2CC2C1,0.2333
CCc1c([nH]c(=O)o1)C,0.2365
CCN(C)C(=O)OCC,0.2975
CC1CN(C1)C(=O)C#N,0.219
CC1CNC(=O)N1C=N,0.2431
c1c([nH]c(n1)O)CO,0.2404
OC1C2CC(O)C12C#N,0.2788
CC1C=CN(C=O)C1C,0.208
c1c(cncc1N)CO,0.1956
NC(=O)C1CC1CCO,0.2732
CC1OC2(CCC2)C=C1,0.2425
C#Cc1cc[nH]c1,0.2222
C1CC2C3C4C(O1)C2N34,0.3165
c1c([nH]nn1)COC=O,0.248
CC#CC(=O)C1NC1C,0.1966
CC1=CCC2(O)CC12C,0.2461
O=CC1CC11CC2NC12,0.2232
CC1CC1(C#N)C#N,0.2887
O=CNC1C2CCC12,0.2727
O=CN1C2C3COC2C13,0.2503
CCCC1=CCC2OC12,0.2433
CC1(CCO1)C(N)=O,0.2648
CCOCC1CC1O,0.3227
CC(=O)C1COCOC1,0.2235
CC1NC1(C[NH3+])C([O-])=O,0.2655
C1CN1C(=O)CC#N,0.2468
CC1(CC1)C(N)C#N,0.2957
Cc1cc(nc(c1)F)F,0.2254
C#CCC1C2CC=CC12,0.2472
O=C1OCC=CC11CO1,0.2432
CCC1CC(=O)N1,0.284
CN1CC2OCC12C=O,0.1766
CCOC(C)CNC=O,0.2834
CN1C2C3CC2(O3)C1=O,0.2438
CC1CC(CO)C(C)=C1,0.2578
CCOC1CCC11CN1,0.3153
CC1(C#C)C2C=CCN12,0.2167
CCCC(CC)C(C)O,0.3244
CC(CO)COCC#N,0.2842
c1nc2c(o1)N=CNC2,0.1787
C1C(CO1)C#CCC#N,0.2713
COC1C(C#N)C1(C)O,0.2841
CC1C(CO)C1C(N)=O,0.2658
O=C1CC2(CC12)C#C,0.225
c1c2c(c(o1)N)CCN2,0.2178
CCOC(C)CCC#N,0.3068
CC1OC2CC3(CC3)C12,0.3142
CC(C)C1CCCC1C,0.3569
C1CC1C1OC11COC1,0.3233
O=C1OCC1C#C,0.2668
Cn1c(=O)ncnn1,0.1616
CC(N=CN)(C#C)C#N,0.2535
O=C1C2OC1C1CC2C1,0.2418
CC1C2(O)CC2C11CN1,0.307
C1OCC=CC#CCO1,0.1977
CC1C2C3OC2(C#C)C13,0.247
CC(=O)Cc1c[nH]cn1,0.215
CC1NC1C#CCC#C,0.2714
CN1CC1C(O)CC#C,0.2771
CC12OCC1C2(N)C#N,0.2652
OCCC(C#C)C1CC1,0.3078
C#CC(C#C)C#C,0.2952
CC12C3N1CC2(C)C3=O,0.2255
CNC1(CN(C1)C)C#N,0.2569
c1c(coc(=O)c1N)F,0.16
CN=C1OC(C#N)C1C,0.2584
CC1NC(C#N)C2OC12,0.2724
N=C1OC(C=O)=NC=N1,0.1506
CC12CN1C(=N)C1OC21,0.2256
CC1OCC2OCOC12,0.3147
CC1(CO)COC1(C)C,0.3057
COC(=N)NC(=O)N,0.2668
CC(C#C)N(C)C(C)=O,0.2644
OC(C#N)C1CCOC1,0.2747
CC1OCCCC1C#N,0.2981
CC1=CCC2C(O)C12,0.2374
CC1(CC(=O)C1)OC=O,0.2217
C1OC23CC4N(CC124)C3,0.2908
C#CC#CC1C2CCN12,0.2039
O=CCCC1OC1C=O,0.2107
CC(O)C(=O)CC#N,0.2279
c1nc(oc(=O)n1)N,0.2076
CCC1CN=C(N1)C=O,0.1631
CCCC(C)(C)C(=O)N,0.2738
CCc1c(c(n[nH]1)O)C,0.2427
CC12CCC(CC1O)O2,0.3185
OC1CCC2C3OC2C13,0.2904
OC1C2CC11CC=CC21,0.256
N=CN1CC=CNC1=O,0.2102
O=CCC12CC1COC2,0.2234
CC1N2C3CC1(O)CC23,0.2989
O=CC1(CN2CC12)C=O,0.2054
C1CC12C(=O)CN2C=O,0.2021
C1OC1C12C3CC1OC23,0.3082
CC12CC3CC4C3C1N24,0.2973
CC1C2COC(C=O)C12,0.2228
OC1CC2CC(O)C=C12,0.2415
OCC1CC2C1OC2=N,0.2849
O=C1CN2C=NCCC12,0.193
COC12COC3C1OC23,0.2929
[N-]1[NH+]=CC=C2N=CC=C12,0.1507
CC1CC2CC=CC2C1,0.2658
CCCC(OC)C(C)O,0.3251
Cn1c(cnn1)C=O,0.1971
CC12CC1C(=O)C(N)=N2,0.1728
CC1(C)CC11CCO1,0.3047
CC1(CCO)CC(=N)O1,0.2883
CCC12C3CC4C(C13)N24,0.2985
CC1=CC(=O)CC(O)C1,0.1894
CC1CCN2C=CN=C12,0.25
COC(C)CC(C)C,0.3279
c1cnc([nH]1)C2(CC2)O,0.2437
CC1(CC1)c2ccco2,0.2262
CC1OC11CC2(C)OC12,0.3249
CCCC1CC2CC12O,0.3228
c1n[nH]c2n1c(nn2)O,0.1983
OC1CC(=O)C1(O)C#N,0.1991
CC12C3C4C1CC2(C)N34,0.3031
c1cocc1C(=O)N,0.219
O=C1NC2COCOC12,0.2571
CCC1(O)CCC11CN1,0.2922
CCCC1=COC(=N)O1,0.2372
CC1CC2=C(N1)C=NN2,0.2121
CNCC(N)(C#C)C#N,0.2507
CC12OC3C1C2C31CN1,0.3076
OC1CC2CN2C1C=O,0.1952
COC1CC2OC12,0.327
Cc1[nH]c(cn1)C(=O)C,0.1905
CCCCCN1CC1,0.3192
CC1C2C(CC12O)=NO,0.2357
C1CC=CCC2OC2C1,0.2583
OC12CC1C(=O)C21CN1,0.2172
CCN(C=O)C(=N)C,0.2353
C1CN=C(OC1)C#N,0.2307
OC12CCC1C2C1CO1,0.3195
CC1COCC1(C)C#N,0.3007
OC1(CC=O)CCOC1,0.2058
CC(=NO)c1cnc[nH]1,0.1829
CC1=CCC2OC12,0.2454
CC1COC2CC(O)C12,0.2996
C#CC(=O)OC1COC1,0.2081
NC(=O)N1C2C3OC3C12,0.2618
Cc1[nH]c(cn1)O,0.2404
Cn1c(c(nn1)N)CO,0.2073
C1C2OC22CCC=CC12,0.2622
C1CN1CC(=O)CC#N,0.2134
CCC12C(CC1=O)N2C,0.2079
C1C2C1C13NC4C1N2C34,0.272
C1CC2(O1)C1COCC21,0.2956
CCC1CCC(C)(O)C1,0.3279
CC1C2CC3(O)C2CC13,0.3197
OC1CC2(CN2)C1O,0.3221
ON=C1C2CC(O)C1O2,0.2555
COC1C=CCC1C#C,0.2552
CCN(C(C)C)C(=O)C,0.2654
CCC(=O)C(=O)C=O,0.1337
NC1=CC(=N)C(O)=CN1,0.1852
CCC12CC(OC1)C2O,0.3178
C1CC=C(C1)C(F)(F)F,0.2575
CC(N)(CCC#N)C#N,0.2995
CC1NC(CO)C1=NO,0.2349
c1c(nc(c(n1)F)F)F,0.2005
O=C1C2CN3C2C13C#N,0.2268
COC(=O)NC=N,0.254
CC1C2C3C1COC23C,0.32
C1CC2OCCOC12,0.3117
CN1N=CC(=N)C(F)=N1,0.1728
Cc1cnon1,0.26
CC(C)C12CC1CCO2,0.3071
CC1N2CC2C(O)C1=O,0.1994
N=C1OC2CC(C2)C1=O,0.1959
ON=C1CCC(C1)C=O,0.2215
CC1C(CCC#N)N1C,0.2613
C1C(=O)N(C(=O)O1)C=O,0.2261
C1Cc2c(n[nH]c2O)C1,0.2468
NC(CC1CN1)C#N,0.275
CNc1cc(n(c1)C)O,0.2226
OC12CC3C1C1CN1C23,0.2929
CCC1=CCCCC1C,0.2582
c1cnn(c1N)CCO,0.2368
OC1C(C#N)C11CCO1,0.2718
CCCCC(C)OC,0.334
CN1CCN=C2OCC12,0.2539
c1c(=O)[nH]c(=O)[nH]n1,0.2019
C1OC11CC=CC2OC12,0.2412
CC(O)C1CC(C)O1,0.329
C1OC23CC(COC2)C13,0.2801
OC1C2COC3CC2C13,0.3165
CC12NC1C1(CO1)C2O,0.2954
CC1(CCC2(O1)CC2)C,0.3021
N#CC1NC2C3OC2C13,0.2614
OC12C3CC(O)(C13)C2=O,0.2336
c1cnc(c(n1)N)F,0.1883
CCc1ccncc1,0.2304
Cc1nccnc(=O)n1,0.148
Cc1c(c(no1)O)CO,0.2411
CC1C(C#N)C2CCN12,0.2462
CC1CC2(CO)CC1C2,0.336
N=C1CC2OC2CO1,0.2826
CCC1C2CCC12,0.3371
CN1C2COC3C2C13C,0.2861
CC1CC2(O)C3CC3C12,0.3044
OC(C=O)C1=CNN=N1,0.2141
C1C(CN1C=O)(C#N)N,0.2626
NC12CC1(C#N)N1CC21,0.1637
COc1c[nH]cc1CO,0.2445
O=CC12CN1CCC=C2,0.2075
C#CC1(OCCO1)C#C,0.267
C#CC1=CC2COC1O2,0.1995
CC(C)CC(C)(C)C=O,0.2285
CC1CC(=O)N2CC12,0.2404
CC1CCN=C(O1)C#C,0.2271
CC12C3C4C5C4C1C5C23,0.3211
c1cc(oc(=O)c1)N,0.1697
CC1=C(N)C(=N)NN=C1,0.1646
CC1CC2(O)COC1C2,0.3077
CC1OC1(C#N)C(N)=O,0.2516
N=C1OCC11CCOC1,0.2813
N=COCCOCC#N,0.2647
OCC1(CN=CO1)C#N,0.2698
Cc1ncc(c(=O)o1)O,0.1786
NC(N)=[NH+]C1=CC=N[N-]1,0.2242
CC(=O)NCCN1CC1,0.2717
O=C1NC2C3OC3CC12,0.2714
c1nc2n(n1)nno2,0.2101
C(C=O)c1c([nH]nn1)N,0.1795
CC1C=CCN1C=O,0.2418
Cc1c(cnnc1F)O,0.1958
CC(C#C)C1NCC1=O,0.2161
C#Cc1nccc(n1)O,0.2018
N=C1C=NOC(=C1)C#N,0.1772
C1C2NC1C1=C2NN=C1,0.227
OC(C#N)C#CC#N,0.2372
COc1c(cn[nH]1)CO,0.2516
CCC1=NC(=N)N=CO1,0.217
CC1C2C3CC2(CO)C13,0.335
CC1COC1(C#C)C#C,0.2549
CC12C3COCC1OC23,0.306
N#CC12CC(CC1)O2,0.2718
C1C2C3OC4C1N2C34,0.2632
c1c(nc(cn1)N)C=O,0.1605
CCCOCCCC#N,0.3008
N#CC1NC11CC2NC12,0.2662
Cc1cnn(c1)CC#N,0.2469
C1CN1CCCCO,0.311
C1CN2C3C4C3C2C4O1,0.2957
C1NC11C2NC3C2OC13,0.2798
CN=COCC(N)C#N,0.2511
CCC1(CO)CC1C#N,0.3065
C1CN1c2nc(no2)N,0.2328
COCCN1C(C)C1C,0.2993
CC12CCCC1OCO2,0.3201
CCC(C)C(=O)OC=N,0.251
CC1CC2=C(NC=C2)O1,0.2316
N#CC12CNC1COC2,0.2713
OC1CC(O)C(C1)C#C,0.3076
C1CC#CCC=CC=C1,0.2311
CC1CC(C)(CO)C1C,0.3226
CC12C3C1C1=CC2N3C1,0.1054
C1CC(=O)COC=NC1,0.2107
OC1CC=CC11CCC1,0.2587
CCN1CC(C)(O)C1=O,0.2675
CC1=C(CCCC1)C=O,0.1936
CCOC1CCC1,0.3308
OC1=CC(=N)C=CO1,0.1935
CC(C)C1CC(O)C1C,0.3226
CCCC1(C)CN1CC,0.3025
O=C1CC(CCO1)C#C,0.2665
CCCN1CC1,0.3227
CC1(NC11CCC1)C=O,0.2236
CCC(C)([NH2+]C)C([O-])=O,0.2663
C1C2OC11COCOC21,0.31
O=CC12CC(N1)C21CO1,0.2125
C1C23CCOC12CO3,0.2794
C#CC1C2OC1C1CC21,0.2951
CN1C2CC1C2=O,0.2509
CCC(C)(C)CC(C)O,0.3234
CC1CCC11CNC1=O,0.2731
CCC1(CC)OC1C=O,0.2154
CCNc1ncnnn1,0.1672
O=C1C2C3N2C1C31CN1,0.2255
CC1C2CC(C)(C#N)C12,0.307
CCC1(CO)C2CCC12,0.3202
CC1=C(C(=O)NC1)C#N,0.1996
OC12COC1CCC=C2,0.2508
N#CC12CN1CC21CC1,0.2491
NC1=NN(C=O)C(=N)O1,0.2061
CN(C)c1c[nH]c(n1)O,0.231
CC#CC1CC1CC#C,0.2757
CC1C=CC2C(C#C)C12,0.2365
CCC#CC(CC)CC,0.2965
CC1CNC(C#C)C1=O,0.1985
CC1CCOCCC1=O,0.2254
O=CC12CC3(CO3)C1N2,0.2214
C1CC2(C1)C1C3NC3C21,0.2686
N#CCN1C2CC1C=C2,0.2298
CC1(CO)CCN2CC12,0.2944
CC(O)CC(CO)C#N,0.3087
C1C2C3OCC(CO3)N12,0.3206
CC1OC2CC2C1(C)C,0.3048
CC(=N)OC1=COC=C1,0.2233
CCNC(=O)C1(C)CO1,0.2654
N#CC12CC3C(C1)C23,0.2893
O=C(C#C)C1CC1C#N,0.2031
CC12CC1C(C2)C=O,0.2253
CC1CC2(C)COC1O2,0.3303
OCC12CC(=O)C1C2O,0.2298
N#CC12C3C4OC1C4N23,0.2657
CC12CC1(CO)NC2=O,0.2515
O=C1CN2CC3(CN3)C12,0.2087
Cc1cc(c(=O)on1)O,0.1843
N#CC1OC11CCC1,0.2865
CC(C)(C#CCOC)O,0.2837
CC(=O)COC1CC1,0.2151
CNC(=O)C1CCC=C1,0.2484
C1N=CN2C=NCCC12,0.2172
c1c(cn[nH]1)NC2CC2,0.2153
CC(C#N)C1(C)CCO1,0.2905
C#CC(=O)n1cnnc1,0.1803
NC1CN2C1=NOC2=O,0.243
CC(=O)C1CC2(CN2)C1,0.2277
COC1CC2CC12C#N,0.2827
CC1C2NC(C=O)=NC12,0.1598
CC1C=CC2C(O)C12,0.2296
CCOC1CC(O)C1O,0.3034
c1c(c(no1)O)CCO,0.2484
C1OC11CC2(CCO2)C1,0.2996
CCn1c(=O)[nH]cn1,0.2343
[NH3+]CC1=C([O-])OC=C1,0.226
O=CCCC1NC1C=O,0.2181
CCOC(=N)C(=O)CO,0.2022
COCCC(C)C#CC,0.3032
COc1ccoc1C#C,0.1856
C1CC(C1)(CC2CC2)O,0.3239
CC#CC1(C)NC1C#C,0.2621
CCC12CN1C(C)C2O,0.2879
O=C1CC2C3CN3CC12,0.2049
C(C(CN)(C#N)C#N)N,0.2563
C#CC1=NCC=CCO1,0.214
O=CC12CCN1C(=O)C2,0.2078
COC1COC(=O)C=C1,0.2148
OC12CC1C1OC21C#N,0.2444
COC(=O)C1CN1C=O,0.2356
C1CC11COC2COC12,0.3189
COCC(C#C)C#N,0.2902
C1NC11C=CC=CC=C1,0.1694
OC1C2CC2COC1=O,0.2703
CC1C(O)C2C1NC2=O,0.2705
O=C1CN2C(C#N)C12,0.2207
CC12CN1C(=N)C2(C)O,0.2473
COCC(C=O)C#CC,0.2188
OC1CN(C=O)C1C#N,0.2602
CCC1OC(=N)C1C#C,0.2853
CC12OC3=NCCC1C23,0.2046
CC(O)C1(C)CN2CC12,0.2919
CC1C2CC(O)C12C=O,0.2247
Cc1c(c2n(n1)CC2)N,0.2249
C1C2COC12,0.319
OCCOC1CC1C#N,0.2819
N=COC1=CNC=C1,0.2359
CC(C)(C)CC(=O)N,0.2743
O=CC1CC(=O)C(=O)N1,0.1729
CCC12CCOC1CO2,0.3215
CC(C)C(C)C1CC1O,0.3288
O=C1CC2(N1)C1CCC21,0.2729
CC1(O)CC2(CN2)C1,0.3087
COC=NCC(=O)OC,0.2491
CN1CC1C(=NO)C#C,0.184
CC(CO)C1OC1C,0.3216
CCC1OC1(C)CO,0.3398
Cc1cc([nH]c1OC)N,0.2303
CCC1(O)CC1(C)C#C,0.2894
OC1C2CN2C1CC#C,0.2904
c1c(=O)[nH]cnc1O,0.195
c1cc(n2c1CCC2)O,0.237
CC(C#N)C(CO)C=O,0.225
CC1(C)CC1(C)N1CC1,0.305
CCC1C(O)C1C(C)=O,0.2155
NC1(CC(O)C=C1)C#N,0.231
c1([nH]nc(n1)N(=O)=O)N,0.1818
CC1C2OC2(C)C11CO1,0.3217
CC12C3CN1C(=N)C2O3,0.2227
C1CC(C1)C1COCO1,0.3346
CC(C)Nc1c[nH]nc1,0.2166
CC1OC(=N)C1OC=O,0.27
CN(C)C(=O)CCC#C,0.268
CC1C2CN=C(C#N)N12,0.1963
COC1CC(O)C1C=O,0.213
O=C1CCC23CCC12N3,0.2176
CC1=CCOCC1=NO,0.1981
c1c(c2c([nH]1)COC2)N,0.2288
CC(C#N)N1C=NN=C1,0.2572
OCC1CC2OC2CO1,0.3388
OC12COC(OC1)C2=O,0.2056
COCC1N(C)CC1=O,0.2007
CC(C)N(C=O)C(=O)C,0.2129
C1NC23COC12COC3,0.2805
CCOC(C)(C#C)C#N,0.2772
CC(CCO)C1COC1,0.3128
CC1CNC(C#N)C1N,0.2503
CCc1cc(no1)NC,0.2217
NC1COC2=C1N=NO2,0.1684
c1cc2ccnn2nc1,0.1714
CC(=O)CC1COC1=O,0.2285
CC1CCC2OCC2O1,0.3296
CC1OC2CC12C#N,0.2714
CC1CCC2=C1COC2,0.2482
O=CC1CNC(=O)C1,0.2179
OC1CC2NC12C#N,0.2663
CCC1(O)CC(C)C1C,0.3216
C1OC23CC(C4OC24)C13,0.2941
N=C1ON=NN1C=O,0.1975
N=C1OC(C=C1)C1CN1,0.2062
CCc1[nH]c(=O)[nH]n1,0.2405
CC1C2C3CCC2C13C,0.3611
O=CC1CC(=O)NC1=O,0.2166
O=CC1CCC2OC12,0.2235
CC1CC2(C)CCC12,0.3387
OCCN1CC1CC#C,0.2854
CC1=CC2OC1CC2=O,0.2024
CC1(CC1(O)C=O)C#C,0.2101
O=CC#CC1(CO1)C#C,0.2
CCC1(CC1O)N1CC1,0.3034
O=CCC12CC(C1)CC2,0.2257
C1OC2C3C=CCC1C23,0.2408
OCC1C2C3C=CC1C23,0.2318
CC1(O)CCCC2NC12,0.315
C#CCN1C2CC1C=C2,0.223
CC1CC11CCC=C1,0.246
CC12C3CC1(NC23)C#N,0.2522
c1c([nH]c(n1)O)C2CC2,0.2418
CC1C2(C)OCC12C=O,0.2179
CCOC(=N)CCC#N,0.2857
C1C=Cc2c1c(n[nH]2)O,0.1909
COC(C(C)C)C(N)=O,0.2634
CC1CC(=O)N1,0.2852
Cc1ccoc1NC,0.2159
CC(=O)C1CCC(=N)O1,0.2193
C1COCCN1CCO,0.3084
CC12CC1CCC2=O,0.2267
OC1C(=O)NCC11CO1,0.2742
CC1OCC11COC1=N,0.269
CC1CN1CCC(N)=O,0.2551
COc1c[nH]cc1N,0.23
CNC=Nc1ncon1,0.21
C#CC1(CCC1=O)C#C,0.205
CC1OCC2C(O)C12,0.3092
CC1=C(F)NC(=N)N=C1,0.1638
CC1=CC2NC2C1(C)C,0.2442
CC1CC1C1CC(=N)O1,0.2908
CCC(C)(C#C)C1CC1,0.3163
CC1(C)CC2CC12,0.3406
N=COC1C2CCC12,0.2761
COCC1(C)CC1(C)O,0.3183
C1C2CC3OC4C(C12)C34,0.3066
C#CCC#CC1CCO1,0.2686
C#CCC1CC11COC1,0.2919
COC1(CC1)C(C)C#C,0.2919
CC(O)C(C)(C)CC#N,0.3149
C1C2OC3C=CC(O2)C13,0.245
C1CC(=CC(=O)C=C1)N,0.1737
CC(=O)C(C)(C)CC=O,0.2174
CC1CC(C)C(O)C1O,0.2949
CN1C2C=C(C)C1C2O,0.2145
N=C1OC2C(O1)C2C#C,0.2817
CCC(C=O)C1CCO1,0.2168
CN1C2CC(=O)C12CO,0.2041
C1OC2COCC3OC123,0.3099
CC1OC(=O)C2NC12,0.2525
C1CN1CCC#CC=O,0.1899
Cc1ccn(n1)CC#C,0.2572
COC1CC2C1OC2=O,0.2741
CC(C)C(=N)NC(=O)C,0.2312
CC1CC11CC2C1N2C,0.3046
N=C1NC2=C(N1)C=CO2,0.1919
CCC1CC(O)C1(C)O,0.323
Cc1cc([nH]c1)CC#N,0.2351
CC1(O)C2CC2CC1O,0.3309
CC1(C=O)C2CC(=O)N12,0.2066
CC(C)(CCC1CC1)O,0.3254
NC(=O)C1OCC(=O)O1,0.2438
CC1NC1CNC(N)=O,0.2993
c1cocc-2cncc12,0.1399
CC1(CCC1)C#CC=O,0.203
Cn1cnc(n1)C2CC2,0.2487
CCC1CC(O)(C1)C#N,0.3003
OCC1(OC2CC12)C=O,0.2001
OCC1C2COC1C2O,0.2961
CC1N2CC2C11CO1,0.31
OCC1CCCN=CO1,0.2588
c1c(cn[nH]1)N,0.2257
OC1CC=CNC1=O,0.2136
CC1CC2CCC1OC2,0.3018
CC(C)C(=O)N(C)C=N,0.2336
CC1C2CC(=N)OC12,0.2729
c1c(nno1)CN2CC2,0.2172
CC12CC(C)(CO)C1N2,0.3018
CC1CCN1C=O,0.2652
CN1C2COCOCC12,0.2954
CCC12C3C4C3C1CC24,0.3188
Cc1cc2c([nH]1)NCC2,0.2182
O=C1NC=CC(N1)C#C,0.2194
CC(=NO)C1(CC1)C,0.2508
COC1CCCC11CO1,0.3118
Cc1c(c(ncn1)O)F,0.2239
CC12C=CC3OC1C2O3,0.2358
NC1CC(OC1=O)C#N,0.2482
CC1(CCOCC1=O)C,0.2089
OC12C3C1C1(O)C3CC21,0.2897
CN1C2C=CC(C=O)C12,0.2065
CN1CC11C=CNC1=O,0.1935
CC(C)c1c(nc[nH]1)N,0.2205
CCC12CC1C1CC1O2,0.3085
CCc1cc(oc1O)N,0.223
OC1COCC(=O)C=C1,0.182
COc1cocc1CO,0.238
CC12CC(=O)C1(O)CO2,0.2133
CN(C)C(=O)CC1CC1,0.2696
CC1=CCC2OC2C1O,0.2619
C#CCn1cccc1O,0.2196
O=C1NC2COCC2O1,0.3135
CC1CC2CN2C(=O)C1,0.2476
C(CC(=O)CO)C#N,0.2361
CC1C2OCC3CC2N13,0.2991
CC1OC2C3CC12C=C3,0.2297
CC1C2CC1C2,0.3939
CC#Cc1ncco1,0.1992
CCC1C2NC2C1OC,0.2979
C1OC2C3C4C5C(N35)C124,0.2882
COC1C=CC2NC12,0.2342
N=C1OCCC(O1)C#N,0.2622
C(CC(C=O)C=O)C#N,0.2064
CC1(CN2CC12)C1CO1,0.3065
O=CNC1C2CC1C2=O,0.238
CC(C)OC(=O)N1CC1,0.2899
C(c1nc(no1)O)N,0.2358
C(COCCC=O)C=O,0.2247
C1CN(C1=O)CC#N,0.2729
CCCC12CC1OC2=N,0.2792
CC12CC3COC1C23,0.3203
CC1(C[NH3+])CC1C([O-])=O,0.1046
OC1C2COC12,0.2971
CCC(O)C1C2COC12,0.3067
Cc1nc2c(o1)con2,0.2115
CC1CC2(CC#N)NC12,0.2669
O=C1CC2(CN2)C2NC12,0.2144
O=CC1CCC=C1C#N,0.1993
CCC1C2C3CC3(C)C12,0.3472
N1C2C3OC4C=CC2C134,0.1689
CCOc1conc1O,0.232
COCC1(CC1C)C=O,0.2273
CC12CC3(CC1C23)C#C,0.2822
OC12C3CC1C=CC2C3,0.2513
CC1(O)C(O)CC1=O,0.2098
CC1COC2(C)CC1C2,0.3179
COC1CC(=O)CO1,0.2225
N#CCCNCC1CN1,0.2786
CC1=CC2(CN2)CCC1,0.2362
OC1CC2(O)CN3C1C23,0.2787
CC1CC1C(C)(O)C=O,0.2153
OC1C2C1C1C(O)CC21,0.292
CCC1=CC2NC1C2O,0.2279
C1CC2C3OC=NC2C13,0.2576
OCCC#CCC1CO1,0.3012
OC1CCCC1CC#C,0.3135
C[NH2+]C(CC([O-])=O)C#C,0.265
NC(=O)C(=O)CC1CO1,0.1776
COC(C)C(C)C(C)C,0.3237
CC(=O)NC1CC2NC12,0.2724
O=C1C2CN(C2)C11CC1,0.2094
N=C1OC(=CC=C1)C#N,0.1486
c1(nnn(n1)C(=O)N)O,0.2107
O=C1NC2CCN=C2O1,0.271
CC1OC1C(C)(C)C,0.3317
CC12CCC1C21CCC1,0.3224
c1c(c[nH]c1O)C(=O)N,0.1986
C[NH+](C)CCC([O-])=O,0.2765
CC(C)c1cc(n[nH]1)N,0.2335
c1c(=O)[nH]cnc(=O)n1,0.1798
OCC1(CN2CC12)C#C,0.2709
CC12CC3C(C=C1)C23,0.2389
Cc1ccc(c(=O)o1)F,0.1747
OC1CC2CC11CCC21,0.3075
O=C1OCOCC1C#C,0.254
O=C1C2CC2C=C1C#C,0.1756
CC12CNC1=NCCO2,0.2511
OC1CCC1C#CC=O,0.1994
CC(C)CCC(=O)N,0.2789
CC1OC2C3CC(C3)C12,0.3299
CC12COC1(C)C1OC21,0.3229
CC1CC2C(C3CC3)C12,0.3307
CC1CC2CC3OC2C13,0.3165
c1c(nc(o1)OC=O)O,0.199
c1c(c(n[nH]1)CC#N)O,0.2289
O=CCC(C=O)C#N,0.2077
c1cn(nc1O)CC=O,0.1879
N=C1CC=CC2CC2O1,0.2351
O=C1CN2C3COC1C23,0.2072
CC12C3NC3C1C2C#C,0.2503
CC1=CC=CCC2OC12,0.1853
CC(O)C1COC1=O,0.2796
CC1C2CCOC12CO,0.3122
OC1CCCOC(=N)C1,0.2814
CC1C(O)C2COC12,0.3048
CC1OCCC2OC12,0.3379
CC1OC1C1C2CCN12,0.3105
CN1C2C3OC3C12C#N,0.2354
CC(C)(C)N1CC1C#C,0.257
CC12OC3CC1C1C3C21,0.3432
CCC1CCOCC1C,0.3239
CC1(CCO)NC1C=O,0.2184
C#CC1C2CC(C#N)C12,0.2806
CC1(C2(O1)CCC2)C,0.3276
c1cn2c(c1O)OCC2,0.2187
OCCC12CC3C(C1)N23,0.313
CC#CC(C)C(O)C#N,0.267
C(C1CN1)C1=NOC=C1,0.2424
O=CC1NC(=O)C11CC1,0.2121
c1c([nH]c(n1)CO)C#N,0.2138
CC12CN1CCC1NC21,0.2867
c1nc(no1)C2CCC2,0.2616
CC1OCC2OC2C1C,0.3323
OC1CC2C(C1)C2C#C,0.2884
CN1CC2C(NC=O)C12,0.2297
O=C1C2CC3CCC13N2,0.2347
OC12C3C4N3C1C2C4=O,0.2075
CC1CC1CNCC#N,0.2663
NC(=O)C(CO)OC=O,0.2507
CC(O)COCC1CO1,0.3298
N=C1CC(CO1)C#N,0.2767
CCOC(=O)C1CN1C,0.2326
O=COC1COCC1=O,0.2063
CN1CC2(C1)CC(=N)O2,0.2513
CCCC1(CO1)CCC,0.3369
c1c[nH]c(cc1=O)CO,0.201
O=C1CNC(=O)C11CO1,0.1891
N=C1OC2C3CC1NC23,0.2485
NC(C#N)C1NC1C#C,0.2694
CC1OC2(C)CC(=O)C12,0.2161
c1c(con1)C2CCC2,0.2431
NC1=NC2COC1C2O,0.2497
CC12CCOC3C1CC23,0.3292
CC1C(=N)OC11COC1,0.2815
C1COCC(=N1)N2CC2,0.2431
CCc1cc([nH]c1)O,0.2435
Cc1c[nH]c2c1[nH]nc2,0.2125
ON=C1C2OC2C1O,0.2364
[O-]C(=O)C#CC1C[NH2+]C1,0.2052
CC12CC(C1)NC(=O)O2,0.3006
CC12C3CC1(CC23)C#C,0.2764
CC1=C(C)C(CO)OC1,0.2463
CC1CC2C(C)(C)C12O,0.3057
C1CC2C=CC3C(O1)C23,0.2452
C1C2CC1C21CN=CO1,0.2667
c1c(coc1N)N2CC2,0.2219
CCC(=O)n1ccnc1,0.1979
CC1=C(C)C(O)C2NC12,0.2386
OC1CC2CC12C=O,0.2204
CC1OC11CC(=O)C1C,0.2144
CC12CCC(O)C1(C)N2,0.2995
C1C(=O)COCC(=O)N1,0.1959
CC12C3C4N1C2C34C=O,0.2058
CN(C)C1(COC1)C#C,0.2624
OC1C=CCC(=O)C1=O,0.1554
CC(C)C1(CC1)C2CC2,0.3375
Cn1cc(nn1)NC=N,0.2164
O=CC1COC2COC12,0.2283
CCC1(C)CC1OC,0.3184
C1C2OC34CC3(OC4)C12,0.2698
N#CC12CCC3C1NC23,0.2746
CN=C1N=CN=NN1C,0.15
C#Cc1c[nH]c(n1)N,0.2077
CN1C2C=CC1C2CO,0.2162
CCC1(CC1OC)C=O,0.2214
COC1(C)CCC1=O,0.1983
CC12CC1C(N)(C2)C#N,0.293
OCC(O)C(O)CO,0.3129
c1c(c(no1)CC=O)N,0.1649
CC12CC3C1C3(O)CO2,0.3002
CN1C2COCC12C,0.3098
CN(C)c1ncon1,0.21
CNC(=O)CN(C)C=O,0.256
O=CCC1C2CC=CC12,0.2197
C1COC(=O)C=C1N,0.2095
OC1C2CCC12C1CN1,0.3016
CC12CC3OC(C1O)C23,0.308
CCCC1CCC(C)O1,0.3313
C1CC1(C#N)N2CC2,0.2817
Cc1c(non1)CCO,0.2398
CC1C(C)N1C1CCC1,0.2872
C1C2C3C4CCCC13N24,0.3074
C#CC1(CC1)C=O,0.2249
CC(C)N1CC(=O)C1,0.2073
C#CC1C2COC1C=C2,0.238
CC1N2CC2C1(C)CO,0.294
OC1C2CC3C2C3C1=O,0.2226
CC1COCC2NC12C,0.3066
CC(CN1CC1)N1CC1,0.3095
c1coc(=O)cc1F,0.1867
OC12CC1CC1OC1C2,0.3227
C1C(CN1C(=O)N)O,0.2917
C1C(=CNC1=O)C(=O)N,0.1917
CC12CC1C(C2)C(N)=O,0.2734
CC1CC(=N)OC(=O)N1,0.2673
C1C2NC3=CN=NN3C12,0.2296
CC(O)(CC1CO1)C=O,0.2239
C#CCC(=O)CO,0.2327
COCC1(N)CNC1=O,0.2531
CCN(C=N)C(=O)NC,0.2399
N#CC1=CC2NC2C1,0.2066
CCC(CC#C)C#CC,0.2897
CC(C)C1CN1C,0.3037
CCC#CCCOC=O,0.2634
OC12CC(C=C1)C(=O)C2,0.207
CC1OC2C=CCC2=C1,0.2467
COc1nnon1,0.2195
CC1(O)CC2CCC1O2,0.316
C1OC11C2CC3C2CC13,0.3443
OC1=CNC(=N)C(=N)O1,0.1594
CC(O)(CO)CCC=O,0.2302
CC1NC(=O)CC2NC12,0.2738
N#CC12NC3C1OC23,0.2556
OC1C2C(O)C(=O)C12O,0.2112
OC12C3C4N=C1OC2C34,0.1451
CC12CCC(C1)N1CC21,0.3111
CC1N=C2OCC2C1C,0.2657
CN1C2CC3(CO3)C12,0.3138
OC1C(=O)CC2CC12O,0.224
CCC1OCCOC1C,0.317
NC12CCC1(N)C2C#N,0.2631
N=C1CC2CC(O1)C2=O,0.2065
C1CC(C1)O,0.3361
C1CC12COC(=N2)C=O,0.168
COCC(C)C1CCO1,0.3279
N=CN1C(C#N)C1C#N,0.2492
CC(C=O)C(C=O)C#C,0.2069
OC12CC3C(C13)C2C=O,0.2102
c1c(onn1)C2COC2,0.2177
OCC#CCC(O)C#N,0.2651
OC1C2CC(C3CO3)C12,0.3116
CCCCCCCC#N,0.3478
C#CC1(OCCO1)C#N,0.2765
CC#CC12OCC1C2O,0.2403
CC1CCCC=CC1C,0.2589
COCC12CC3C(C1)C23,0.323
COC1CCN2C(C)C12,0.2953
CN1CC(=O)C1(C)C#N,0.2019
CC(C#N)C1=CN=CO1,0.2423
CN1CCC1C(=O)C#N,0.1555
COCc1nnon1,0.2039
COC1CC2C=CCC12,0.2603
CC(C)C(O)C(C)(C)C,0.3187
Cn1c(cc(=O)cn1)N,0.1861
CCC1C2OC(C)=NC12,0.2561
CC1CNC(=O)O1,0.3141
CC12CC(CC1)C21CO1,0.3365
CC(O)(CO)C(=O)C#C,0.1973
O=C1CC2C(C#N)N12,0.2323
CN1C=NC(=N)NC1=O,0.2041
CN1CC2OCC1CO2,0.2851
C#CC1OC1C#C,0.2605
CC1CC(C)C1CCO,0.3348
Cc1cc([nH]c1N)C=O,0.1636
OCC1OC2CCC12O,0.296
CCCN1CC1(C)C=O,0.2162
CC(CO)C1=CC=CO1,0.2362
c1c2c(c([nH]1)N)ocn2,0.1976
Cc1cnn(n1)C=O,0.2169
CCC1CC(OC)C=C1,0.2611
C(CO)NC(=O)CO,0.2767
OC1COCOC1=N,0.2711
CCNC1COC1=NC,0.2554
O=C1CCC2NC2C1=O,0.1682
OC1(CC1CC#N)C#N,0.2945
CC1OC2(C)C(C=O)C12,0.2102
C#CCCOCC#N,0.2798
CC12CCC34OC(C13)C24,0.2955
COCC12OCC1C2C,0.303
C1OC1C12CN3C1CC23,0.3094
CNc1cccc(c1)N,0.203
c1(nnon1)C(=O)N,0.1933
C#CCNC(=O)CCO,0.2716
CC1=CC(=O)C(O)CN1,0.1859
CC1(CC(=N)O1)C1CN1,0.2732
COC(C)CC(C)C#C,0.3075
CNC1=NC(CN1)C#N,0.2579
O=CNCC1CC1C=O,0.2272
Cc1nc(nc(n1)F)O,0.2398
O=C1NC=CC(O1)C#C,0.219
CCC1CC(C)C1,0.3688
CC1CC1N1CC1CO,0.3059
CC(C#C)C(O)C1CN1,0.2813
CCC1NC1C1CO1,0.3192
N=C1OCOC1=O,0.2287
CC(C)Oc1c[nH]nn1,0.221
CC1CC(C)N(C1)C=O,0.2657
CC(C#N)(C#N)OC=O,0.2608
CC1C2CC1OCC2,0.3184
CC12NC1(C)C1OC21,0.3158
CC(O)CN1CC1C,0.3155
CC(=O)C1(C)C2CN1C2,0.2217
CCCC1(C)C2COC12,0.3078
OC1CCN2CC12C#N,0.2758
CC(CC#N)CN1CC1,0.2806
CC(C)C1(CN1)C(C)=O,0.223
CN(CC#C)C(=O)CO,0.2684
c1c(con1)N(=O)=O,0.2095
CC1C2COC1C2(C)O,0.3159
CC1C2OC=NC1C2C,0.2598
CC1C2OC(OC12)C#C,0.2752
CC1=CC(=N)NN=C1F,0.1569
NC1CN=COC1C#N,0.2452
CN=C1NC=NC(F)=N1,0.1758
O=COC12CC1CC2=O,0.2274
Cc1c(c(n[nH]1)C)NC,0.2329
NC1C(CO)COC1=O,0.2551
CC#CC(C#N)C(C)O,0.2902
Cc1c(onn1)N,0.2091
CC1C=C(NC1=O)C#C,0.1832
OC1CCCC(=C1)C#C,0.208
O=CCN1C2C3CC3C12,0.1992
CC1=CC2(C)CC1C2O,0.2395
Cc1nnc2n1nc[nH]2,0.2157
CC(=O)C1(C)CN1,0.2291
CC12CC(C1)C(=O)OC2,0.2762
Cc1ccn2c1C=CC2,0.1739
CC(=O)C1NC2COC12,0.2222
CN(C)C(=O)C(F)(F)F,0.2547
CC1CC2NC(=O)NC12,0.2995
CCC12CC3(C)OC1C23,0.3043
CC1OC2(CC12)C1CN1,0.2984
CC1CC=CC(C1)C#C,0.2631
O=CCOC1CC1C=O,0.2145
c1nc(=O)ncnn1,0.1179
CC1C(C=O)C1C#N,0.2224
OC12CC1C1C2CC1=O,0.2069
CCC1COC1COC,0.3133
CCC1C2CC2C11CC1,0.3308
CC12OC1C1(O)CC21O,0.2751
COC12CC1C(CO)C2,0.3175
CC#CC1=NCC(=N)N1,0.1934
CC1C=CC2C(C#N)C12,0.2445
CC1OC2CC1C2=O,0.2073
CC12CCC3(CO3)C1O2,0.3284
[O-]C(=O)C12CC1NC=[NH+]2,0.2396
OC1CCCC1=O,0.2234
CN(C=O)C(CO)C#N,0.2666
O=CC1CC23CC(C2)C13,0.2144
N=C(OC=O)C#N,0.2188
CCC1=NC(=N)C=NO1,0.1951
OC1C=CC2(OC12)C=O,0.2153
CC1(C)CCC(O)C1=O,0.2199
CC1C2N1CC(=O)C2=O,0.137
O=C1CC2C3N=CN1C23,0.2072
O=CC12CC3C4C1N4C23,0.2131
CC1CC=CC(C)CO1,0.2554
CC1(C)CCC1CC#N,0.3339
C1CC2(C1)C(=NO)CO2,0.2405
CC1CC1C12CCC1O2,0.3145
c1cn2c(cc1=O)CC2,0.1969
c1(c(c([nH]c1O)O)O)N,0.2111
CC1C2C(N2C)C11CN1,0.2961
CC12C3CC11OCC2C31,0.3158
CC1(C)N2CCC12CO,0.3068
c1c[nH]c2c1occ2N,0.2021
c1c(c(c(=O)on1)N)N,0.1591
OCC1COCCC1=O,0.2187
CCC1C2COCC12C,0.3244
C1C2OC3COC1C23,0.3159
CC1CC(N1)C(F)(F)F,0.3056
CC12OCC1N1CCC21,0.2677
OCC1CN1C1(C)CC1,0.2807
CC12CC(C(O)C1)C2=O,0.2312
CC(O)CC(C)N1CC1,0.2968
CC1CC=CC2CC12C,0.2443
CC(O)C1=CN=CO1,0.2424
COC12COC1C2(C)O,0.2828
c1c(nn[nH]1)OC=O,0.2384
Cc1c(nc([nH]1)N)O,0.2206
CCC(=O)C(C)(O)CO,0.228
CC1CCC2NC2CO1,0.3102
CC1C(O)C1C#C,0.285
CN(C=O)C1CC1O,0.2649
CCN(C)c1[nH]ccn1,0.2338
CC1OC2(C)CC3C1C23,0.3245
CC1(CC=O)CC=CC1,0.2241
CC#CC(O)C(O)CO,0.2824
OC1(CC1C1CN1)C=O,0.2019
CC(O)C1C2NC1C2O,0.3051
CC1(C=CN(C1=O)C)C,0.2106
C(=O)NC(=O)C(F)(F)F,0.2131
OC12CCC1OCC2,0.3128
C1CC2=CC3OC3C2=C1,0.1902
N=C1CC2OC3C(O1)C23,0.2645
CC1=C(COC1)C#C,0.2041
CNC1C(=O)CCC1=O,0.1684
N=C1NN=C(N=C1)C#C,0.1474
C#CCc1cc(co1)N,0.2176
C1CC2CC=CC2=C1,0.1943
CC(=O)C(=O)N1CCC1,0.1759
O=C1C2CN2C1C#C,0.2129
CC12CN3C1C3(CO)C2,0.3165
COc1[nH]c(cn1)O,0.2464
OC1C2C3C=CC1C23O,0.2345
CC1(O)C2CC2C2OC12,0.3216
C(CN=COC=O)C=O,0.2245
C1C(CC1=O)NC(=O)N,0.2144
CC1=CC(C=O)N2CC12,0.1983
C1CC(C1)OCCCO,0.3224
Cn1c2c(nn1)onn2,0.1936
CC1C(O)C(C)C1C=O,0.2206
CC12C=CCC11CC2C1,0.2559
Cc1c(con1)N(C)C,0.2103
CC1NC1C1(CN1)C#N,0.283
CC#CCCC(=O)NC,0.2687
CC12CC3C(OC13)C=C2,0.2349
CCCOC(CC)C#N,0.3034
CCCC12CC(C)(C1)O2,0.3208
CCC1(OC)C2CCC12,0.3232
C1CC2C3C4OC4C2C13,0.3389
CC(=O)C1(O)CC1C=O,0.2029
C1NC11CC=C2COC12,0.239
CCC1C2COC(=O)C12,0.2714
N=C1CN=C(N1)C1CC1,0.2204
CC#CC#CC1CN1,0.2087
C#Cc1c(nccn1)O,0.1756
CC12C3C(CN13)C2CO,0.3043
COC1C(C)C1(N)C#N,0.2682
CC(C)CC(=O)N1CC1,0.2537
CC12CC1CC2=NO,0.2463
CN(C)C1CC(O)C1=O,0.1775
CC1CCC2CC1C2O,0.3157
C1OCC23OC4C2OC134,0.2865
C1C2C3C2C2(COC2)N13,0.3079
CC1=C(C(=O)NC1)C,0.2242
OC1CCCC=C1,0.2581
CCC12CC1C(C)(O)C2,0.3191
c1cc(oc1N)OC=O,0.192
C1CC(=O)NCC1=NO,0.2387
ON=C1C2NC2C2NC12,0.2217
CC1CC(CO)C2CC12,0.3395
C1NC2=NCC3OC3C12,0.2529
C#CC1OCC=C1C#N,0.2136
c1cnn(c1)C2CCC2,0.2603
C#CCC12CC(C1)CO2,0.294
CC12CC1(N)C(=N)O2,0.2602
COC(C)C1NCC1=O,0.2178
O=C1CNC2CCC=C12,0.1751
OC1CC2C(O)CC12,0.2995
C1CC11CC2CC(C1)O2,0.3244
CC12CC3C4CC1C2N34,0.3188
COCC(C)C1CN1C,0.307
CC1CC2(C)OC2(C)C1,0.3299
CC1OC1C(=O)C=O,0.1503
CN1C(=N)OC=CC1=O,0.2046
CCC12CCC(O)C1O2,0.3261
CC1=NC(CCO1)C#C,0.266
OCC1CCC(C=O)=C1,0.1936
CC1OC1(C)C(=O)C#C,0.1951
CCCC12OC3C1NC23,0.2969
CCC12CC3C(CC13)O2,0.3249
CC1(O)CC1(O)CCO,0.2903
OC1C(O)C11COC1=O,0.2609
CC1(O)C(O)C2COC12,0.2992
OC12CCC1=CNC2=O,0.1987
C1OC23C4CC2C(O4)C13,0.2975
CC1(C)CC(=O)C2OC12,0.2126
CCOCC1CCC1O,0.3203
C1OC23CC4C2C=CC134,0.2089
NC(C#N)C1CCC1O,0.2827
NC12CN=C3OC1C23N,0.1565
CN1CC(=O)OCC1=O,0.2529
CC1CC2OC(C)(C)C12,0.3087
C1OC2CC1CC=C2,0.2482
CC1CC(C)C(C1)C#C,0.3104
CCOc1c[nH]nc1N,0.2247
CC1CC(C1)(C)C,0.36
COC1CC(C1)OC=N,0.2824
CN(C)Cc1cnon1,0.1909
N#CC12CC1OC21CC1,0.2622
OC1CC2CC3C2CC13,0.3271
CC1CCC1C(O)CO,0.3112
N=COCC1OC2CC12,0.2777
CCCN(CC#C)C=O,0.2695
C1CC=C(C(=O)C1)C=O,0.1599
CC12CC(O)C1(CO)N2,0.2889
NC1=NC(CC#N)CO1,0.2746
CC(O)C1C=CC2NC12,0.2422
CN=c1cnonc1,0.1834
CC#CC1COC(=N)N1,0.261
CC1(C)NC1CC=O,0.2189
COCC#CC1CCO1,0.27
CNC1=CNN=NC1=N,0.1565
CC1CC(=O)N(C)C1=N,0.25
OC1CC1C1=NON=C1,0.237
C1OC2COC1COC2,0.316
NC(=O)C1CO1,0.2627
CC1OC2CC(O)C12,0.3009
CC1C2OC2C1(N)C#N,0.2836
CC(O)C1NC1C(C)=O,0.2241
CC1C2C3C2C1(O)C3C,0.3157
CC1C(O)CC2NC12C,0.3084
CC12CC1OCCC2O,0.3107
CNC(=N)C(=O)C1CN1,0.1673
CCC1CCN(C1)C=O,0.2655
CNc1ncc(o1)CO,0.2221
OC12CC(=O)C1C=CC2,0.2077
CCC1NC1(CO)C#C,0.2722
CN(C)C(=O)C(=O)C#C,0.1664
C1OC2CC1N=CO2,0.2696
N#CC1COCC1C#N,0.3001
OC12CC1CNC2=O,0.2665
Cc1c[nH]c2c1cno2,0.2145
OC1C(=N)OCC11CO1,0.2757
CC1CC2(CN2)C=C1C,0.2433
OC12COC3CC1OC23,0.3113
CC1(CC1)CC(F)(F)F,0.3574
CC1=C2CC3C(C23)C1O,0.1717
O=C1OC(C=C1)C1CC1,0.2261
CC1(CCC12CCC2)C,0.3389
C1C2OC11CCOC21,0.2956
CC1NC(=O)C(C)C1C,0.2711
OC12CC1(O)C(=O)NC2,0.263
CC12CN3C(C13)C2C#N,0.272
CC1(O)C2OC3C2OC13,0.2843
CC1(O)CC2CC1C2,0.3309
C1CC23CCCCC12O3,0.322
CC1C2CC(CO)N12,0.3011
CC#CC(=O)N,0.2342
CC(C)(C(=O)NC)O,0.2695
C1C=CC(=O)C1=NO,0.1613
OCC12CC1COC2=O,0.2665
OC1(COCC1=O)C#N,0.2093
CN(C=N)C(=O)N1CC1,0.2401
COC12C=CC3C1CC23,0.2275
O=C1CC2OC3CCC123,0.2136
O=CN1CC2OCC2=C1,0.1939
CC1C2C3OCCC3N12,0.2903
N#CC1=CC2COC1O2,0.2079
N#CCC1CC2CC1C2,0.3461
CC1(C=O)C2CN1C2,0.2117
Cc1c[nH]c(=O)c(n1)N,0.1681
CC1(NC1CO)C1CC1,0.3217
O=C1CCCC2CC1C2,0.2229
N=C1OCC2C(C=O)C12,0.2207
CC1C(N)C1(C#N)C#N,0.2517
CN1C(=O)CC1(C)CO,0.2761
CCC12CC1OC(=O)O2,0.3177
CCOC1C2CC1C2=O,0.2446
O=C1OC2CN3CCC123,0.2286
C1OC2C11CC22COC12,0.1631
CCn1c(ncn1)C#C,0.2157
OC1C2NC2C(=O)C1O,0.2029
CCC1(C)CC(CO)O1,0.3143
C1CC1(C#CC#N)C#N,0.2235
O1C2C3C=CC2C13,0.2236
CC1C(=O)C2(C)CC12O,0.2245
COC1C2CC1O2,0.313
C1CC23OC1C2CC=C3,0.2432
NC(=O)C12CC(O1)C2O,0.265
CC1N=C(N)OC1CO,0.2763
CC(C#N)C(C)C(C)=O,0.2299
CN=COc1cocn1,0.2198
O=C1CC23CC2(CO3)N1,0.2614
C1C2C1C1C3COC1C23,0.3248
CC1COC=N1,0.2712
COC1OC=NCC=C1,0.2303
CC1C(C)C1(C=O)C=O,0.2112
CC1(CCOC1)NC=O,0.2752
C1C2CC3CC1C1C2C31,0.3466
C1CC(C1)CC2CCC2,0.3574
O=C1CCCC1N1CC1,0.2118
CCC1CC1CC(C)C,0.3479
CC1OC(C#C)C1=NO,0.2454
C(C(=O)C(=O)C(=O)N)O,0.1511
C1C2C3COCC=C1C23,0.223
C#CC(=O)OC1CCC1,0.2368
CCC(O)C1(C)CC1O,0.3232
CC[NH2+]CCCC([O-])=O,0.2725
C#CC1N=CN2CCC12,0.238
CC1(C)OCC11CC1O,0.306
C(C#CC#CC#N)O,0.1864
C1C2N3C1C21COCC31,0.3053
CC1CCC2CCC2O1,0.3199
O=C1COC2CC(C2)N1,0.254
C#CC12OCC1N1CC21,0.2411
OC1CNC(=O)C1=O,0.1697
O=C1CC23NCC2NC13,0.1785
c1c2c(nc(o2)N)on1,0.2012
Cc1ccnn1CCO,0.2541
[NH3+]CCOC1=NC=N[N-]1,0.2681
CN1CC1C(=O)OC=N,0.2116
N=C1OCC2CNC2=C1,0.2049
CNC(=O)C(O)C1CC1,0.2735
C1C2C3CC1C23,0.3515
C1C2OCCCC3C2N13,0.3049
CC1(C#C)C2OC1C=C2,0.2314
C1CC=C(C1)C(=O)C=O,0.1483
Cc1cc2n(n1)CCN2,0.2402
CC1C=CC2(C)OC12,0.2459
CC(CO)C(CO)C=O,0.2274
C1C2C3CC4C3CC4N12,0.2999
Cc1cn(c(n1)OC)C,0.2439
N=C1OCC(=C1)C1CC1,0.2095
CCCNC1COC1=O,0.2438
CC12OC3CC1OC23C,0.3231
O=CC12CC1OC2C#C,0.2218
OC1CC2(CO2)C1C=O,0.2208
COC1CC(=NO)C1C,0.2472
CCCNc1c[nH]cn1,0.22
OC1CNC2=CNN=C12,0.2097
CCC1(CCO1)C#N,0.2834
CC1CNC(=O)C1=NO,0.1955
C1CC1(CNC=O)CO,0.2793
O=CC12CC3C(CC13)O2,0.2182
Cc1c(n(cn1)C=O)N,0.183
CN1CC(C#C)C1=O,0.2696
CCC(C)C1CCC=C1,0.2626
CC(C)(CC#C)N1CC1,0.2833
CC12C=CC3C1N2C3=O,0.2101
CCOc1cnn(n1)C,0.2283
Cn1ccc(c1)O,0.2317
Cc1cc(no1)C(=O)C,0.2008
OC1CCCNC(=O)C1,0.2687
CC1=COC(=N)C=C1,0.1648
N#CCC1CN2CC12,0.2798
c1c(ocn1)CC(=O)N,0.2272
COCC1=CC(=O)NC1,0.2175
NC1=NCCC1(O)C#C,0.2353
C1NC11COC2CC2C1,0.2921
C#Cc1ccn[nH]c1=O,0.1552
CC1C2CC(CO)C12C,0.3164
OC12CC(C1)C1CN1C2,0.2928
O=C1CC2C3CC3C2=C1,0.1932
C1CC(C1)(CCO)C#N,0.3023
CC12CC1C1(CN21)C=O,0.1919
COC1(C)C2NC1C=C2,0.2211
C1CNC(=O)C(=O)CN1,0.1763
CC1C(C)(C)C11COC1,0.3054
CC(O)C1OCC2NC12,0.3151
COC(C#N)C(N)=N,0.2504
c1c(nc2n1CCC2)O,0.2276
CCC1(CN1)C1CN1,0.3044
CC1OCC(C)C(=O)O1,0.2702
CC#CC12CC1C1CN21,0.2406
NC1=NCC(O)C11CO1,0.246
COC1CC2(CCO2)C1,0.3095
c1cnn2c1OCCC2,0.2449
CN1C2CC1(C=C2)C#C,0.2163
CCC(OC)C(=O)NC,0.2659
CN1CC2CC2CC1=O,0.2635
CC12CC1C1CC(C1)O2,0.3103
N=C1CC2COC(=O)N12,0.265
CC1C=CC2(NC12)C=O,0.2168
CC12CC(N1)(C=O)C2=O,0.2069
CNC(C#N)C1CCO1,0.2751
CC1=C2COC2C(=O)N1,0.191
CCCN=COCCO,0.2722
N=C1C=COC=C1C#N,0.1885
CC12C3OC1C1C3N21,0.3078
CC1=Cc2cn[nH]c2C1,0.1978
C1COC(O1)C(=O)C=O,0.1399
COC(C)(CO)CC=O,0.2235
CNC1=CC(=N)N=CO1,0.185
CC12NC3C(=O)C1C23O,0.2263
c1c2c(c[nH]1)NCCN2,0.2238
CC12CC(C)(C#C)C1O2,0.2919
CC1(C)CN2C(CO)C12,0.3013
Cc1ccoc1N(C)C,0.2358
CC(O)C(C)C1(C)CC1,0.3174
CC1OCC2CC12O,0.3207
CCC(C)C(C)(C)C#C,0.3187
CC12CC3C(C1)C3CC2,0.3308
Cc1c([nH]nc1O)C=O,0.1703
N=COC1C=CNC1=O,0.2041
CN1CC1C1CC1CO,0.2808
OC1COC(=N)C=C1,0.2166
C(C(CO)C#CC=O)O,0.1997
CC12CC1(NC=N2)C#N,0.2399
COC1(CC=CC1)C#C,0.2675
CC(O)CC1=COC=C1,0.2421
CN1CC11CC(C1)C#N,0.2695
COC1OC(CO)C=C1,0.2501
C1COCCC1C(=O)N,0.2727
C1C(CO1)N=COC=O,0.221
OCC1C2CC(O)CN12,0.2835
CC1OC2C(O)C12C#N,0.2664
O=C1NCC1CN1CC1,0.2763
CC1NC1(C#C)C#N,0.2595
N=C1OC2=C(O1)C=NO2,0.2093
Cc1cc(cc(n1)N)O,0.2123
COC1(C)CCCC1=O,0.2047
CCC#CC(C)(C)O,0.2932
CCC(C#N)C(O)C#C,0.2909
CCOC1CC2(C1)CC2,0.3261
CC1C(C)N1C1CC1O,0.2956
CCCC(CO)C1CC1,0.3388
CC(=O)N1CC1,0.253
CNC(C)(C#N)C1CN1,0.2792
CC(O)C1(CCO)CN1,0.3082
CC1NCC1(C=O)C#N,0.1985
OCC1COC2CN1C2,0.3024
C[NH2+]CC(=O)[CH-]C=O,0.1928
CC(C=O)C1OCC1=O,0.2103
O=C1C=CC23CC12CO3,0.1769
CC1(C)C2N3CC2(C)C13,0.3077
C1OC23CC4C(CC24)C13,0.3141
CCC,0.4179
CC(CO)C12CN(C1)C2,0.2967
CCC1CCOCC1O,0.3242
O=C1CN2CC2C1C#C,0.2001
O=CC1OCC11CC1,0.2101
CC12CC=CCC1O2,0.2701
CC1C=C(C=O)C2NC12,0.185
CC1C2CC1C(C)C2C,0.3638
[NH3+]CC1=N[N-]C=CC1=O,0.1612
CC12CC3C1C2N3C=O,0.2483
CC(CO)OC1CC1,0.3256
CN1CC2(C1=O)CC2,0.2752
[N-]1[NH+]=CC=C2C=CN=C12,0.1515
ON=C1C2C3N2CC13O,0.2424
O=C1NCC11CCO1,0.2488
C1CC(C1=O)(CO)CO,0.2153
CC1=CCC(=NC)OC1,0.2486
CCCCC(CC)C#N,0.3445
C1OC1C12CC(C1)CC2,0.3477
CC#CC(CO)C(C)=O,0.2147
CC1(CCC=C1)C=O,0.2102
COC1C2NC1C2CO,0.3004
CCC1(CC)OC2CC12,0.3139
CN1CC(C1)N(C)C=O,0.2555
ON=C1CC2CNC2=C1,0.1894
CC1CC(C)C11CC1O,0.3107
C1OC2CC=CC3C1C23,0.2493
CCC1(CCC1)CC,0.3534
C1OC2C3C4C3C2C4O1,0.347
COC12COC3CC1C23,0.3161
CNC(=O)N1CCC1C,0.2909
CCC(C#N)C1COC1,0.2873
CC1(CC2CN12)C(N)=O,0.2708
c1c-2[nH]ncnc2cn1,0.1099
CCC12CC(C1)C1OC21,0.3367
N=C1NCC2CC(=O)N12,0.2404
CCC(=NO)CCC#C,0.2506
CC(=O)N1CC2OCC12,0.2647
CC1(NC1(C)C#C)C=O,0.2202
c1c[nH]cc1N,0.2299
COC12C(C)C1C1OC21,0.2869
Cc1c([nH]cn1)C=O,0.1906
Cc1ccc([nH]1)C#N,0.2032
CCC12CC3(C)CC1N23,0.3245
CC1=CCC2NC12C#C,0.2364
COC(=O)NC1CC1O,0.2925
C(=O)Oc1c(nno1)O,0.1939
NC1CC(=N)OC1C#N,0.2615
N=C1ON=C2CCCN12,0.225
C#CCC1OC11CCC1,0.3078
OCCC12CCC1O2,0.3242
N1C2C1C1OC3C2NC13,0.2844
CC1NC11CC(C1)C=O,0.2245
CNC(=O)C(O)C=O,0.207
CCOC1CN2CC12,0.3073
C(CN=C(C#N)N)C=O,0.2076
O=CC1NC1C1COC1,0.2199
CCc1ccnc(=O)[nH]1,0.18
OCCC1=NOC(=N)O1,0.2452
CC1CC(O)C1,0.3318
CN1C=NCC1(C)C#N,0.2405
O=CC1(CO1)C#CC#C,0.2014
CCC(=O)CNCC=O,0.2066
CC1=C(C(=O)OC1)CO,0.2294
CC1COCC2CC2O1,0.3183
N=COC(=O)CC#C,0.2478
c1c(ncnn1)C(=O)N,0.1516
OCC(NCC#N)C=O,0.2177
OCC12CC1(CO2)C#C,0.2606
C1OC1C1=CN=NC=N1,0.165
CCCn1ccc(n1)N,0.2301
CC12CC1(O)C1CC21,0.3211
CCNc1nc([nH]n1)C,0.2262
CC(=O)C12OC3C1NC23,0.2041
CC1C2C(C)C1(O)C2O,0.3202
CCC(C)C(C)OC=O,0.284
CC1C2OC2CC2OC12,0.3274
CN1C2COCCC12C,0.3022
CC1OC11C(C)NC1=N,0.251
C1CNC(=O)NC(=O)N1,0.2659
CC1CC2CCC1O2,0.3253
C1C2CC1C21C2CC1C2,0.3881
Cc1cnc(nn1)O,0.165
CC(CC#C)NC(N)=O,0.2918
CCCCC#CC#N,0.2463
CC1OC11COC=NC1,0.2709
CN1C(CCO)C1(C)C,0.2895
C1CNc2c1c(no2)N,0.2276
CC1C2CC1(CC2)C#N,0.3231
CC1(CO)OC1CCO,0.3322
OC1C(C#C)C1(O)C#N,0.2576
O=CNC12CC3C1N3C2,0.2547
N#CC12NC3CCC1C23,0.2434
C#CCC#C,0.2978
OC1CC2C3CN3C12,0.2736
CC1C(C)C11CC(O)C1,0.3287
NC1C=CC2NC12C#N,0.226
CC(C(N)=O)C(F)(F)F,0.2754
c1cn(nc1O)CCO,0.2397
C1CN(CC=C1)CC#N,0.2514
OC1CC(O)(C#N)C1O,0.2674
CCC1C2CCC(=O)C12,0.2232
CC1COC2CC12O,0.2921
C#CC1COC2COC12,0.2945
O=C1OC2CCC1C=C2,0.2341
OC12CC3(C1)OCC3C2,0.3091
CC1(CN1)C1=NOC=N1,0.2293
CC1CC(C#C)C(=O)O1,0.262
Cc1c(nc[nH]1)NC=O,0.2154
C1OC2C=CC3C1C23,0.2348
O=COC12CC(C1)C2,0.279
COCc1c(non1)N,0.2134
c1cnc(cc1F)O,0.2234
Cc1cocc(c1=O)O,0.1939
CCC1N(C)C1(C)C#N,0.2712
CC1(C#N)C2CCCC12,0.3138
c1(c(nc([nH]1)O)O)N,0.2409
Cc1cc2c(o1)CCC2,0.2238
CC(=O)CCC1CC1O,0.2333
CN(C)C(=O)C1CN1C,0.2339
OC1(CC1)C#CC1CN1,0.2615
CC1CCCC1CO,0.3376
NC1C2C[NH2+]C12C([O-])=O,0.2545
CCC12CC1(O)C1OC21,0.3092
CN1CC23OC4C2CC134,0.2593
CC1C(CO)C1C1CC1,0.3143
CC(C)CC(C)(O)C#C,0.3
ON=C1C2CC1CC2,0.2623
CC1OC2(C)CN3C1C23,0.312
Cc1c[nH]c(c1C=O)N,0.1729
CCC1CC11COC1,0.3114
COC1=NC(=N)OC=N1,0.1947
O=CC1C2CN(C=O)C12,0.2085
Cc1cc(no1)O,0.2474
N=C1OC=C(C=C1)C#C,0.1586
CCc1c[nH]c(c1O)O,0.232
OC1C2CCC2C1C#C,0.282
Cc1cc([nH]c1O)C,0.2296
C1CC1C(=O)C2CC2,0.2294
CC(C)C(C)C(N)C#N,0.2819
CN=C1N=NOC=C1N,0.143
CC(=O)C1=CCOC1=O,0.1797
C(=O)C(=O)C(=N)NC=N,0.1156
CC1=C(C)C2OC2C1,0.2387
C1C2N1CC1=CNN=C21,0.2349
CC1CCN2N=CC=C12,0.2599
CC1(CO)CN1,0.3186
O=CC12COCCC1O2,0.214
CC1(C)OC1C#N,0.2932
CN1CC1CC1CC1O,0.2943
OC1C2OC(=N)C(O)C12,0.2568
CC1=CC(=O)C(CO)C1,0.1935
CC1=C(C)C(O)C(=O)N1,0.2058
CCCC12CC1C(C)C2,0.3285
CCC1CNC=CC1=O,0.1886
CC1CC2=C(O)C=NN12,0.2345
C#CC12CC3C(CN13)C2,0.2638
c1noc(=O)n1CC=O,0.2068
CC#CC1(CC1)C(C)O,0.2814
N#CCC1C2COCC12,0.3036
CCC1NC11COC1=N,0.268
OC(CNC=O)CC#N,0.2739
CCC#CC(C)CC#N,0.285
CC(C)(C)C(C)(C)C#N,0.3511
C1C2CN1C21COC1,0.3071
Cc1c(coc1N)OC,0.2262
O=CCC12CC1C1NC21,0.1925
OC1COC(=N)C1C=O,0.227
CC12OC3CC1C(=O)C23,0.2181
c1c(n(nn1)C2CC2)O,0.2431
c1c(c(nc(=O)o1)O)N,0.1671
OC1C2OCC2C11CO1,0.2891
CC1CC(O)COC1=O,0.2684
CC1(O)C2N3CC2(O)C13,0.3024
c1cnoc1NC=O,0.2107
CC12C3CC(C13)C21CO1,0.34
CC1C2COC1C2=O,0.2067
CN1C(CO)C1CCO,0.2875
CCCC(C=O)C1CN1,0.2094
CC1C2CN2C=C1C=O,0.1834
C[NH2+]C(C)(C#C)C([O-])=O,0.2665
CC12NC1C(O)C2(C)O,0.2996
C[NH+]=C(N)C(C)C([O-])=O,0.2299
C1=CNC(=O)NC=C1,0.1658
OCC12CC3OC1C23O,0.2828
C#CC1CC2CCC2O1,0.2859
OCC1C=CCCC=C1,0.2493
OC1(CC(=O)C1)C1CN1,0.2117
CCNc1c(cco1)C,0.2162
CC(C)CC(=O)CCO,0.2337
OC12C3CC1CC23C#C,0.2712
O=CC1C2C3NC3C12,0.2289
CC12CC(CCO)C1N2,0.3237
C1CC2OC=NC3C1C23,0.2604
CC1C2CC2(C)C1O,0.3145
CC(=NC)OCC1CC1,0.2779
COCC1CC(=O)C1,0.2227
CC1OC2CC1(O)C=C2,0.2402
[N-]1[NH+]=CC=C2N=CN=C12,0.1726
C1OC23COC(C=C2)C13,0.2305
NC12CC3NC1C23C#N,0.2413
N=C1OCC(=C1)C1CN1,0.2036
CC1(C)C2CC2C11CC1,0.3294
C#CC1OCCCCO1,0.2922
CC12CC1C=CC2C=O,0.2154
CCC1C2OC(CO)C12,0.3055
CC1(C)C2CC1C(O)C2,0.3354
CCC1CC(=O)C1OC,0.2014
CC1C2CC1(O)C2=O,0.246
OC1C(O)C1CC#C,0.2863
CC(C)C12CC(C)(C1)O2,0.3143
Cc1cc(c([nH]1)N)OC,0.2239
CCCn1nc(nn1)C,0.2577
CC1(CO)CC1(C)C#N,0.3101
CC1C2C3C2C2(O)C3C12,0.2969
O=CNC=NCC1CN1,0.2293
COCC1(C)OC1(C)C,0.3312
CC12CCC3CC1(O)C23,0.3048
CC1CC2C3C4C1C4N23,0.2826
CC1(CCC1)C(=O)C#N,0.2039
OC1CC1CN1CC1,0.306
OCC12C(O)C1CC2=O,0.2304
COCC(=O)N1CC1,0.2326
NC1C2CC1(OC2)C#N,0.2553
COCCC12CC1OC2,0.3053
OCC1C2NC(=O)NC12,0.2827
c1c2c(con2)ncn1,0.1627
CN=c1n(c(no1)O)C,0.2445
CC1CC2NC1C2=O,0.2305
C1C2N1CC1=C2OC=N1,0.2184
c1c(=O)[nH]nc(n1)N,0.1426
C1C2OC2C2=CON=C12,0.2412
COC12CC(C1)OC2=N,0.2755
CC(C)(CO)C(O)C#N,0.29
C1C2C3C4OCC13C24,0.3276
Cc1ccoc1COC,0.2327
CC#CC#CC(C)C,0.2274
C1CC2C1C21CCCO1,0.3075
Cc1cc(n(n1)C=O)C,0.2112
CN(C)c1ncc(o1)N,0.2216
CCC(C)N(C)C(C)=O,0.2678
NC1=CC(O)=NC(=N)O1,0.1897
c1cnc(c(c1F)F)F,0.233
CCc1c(nco1)C=O,0.2017
C1CC1(C=O)C(F)(F)F,0.234
CC12CC3OC(C1)C23,0.3114
OC1COCC(=O)C1=O,0.1472
CN=C1OC2CCC12C,0.2772
CCC(C)N(C)C(N)=O,0.2894
CNc1c(non1)C#N,0.1786
COC(C)C1CCOC1,0.3268
[NH3+]CC1CC(C1)C([O-])=O,0.0909
c1c(c(c[nH]1)CO)CO,0.2525
OCC(CC=O)OC=O,0.2238
CC#CC1(C)COC1=O,0.2563
CC(=N)OCC(O)C#C,0.2904
OCC1N=CNC1=O,0.2285
Cn1c(ccnc1=O)N,0.1845
CC12CC(C1)(C#C)C2O,0.2847
O=CC1N2CC1(C2)C#C,0.2107
CN1C=NC(C=O)C1=N,0.2007
C1CC11OC2CCCC12,0.3055
N=COC1OC(=N)C=C1,0.22
CC(C)C(=O)C(O)C#N,0.2321
O=CC12CC(O1)C2C#N,0.2149
C1CCC=CC=CCC1,0.2311
CC1CNC(C#N)C1O,0.2657
CC1(NCC1=NO)C#N,0.2337
CCC1(C)OC1C=O,0.2156
CCC1(CC1CO)C#C,0.2912
CC1C(CC1C#N)C#N,0.3163
[O-]C(=O)CC[NH2+]CC#C,0.2691
C1CC23NC2CN2C1C32,0.3022
N#CC(C1CC1)C1CN1,0.2861
OC1CC1OCC=O,0.2058
CC1C2CC=C(C)C12O,0.2461
CCC12CC1CC2O,0.3192
N=C1OC23CC(C=C2)C13,0.2276
CC(=O)CCCCCO,0.2344
OC1C(C#N)C1C1CO1,0.2923
CC1CC(=O)C(C)N1C,0.2072
N#CC12CC(C1)C=CC2,0.2494
O=CC12OCC1C1CC21,0.2049
O=C(C#N)C1CCCN1,0.15
CCC1CC2OC12C=O,0.2146
Cc1cnc(o1)C=O,0.1812
OC1(C#N)C2C3CC2C13,0.3027
c1c(nn[nH]1)CN2CC2,0.2425
Cc1c(ncc(=O)[nH]1)N,0.1428
CN1C2CC3(CC3O)C12,0.2954
OC12C=CC3C1N3C2=O,0.2127
Cc1c(nc([nH]1)O)CO,0.2356
CC(CC(C)=O)C#N,0.2349
CCN=COCC1CN1,0.2636
C1CN1CCC#CC#N,0.2159
OC1CC1(O)CC1CO1,0.2913
O=CC12CN(C1)C2C#C,0.1885
N=C1OCC2(NC12)C#C,0.2472
C1CC1C(=NO)C2CC2,0.2368
OCC12CN1CCC2=O,0.2127
N#CC1(CC2CN2)CN1,0.2587
COCC1C(C)NC1=O,0.2806
[NH3+]C(CNC=O)C([O-])=O,0.2479
CC(=O)NC1(C)CC1O,0.2636
CC(C=O)C(C)N1CC1,0.2145
CC1=CCC2(CCO2)C1,0.2618
OC12CC1OC=NC2,0.2641
CC(=O)COC(=N)C=O,0.1802
CN1N=NC=C1C1CN1,0.2404
Cc1c[nH]c(n1)COC,0.2472
C1CN=COC(=O)OC1,0.264
CC1=CCC(=O)C(=N)N1,0.1476
c1c(cn[nH]1)CO,0.2558
C#CC1NC11CC=CC1,0.2618
CCC(=O)OCCC#C,0.2842
CC12CC3CC(C)(O1)C23,0.314
C1C2CCC3NC3C1O2,0.3022
CC1CC(=O)C2CN12,0.2182
CC12COC1(C)C(O)C2,0.3058
CCNC(C)(C=O)C#N,0.2039
CN=C1OCC2OCC12,0.2671
CC12CCC3(C)CC1C23,0.3358
CC(C)C(C#N)C(C)C,0.3447
C1CC2(C=C1)OCCO2,0.2625
CC1C2N=COCC12C,0.2502
CCC1C2OC2C2OC12,0.3166
CCC12OCCC1C2C,0.3081
CC(C)n1nccn1,0.2587
C1C=CNC1=O,0.2152
CCCCNC(=O)N,0.3024
CN1C(=N)OC(N)=C1C,0.2188
CC1C2OC1(C=O)C2C,0.2124
CC(=O)C1(CC(=O)C1)C,0.2224
COC1CC(C)CC1O,0.315
OC1COCOC2CC12,0.3289
CC1(CN1)C(=O)CC#N,0.2246
OC1CC11CCCCC1,0.3296
CN1CC(C1)(CO)C#N,0.2556
CC(=NO)CNC=O,0.2469
COc1ccc([nH]1)N,0.2352
C(C#N)C(=O)CNC=O,0.2095
c1c(nc(cn1)O)C#N,0.1847
CC(=O)OC12CC(C1)C2,0.2799
CCC1CC(=O)C(=O)C1,0.1442
OCC12CCC1CC2=O,0.2165
c1c(c(=O)[nH]nn1)F,0.188
CC1CCC(=O)CO1,0.2104
CCC#CC(OC)C#C,0.2681
Cc1cccc(c1N)O,0.2052
OC12COC11CN(C1)C2,0.3116
OC1CC2CC12O,0.3276
OC12C3C1C1C3OCC21,0.3045
CCOCC#CC(C)C,0.2813
COC(CO)C#CCO,0.2819
C[NH2+]C(C)C([O-])=O,0.2661
C1CC1N1C2C3NC2C13,0.2879
CCC1C(C#C)C1C#C,0.2683
CCN1CC(C)C1=O,0.2775
C1NC11CCC11COC1,0.3089
C(C1CO1)C1=CN=CN1,0.2482
CC12CC3CC1(O)C23C,0.2966
CC1CC=CC11CC1O,0.2456
Cc1c(ccc(=O)o1)O,0.1546
CC(OC(C)C#C)C#C,0.2825
CC12NC3C(OC13)C=C2,0.2245
C#CCOc1[nH]ccn1,0.2319
CCC1(C)CC1C#CC,0.2794
CC1(C(=O)C=CN1)C,0.1902
CC1N2CC1(CC=O)C2,0.2052
CC1(OCC2CC12)C=O,0.2116
CCCC12OC1C1CC21,0.2944
CCOCCC(=O)N,0.279
C#Cc1cc(=O)cn[nH]1,0.1715
N=C1NCC2=C1ON=N2,0.1848
CC(=O)C1(CC1)NC=O,0.2252
O=CNC1=NC2CC2N1,0.1942
CC1=CC2NC2C=CC1,0.226
N#CC1OC2CC2C=C1,0.2345
CC(C#C)C1CCOC1,0.2948
O=C1C2C3C2N2CC3C12,0.2094
C(C(=O)N)NC(=N)C=O,0.1528
CCCc1cncnn1,0.1643
C1CC2COCOC2=N1,0.2707
C#Cc1coc(n1)CO,0.214
CN1CC2OC3(C)C2C13,0.2806
c1c(=O)[nH]c(nc1F)N,0.2044
CC1COC(C=O)C1O,0.2237
CC12CC1CNC2C#N,0.2735
CN1CC1CCCC#N,0.2662
CCCOC(=O)N1CC1,0.2897
CC(O)C(C#C)C#C,0.2844
CC1CC2OC3C2C13C,0.3056
CC1CC2(C)NC2C=C1,0.2427
C1C2CCC3C4OC23C14,0.2161
CC1(CN1)C1(CN1)C#C,0.279
CN1C=C(F)C(=N)N=N1,0.1684
CC1CCC(C=C1)C#C,0.2596
O=CCN1CC1C#C,0.2179
CC1C2CC1C(C)=C2,0.2385
c1nc(no1)NC=O,0.231
O=C1C2C3CC1CC23,0.2266
CCC(CCC#N)C#C,0.3062
CC1C(C)C(C)(O)C1O,0.2948
CCC1OC=NC2CC12,0.2526
OC1CC(C1O)N1CC1,0.2921
C#CCC12CC=CC1O2,0.2448
CN1N=CC(N)=NC1=N,0.1606
COCC12CC(C1)C2=O,0.254
CC1(CC2CC1C2)C#N,0.3421
OC1CN2CC2C2NC12,0.271
CC12CC3(CO)CC1N23,0.3219
OC1=C(F)NC(=N)C=C1,0.1496
CC(C)(C1=CCOC1)O,0.2484
OC(C#N)C1CCC1O,0.2909
CC1(C)CCN2CC12,0.3047
OCC(O)CC(=O)C=O,0.1559
CC1CC2C3C4C(C13)N24,0.3117
CC12OCC3C1COC23,0.3106
O=CC1C2C=CC1C2=O,0.2054
c1coc(c1N)CC=O,0.1662
O=C1OCOC2CC12,0.2634
CC1OCCC1(C)CO,0.3066
C1CC(O1)C1=CON=C1,0.2413
CC12C3C4N3C1C24O,0.2675
CNC(=O)c1cn[nH]n1,0.2203
O=C1CC2OC(=O)OC12,0.2028
CCC#CCN(C)C=O,0.2711
CC(C#N)C1C(O)C1O,0.287
CC(C)OCC1CN1,0.3209
c1c([nH]c(c1O)N)C=O,0.1573
CCCC1C2OCC12O,0.2872
NC1=NC2(CC2O1)C=O,0.2067
CC(C)(CN1CC1)CO,0.302
OC1C2C3OC1C23C#C,0.2597
CC1(C)N=COC2CC12,0.2703
COCC1(O)C2COC12,0.2972
OC(C#C)C1=CON=N1,0.2344
CCCn1c(ccn1)N,0.2436
CC1(CC(=O)C1)CC#C,0.2209
C1CC1C1CC=CC1,0.2661
COCC#CCOC,0.2845
c1c2cnncc2n[nH]1,0.1693
OC1CC(=O)CC1C=O,0.2171
CCNC(=O)NC=O,0.2436
c1c(=O)cc([nH]c1O)O,0.2194
C#CC12CC1CC1CN21,0.28
CC#CC(=N)OCC#N,0.2364
N#CCC1COC1C#N,0.2743
Cc1nc(=NC)cno1,0.1844
C1CN1c2[nH]c(=O)[nH]n2,0.2399
CCCN1CC(=O)C1C,0.2075
OCC12CC(CO1)CO2,0.332
CC(=O)CC1CC2NC12,0.2239
CC(O)C12CNC1CO2,0.2876
COC1=NCC(C)N1C,0.2662
OC1(CC=O)CC=CC1,0.2243
CC1CCCC=CCC1,0.259
N=C1OC2COC3C2C13,0.2717
CC1CCC(CO)=C1,0.2587
OCC1CCC(=N)OC1,0.2761
CC1CC1CC=O,0.2258
CC1C=CC2CCC1O2,0.2574
NC12C=CCC1OC2=O,0.2302
OC12CC(C1)COC2=N,0.2823
CC(O)C1=C(O)NC=C1,0.2365
C#CCC#CCC#C,0.2856
CC12CC(C=O)C1(C)N2,0.2067
NC(=O)C(NC=O)C#C,0.2571
C1CC2C=CCCC2O1,0.2609
N=COCC(=O)C=O,0.1466
COC(C)C1(O)CC1O,0.2902
N#CC1C2C=CC1N2C,0.2142
CCc1c(oc(n1)O)C,0.2386
N#CC12CC3C4C3N1C24,0.2634
CC1CN2C1=NNC2=O,0.2375
Cc1cc(=O)cc[nH]1,0.2022
C#Cc1cc(c[nH]1)CO,0.1994
C#CC(=O)c1ccon1,0.1942
CN1CC11CCC11CN1,0.3038
COCCC([NH3+])C([O-])=O,0.2705
CN=C1OC(C)=NC=C1,0.1762
c1c(coc1C=O)CO,0.1853
CC#CC1=CC(=O)NC1,0.1933
CC1CC2OC1CC2O,0.3231
O=C1CC2C(NC12)C#C,0.2006
C(CC#N)C#CCC#N,0.2861
CCNC(CNC)C#N,0.2666
OC1C2NC2CC11CN1,0.3019
COCC1C2CC1C2C,0.3394
CC(C)OC1CCCC1,0.3153
CC12CC3(C)N1CC23O,0.3087
CC1N2CC1(C2)C(C)=O,0.1963
CN(C)C(=O)NC=O,0.2396
CC1C2C(O)CN2C1=O,0.238
CC(=O)C1CC=CC1O,0.2326
c1cc-2ccnc2oc1,0.1459
CCn1cc(nn1)C=O,0.2035
CC#CC1NC1(C)C=O,0.2029
CCCn1c(=O)[nH]cn1,0.234
CNC(=O)C#CCC#C,0.235
CCC12CCC1(O2)C#N,0.2692
C1OC2C1N1N=CN=C21,0.258
OC1CC11CCC(=O)O1,0.2743
OC1C2C3NC(=O)C2C13,0.2555
CC1CN1C1(CC1)C=O,0.1978
OC1COC(=O)NC=C1,0.2304
CCc1c(nco1)C#C,0.2133
CC1C2CC1(NC2)C#N,0.2628
CCC1OC1CNC=O,0.2823
c1nc2c(o1)nco2,0.2045
CCc1c(n[nH]n1)C#C,0.2203
N#CCC1COCC=C1,0.2642
O=CC1(CC2CN12)C=O,0.2047
CCCC1=NCCCO1,0.2728
C1CC12CCOCO2,0.3393
CC1=C(N)C2CC2C1=O,0.1901
N#CCCC#CC1CN1,0.2581
C#CC1=CC2CCC2C1,0.2077
CC1CC2(C)COCC12,0.3271
CNc1c(cc[nH]1)OC,0.2282
CC1CC2(C1)NC2C#N,0.2819
O=CC1COC1C=O,0.1981
CCC1=CC2OCC2C1,0.2502
CC1(C)CC1(C)CCO,0.3323
CC12CC1OC1CC1O2,0.3178
C#CC1N2CCC12C#N,0.2444
C1OC2CCOC12,0.3317
CC(O)CC(C)C1CC1,0.3324
OCC12CCC1OC=N2,0.2562
C1C2CC3(CCO3)C12,0.3161
CC12CCCC(O)C1N2,0.2974
NC1=C(OC(=N)N1)C=O,0.1679
Cc1coc(n1)NC=O,0.2056
CC1OC2C3NC2C13O,0.2827
c1c(noc1CO)CO,0.2437
CC1CC1C(O)C1CO1,0.342
OCC#CC1OC2CC12,0.2562
CCC1C2NC(=O)C12C,0.2504
CC12CC(=N)OCC1N2,0.274
[O-]C1=CC(=[NH2+])NC=C1F,0.202
CC12CCC(=O)C1(C)O2,0.2115
CC1CC(=O)NC1=N,0.2496
OCC1CC1CCC=O,0.2275
O=C1CC2C1C1CCN21,0.1903
CN1CC2(CC1C2)C#N,0.2484
N=C1OC2C1OC21CC1,0.2529
CNCc1nc([nH]n1)N,0.2409
CC(O)C12OC1C1NC21,0.2684
C(C1CN1)C1=CN=NO1,0.2261
CC1(C)C=C2CC3C2N13,0.1656
NC1=C(C#N)C(=N)OC1,0.196
CC1(O)C(=O)COC1=O,0.2083
CN=C1OC2CC1C2O,0.2703
CN1C(CO)C2OCC12,0.2866
N=C1OC(=NC=C1)C#N,0.1595
CC(=NO)CC1(CC1)O,0.2449
O=CNC1CCC2OC12,0.279
COC(=O)C(C)C(C)O,0.2792
CNC(=O)NCC(=O)N,0.2559
CCCNc1ccn[nH]1,0.2382
CCC1C(O)CC1(C)O,0.3174
Cc1c(c[nH]n1)N(=O)=O,0.2049
COC(=O)c1c[nH]cn1,0.2259
CC1=C(C(=NO)CC1)C,0.1919
CC(=NO)C#CC1CN1,0.1904
OC1C2C3N4CCC13C24,0.2889
CCC12C3C4CC1N2C34,0.3038
C1CC1N(C=O)C=O,0.2246
C(CC(=O)N)CNC=O,0.2746
CCC(CC)CC#N,0.348
CC1CC1(C=O)C(N)=O,0.2162
CC(C)COC(=O)N,0.3232
Cc1ccc(c(n1)F)N,0.1932
O=C1NC=NC1CC#N,0.2283
CC1C2CC(C2)C1C,0.3736
OC1CCC2CN2C1,0.2882
O=C1CC(=O)C(N1)C#C,0.2058
CC(=O)CC(=O)C#C,0.18
CC1CC2(CC3OC23)O1,0.3126
CCC1CNC=C1C=O,0.1792
CC1C2CCC(O)C12C,0.32
CCc1cncn1C,0.2456
N=COC12CC(C1)C2,0.2802
CC1CC(=O)CC2CN12,0.215
OC1CC(C=O)C11CC1,0.22
CN1N=NNC(=N)C1=N,0.1961
CC1C=C2CC3C1C23,0.1787
CC(CCO)C1CCC1,0.3418
CCN(C)CC(F)(F)F,0.3028
O=C1CN2CC1NCC2,0.1791
C1CC2(C1)CC1COC21,0.3082
C1CC(=O)C=C1CCO,0.193
CC(=O)NC=NC,0.2355
C#CCC1(CO1)C#N,0.277
OCC1COC11COC1,0.3092
CC1OCC2=CON=C12,0.2358
CC1C2C(=O)C(O)C12C,0.2143
[O-]C(=O)CN=CNC=[NH2+],0.1228
C(CC#N)CC(=O)C=O,0.1576
OC1CC1(CC#C)C#N,0.2673
CCC(CC)C(C)(C)O,0.3286
CC1=CC2(CC2)CC1O,0.2439
CC#CCC1OC2CC12,0.2899
FC1=NC(=N)C=CN1,0.1991
OCC(O)C1CC2CN12,0.3052
CC1CC(=O)C1NC=O,0.2208
CCC1CN(C)C1=O,0.2782
CCCC1C2C3CC3C12,0.2831
CC(O)C(=O)C#CC=O,0.1888
C1CC1(CC#N)CO,0.3139
C1C23CCOC12CCO3,0.3045
OC1CC2C(C#N)C12O,0.2774
CCC1OC2CC1C=C2,0.2432
CC(CO)C(C)C1CC1,0.3387
CCCN=C(CO)OC,0.2673
NCC1(OCC1N)C#N,0.2549
c1(n[nH]nn1)NC(=N)N,0.1858
CN=C1OC=NC(N)=N1,0.1805
COCCC(O)C(C)=O,0.2259
CC1OC23CC(C)(C2)C13,0.3011
CCC(O)(C=O)C#N,0.2193
CC1(CC1)C2(CC2)C=O,0.2257
c1c[nH]c(c1N)CO,0.2159
CCC1C(CO)N1C,0.2811
Cc1ccnc(n1)O,0.2151
CCC1(O)CCC1=NO,0.2465
COC1=C(C[NH3+])N=N[N-]1,0.2193
CN=C(C#N)OC1CC1,0.2219
CC1C2CC2C1C#C,0.3012
CC1C=CCCNC1=O,0.2456
CC1C(CNC1=O)C#N,0.2707
CC1OC1C1C(C)C1C,0.3263
CN=C1OC2COC1C2,0.2639
CCC(=O)NC1CCC1,0.2764
CCC(CC)C(N)C#N,0.2817
CC1C(CC1=NO)C#N,0.2487
O=C1C2CCC2C2CN12,0.2337
C1C2C1C1OCC21,0.3117
CN=C1ON=C2CCN12,0.2167
C1OC2C=CCN3C1C23,0.2321
OC1C2C1C1CCC21,0.3075
CC12OC1CN1CC21,0.2955
CC12CC3C(N1)C3C2=O,0.2118
CNC1C2NC2C1=NO,0.2195
O=C1OC2C3CC12CO3,0.2529
CN(C)c1c([nH]cn1)N,0.233
CNC(C#N)C#CC=O,0.1891
C1CC23NC2C=CC3=C1,0.188
CC1CCC(O)C(=N)O1,0.2822
CC(O)C1=NOC=C1N,0.2073
CC1CC=CC1,0.2648
N#CC1C2OC1C1OC21,0.2818
OCC1CN=COC1=O,0.2353
CC(=N)OCCCCO,0.2992
CC12CC3NC3C1(C)O2,0.3214
CC(=O)OCC(=O)C=O,0.157
CC(O)(COC=N)C#C,0.2817
OCCC1CC2(CO2)C1,0.3308
OC1CC2C3OC2C13O,0.2814
CC1CC(=O)C(=O)CO1,0.1511
OC1CC1C1CCCO1,0.298
CC(C)C(=O)CC=O,0.2059
CC1C=C(C)C2(C)OC12,0.2438
CCCCCC(=NO)C,0.2559
CCC(O)(CO)C(C)O,0.317
O=C1CCC2(CN12)C#N,0.2424
CC1OC2CC1C(C)=C2,0.2457
CC1(CC2OC2C1)C#C,0.3125
NC1(CC1C1CC1)C#N,0.2923
COCC1(O)CC1C#C,0.2919
CCN=C1NC(C)CO1,0.2788
CC(O)C1=CC(C)CC1,0.2576
CC(O)C12C3CC1CC23,0.3105
CCC1CC(=O)NC=C1,0.2131
CC1C(O)C(=O)C11CC1,0.2121
CC1(C)OC2(CC12)C=O,0.2188
CC(C)OC(C)C=O,0.2245
CC1(C=O)C2CCC1O2,0.2179
CCC#CC1(CC1)CC,0.2827
CN1CCC1C(F)(F)F,0.3067
C1NC11CC2OCC1O2,0.321
O=C1CCCCC11CO1,0.218
CCOc1nc(on1)N,0.254
CN1CC1C(O)C#N,0.2537
CNC(=N)C(=O)CC#C,0.1703
CC1CC(C)OC(=O)N1,0.3033
c1(nc(nc(n1)F)O)N,0.2488
C1NC11CC2OCC2=C1,0.2186
CCC1OCC(C)(C)O1,0.3252
CC1C2C(C)CCC12C,0.3276
OC12C3CC1(CC23)C#C,0.2698
CCCOC1CC1,0.3356
C#CCC1C2CCCC12,0.3116
CN=C1NC(=N)OCO1,0.2504
OCCOC(CO)C#C,0.285
CC1NC=C(C=O)C1C,0.1796
CC1=C(CCOC1)CO,0.2513
CCC1C(O)C2OCC12,0.3
Cc1cc(oc1O)N,0.2237
CC1OCC2(NC12)C=O,0.2184
OC1C2CC1(O)CC2,0.3168
C1NC11C2OC1C1OC21,0.3002
OC1CC11CCC=C1,0.2456
CCC(OC)C1(O)CC1,0.3157
CNC(=O)OC(C)C#C,0.2884
CC#CC(C)(O)C#C,0.2721
CC(=O)C1(COC1)C#N,0.2274
CC1C2OC(=O)C(O)C12,0.2632
OCC#CC1NC1C=O,0.2163
COCC#CC(C)C#N,0.2735
N#CC12CC3CC1N23,0.2702
CC1(CO)CCC11CC1,0.3346
O=CNC1C2CCC1O2,0.2766
O=CC12C3C4C(CC14)N23,0.2123
c1cncc(c1O)C=O,0.181
CC1(COC1)C#CC#C,0.2267
COCC(=O)C1(CC1)O,0.2259
CC1C(CCCO)N1C,0.2886
N#CC1C2C3CC1CN23,0.2853
C#CC1(CC(=O)C1)C#N,0.2213
CC12CC3C1C2OC3=O,0.27
OC12CCC1(O)COC2,0.3015
O=C1OCC23CC12NC3,0.2451
CC1(O)C2CC1C2C#N,0.3024
NC(=O)OC1CC1C=O,0.2296
CC12CC1C(CC=O)C2,0.2251
c1c2c(on1)CCC=C2,0.1933
COC1CC2(C)NC12C,0.2894
CN1CC2(C1)NC2CO,0.2865
C1C=CC=C(C=C1)C#N,0.1701
N=C1OC2CC1C(=O)O2,0.2558
O=C1CC2C(CC#N)N12,0.2335
C1CN1C1=NCC2NC12,0.2454
CC1(CC1)CCCOC,0.3337
Cc1cnc2n1C=CC2,0.1948
CCC(O)(C#C)C(N)=O,0.2536
CCC1(C)OCOC1=N,0.2896
CC(O)C1(C)OC2CC12,0.3059
FC1=NC(=N)NC(=O)O1,0.234
CN1C2CNCC(=O)C12,0.1903
CC#CC12C3CN1CC23,0.2486
N=C1CNC(=O)CO1,0.2625
OCC12CC1C=CC2,0.2491
N#CCC1CCCOC1,0.2899
CC12CC3C1OC23,0.3118
CC12CN=C3OC1C23,0.1625
OC1C2NC1C2OC=N,0.2751
CC1OC2C(C#C)C12,0.2774
OC1(CCC2OC12)C#C,0.2788
CC#CCC(C)(N)C#N,0.2784
CCC1CCCC1O,0.3293
CC1OCC2OC1C2O,0.3242
C1C2OCC3CC(O3)C12,0.3151
CC12C3CC1C=CC23O,0.2362
CCOc1ccoc1C,0.2162
CCC12COC3CN1C23,0.3126
Cc1[nH]c(c(n1)N)O,0.2326
Cc1c2c(on1)CC=C2,0.2004
CNc1cc(ncn1)F,0.218
C1CC2CC1CC=C2,0.2617
CCC12OC1CCC2=O,0.2109
OC1CC1C1(O)CC1O,0.2754
CC(O)C(=O)NC=O,0.2226
CC1OC(C=O)C1C#N,0.2122
C1CC1C(=O)CC(=O)N,0.2103
CC1(C)C2CC(C#N)N12,0.2583
O=C1NC=NC2CCC12,0.2249
c1c(ocn1)C(=O)N,0.2172
C#CC1C2OCC12C#C,0.2557
CC1OC2COCC2O1,0.3247
OCC12OC1C(=O)C=C2,0.1739
CC1=Cc2c(c[nH]n2)C1,0.2046
O=C1OCC23CN(C2)C13,0.2335
CC1CC2CN2C1C#N,0.2745
CCc1cnccn1,0.1966
CC(C)C1(CO1)C1CO1,0.3388
CC1(CO)CC(CO)O1,0.3108
CC1C2CC1N1CC21,0.3227
CC1N2CC2C1(C)C,0.3056
CC1(O)COC1CC=O,0.2248
C#CC1OC11C2CC1C2,0.2729
N=C1OC2C3CC1C23,0.2705
C1C2NC3=C(N=NN3)C12,0.2149
CC1=NCC(O)C(=O)O1,0.2376
CC1CC(=NO)C2CC12,0.245
CC1(C)CC1NC=O,0.2706
NC(=O)C1CN1C=O,0.2426
CC1OCC1(C=O)C#C,0.2135
CCCC(=O)C1(CC1)O,0.2254
CC1CC2CC2N1C=O,0.2566
CC(COC=N)C=O,0.2305
CC1CN=C(C1)OC=O,0.2426
CC1(C(=CC(=O)O1)N)C,0.2236
C1OCC2CC1OC=N2,0.2762
CC12CCCC1(N2)C#C,0.2807
CCc1c[nH]cc1O,0.2371
N=C1ON=CC(=O)C=C1,0.1639
COC1(C)OCC=C1C,0.2618
CC12CC1CC=CCC2,0.259
CC1(OCC1O)C#N,0.2808
C1NC1C1=CC2OC2C1,0.2294
CC#CC1CC=CC1C,0.2623
CCN=C1C(=O)OCO1,0.217
CC12CC(O1)C=CCC2,0.2395
OCCC1COC(=O)N1,0.3115
O=CC12CCC1O2,0.2152
Cc1cnc(nc1C)N,0.1955
CC1CC=CC=CC1=O,0.1695
C1OC2CC11OC1CC2,0.3237
OCCCC1OC1CO,0.3374
CCNC1(COC1)C#N,0.2674
CC(OCC1CO1)C#N,0.2928
CC1(OC=O)C2CC1C2,0.2793
O=C1CC2CC1C21CN1,0.2234
NC1(C#N)C(O)C1C#C,0.2523
COC(C)C1NC1CO,0.3112
CC1=CCC2OCC2C1,0.2553
COC1(C)CC1(O)C#N,0.277
CC(=NC)NC(=N)C#N,0.1884
CC12COC1C(C2)C#C,0.2819
CN=C1OC=CC=C1O,0.1646
OC1C2CC1C21CO1,0.312
CC1OCC2CCOC12,0.3119
NC1C(O)COC1C#N,0.2725
NC12CCC1C2(O)C#N,0.2667
CC(=O)C(O)CC#N,0.2377
CC1=NNC(O)=NC1=N,0.1933
CC1CC1(C)OCC#N,0.2796
Cc1ccc(n1C)C,0.2322
C(=O)c1c(n[nH]n1)O,0.1946
C1CNC(=C1C=O)C#N,0.1534
CC12NC1C(=O)CC2=O,0.2142
CC1CCC=C1C(C)=O,0.194
C1C2CC1C1=C2NN=C1,0.2367
CN=CNC(=O)OC=N,0.2332
O=CNC1=NC2CC2C1,0.2171
CC1CC2(C)C(C)OC12,0.3154
O=C1OC2CCOC2O1,0.3284
COC12CC1OC2=N,0.2721
CC12OC1CC2CCO,0.3249
CC(O)C(C)(C)C=O,0.2278
CCc1cc(no1)C#C,0.222
CC(O)C(O)C1CO1,0.3205
CC12CC3(O)C1C(O)C23,0.3296
OCC12CC(CO1)C2O,0.3067
CN1CC2(CCC12)C#N,0.2452
c1cc([nH]c1)C#CC#N,0.1706
C#Cc1[nH]c(=O)ncn1,0.1794
CC(=N)Nc1ncno1,0.2242
CCNc1[nH]ncn1,0.2509
CCCCC1CCC1,0.371
CN=COC1(CC1)C=O,0.214
CC(C)C12OC1CC2O,0.3207
CC1CCC(O)COC1,0.3148
O=C1NCC(N1)C#N,0.2747
N=C1OCC(O1)C=O,0.2076
ON=C1CC2CC=CC12,0.2421
CC1CCC2=C1CCC2,0.2524
CC1OC1C1(CO)CO1,0.3334
O=CC(=O)C1CC2CC12,0.1488
C(CO)C(=O)CCO,0.235
CC12CC1C(=O)OCO2,0.2612
O=C1CNC(C1)C1CN1,0.2036
CC1CC2=CC=C(N)N12,0.237
OC1CC11NCCC1=O,0.1986
CC1CC2=CCCC2=C1,0.196
O=CC(OCC#N)C#C,0.2177
COCC1OC1C(C)C,0.3354
CC1CN=C2OCCN12,0.2735
N#CC(C1CN1)C1CN1,0.2762
CCCC1CC1N1CC1,0.3185
CC(C)(C)c1c[nH]nc1,0.2553
OC12CC3CN4C(C14)C23,0.3035
CC(=O)N1CCOC1=O,0.2557
CC1C2C3C(O)C3CN12,0.2676
CNC1COCOC1=O,0.2316
CC1=C(NC(=O)C1)CO,0.2057
C#CC1=CCOCC=C1,0.1742
N=COC1=NC=CN=N1,0.1655
CC1NC23CC4C2OC134,0.259
CNC(=NC)C(O)C#N,0.216
CC(O)CCC(F)(F)F,0.3413
CC1OCC(C#C)C1C,0.2917
N=C1NC=CCC(=O)N1,0.2197
NC1=NC(N)=NC(=N)O1,0.2073
CCOC(=N)COC,0.296
CCC1CCN1CC#N,0.2606
c1c(nc[nH]1)COC=O,0.2426
CC1CC(N)(CO1)C#N,0.2809
C1C2N1CC1=C2N=CN1,0.2305
CC(C)C1OC(C)C1=O,0.2197
CC1(CC(O)C1O)C#N,0.2986
CC(=NO)C1CC1(C)O,0.2403
CCCC1CN1C(C)=O,0.2542
CC1N(C(N)=O)C1(C)C,0.2825
CC1=NC(=N)N=C(F)O1,0.2209
CC(C)OCC(=NO)C,0.2555
CC1(C)C2C3OC2C13C,0.2992
c1cc(c(cc1N)O)N,0.1852
Cc1[nH]c(=O)c(cn1)F,0.1931
CN=C1OC2CNC2=C1,0.191
OC1CC2CC1C1OC21,0.3199
[O-]C(=O)C(=N)NC=[NH2+],0.1985
c1nc2c(o1)COC2=O,0.2349
CC1CC(C)(C)N=CO1,0.2745
OC1C2CCC12NC=O,0.2657
COC1CC1OC(C)=O,0.2706
C1OC2CCOCC12,0.3171
COC1C(=O)CC11CO1,0.1946
CC1(O)CC2(O)COC12,0.2978
COC1OCC(O)C1=O,0.2141
C1C2C3C4CC(CN24)N13,0.2886
OC1C2C3OC3(C#C)C12,0.2568
C1NC1C1=NOC=C1,0.2477
N#CC12CC3CCN1C23,0.2769
CCC1CC1OC,0.334
c1c(c2c([nH]1)C=CC2)O,0.1711
O=C1C2CC2CC2NC12,0.2188
CC(OC=N)C(F)(F)F,0.2896
C(=O)Nc1c(n[nH]n1)N,0.1937
C1CC11CCC2OC2C1,0.3406
CC1CC2C3N1CC23O,0.2906
CC1C2C3C1OC23C,0.3103
c1c([nH]nc1CO)CO,0.2545
COCC1(O)CC1(C)C,0.3151
COC1C(O)CN=C1N,0.2522
COCC1(C)OCC1=O,0.221
CC12OC3C(C13)C21CC1,0.3092
C1COC(=N1)CCCO,0.2701
CC1C(O)C2(CC2)C1=O,0.2131
C1CC23CC4(CCC24)C13,0.1391
CC1(C)NC1C(O)C#N,0.2718
CCC1C2NC2C2CN12,0.29
O=CNC1C2COCC12,0.2695
CCC1(C)C(O)C1OC,0.3027
O=C1CC2COCC1O2,0.2125
C1CCC(=CC1)C=O,0.1981
OCC#CC1C2CN1C2,0.2509
c1[nH]nc(n1)C#CC#N,0.1992
CC12CC(C1)NC2=O,0.259
O=CCC1OCC11CN1,0.2194
Cc1c(nc(o1)O)CO,0.2358
CNc1ccoc1,0.221
CC1C2C3C2N2C3C12C,0.2937
OCC1(C#N)C2CC1N2,0.266
OC1CC(=O)CC11CO1,0.2227
OC1=NC(=NN1)C1CN1,0.2424
CC(=O)c1c[nH]c(n1)N,0.1874
CC1(C)OCC1(O)C=O,0.2158
CN(C)C(C#N)C(C)=O,0.2093
COC(=O)CC1CC1,0.2846
C1C=CC(=CCO1)C#N,0.1773
[NH3+]CC1=CC([O-])=CO1,0.0805
CC1(C)CC2=CCOC12,0.2348
CC12CC3(C#N)C(N1)C23,0.2614
CCC1OC2C(O)C2O1,0.3052
OC12CC3C1CC23C#C,0.2893
CC1(CC#C)NCC1=O,0.2113
CC1C2CC1(C=O)C=C2,0.2111
CC#CC#CC(=NO)C,0.1731
Cc1c2n(nn1)CC2,0.2512
CC1=NCCNC(=O)O1,0.2555
CC1CC(C)C(=O)N1,0.2727
OCCC1CCOC1=O,0.2688
OC12CC1CCC2C#N,0.3044
CC(O)(CCO)C1CO1,0.3384
N#CC12OC1C1COC21,0.253
CC(C)(C=O)C(=O)OC,0.2311
OC1C2CCCC=CC12,0.2397
CN1C2CC2(O)C11CC1,0.2717
COC(C)C1=CN=NN1,0.2515
c1cc(ncc1F)C=O,0.1824
OC(C#C)(C#N)C1CO1,0.2778
CN1C(CO)C1C(C)=O,0.2012
OC1(CC#N)CCC1=O,0.2062
CC1=C(C=O)C2CC1O2,0.1823
FC1=C(F)C(=N)N=NO1,0.1967
CC#CC12CC1OC2=N,0.2505
CC12CC(CCC1O)O2,0.3065
C1CC11CCCC11CO1,0.3259
C#CCCC(=O)C(=N)N,0.1809
CC12CC1C1C(C=O)N21,0.1957
C1C2CC11CCCC1O2,0.3129
Cc1cc(=O)c(no1)F,0.1903
CCCN=COC=O,0.2386
CCCC(O)C1COC1,0.3068
O=C1C=C2NCC3C2N13,0.1697
CCCCCCCCO,0.3427
c1c(c(c(o1)N)N)C#N,0.1871
COc1c(nco1)CO,0.2298
CCC(=O)NC(=O)OC,0.2471
COC12C3CN(C13)C2=N,0.2483
CC(=O)c1ccn(c1)C,0.2007
OCC1(CC1O)C=O,0.225
COC1(COC1)C#C,0.2787
c1cnc(cn1)C#N,0.1901
Cc1cc(=O)n(nc1)C,0.1776
COC1(COC1=O)C#N,0.2409
c1c(c(nc(n1)N)N)F,0.196
CCC12CCC1C2CO,0.3162
COC12CC1C(C)OC2,0.3344
CC1=CCC(=NO)C1=O,0.1623
CN=C1OCC1(N)CO,0.2611
CC1=CNC(=O)CCC1,0.2117
CC1C2COC3(CC3)C12,0.304
CC12OC1C(=O)C2(C)O,0.2072
CC1CC2=CNC(=O)C12,0.2017
CC1C=C(CO)C2OC12,0.2427
CNC1=NOC(=N)C=C1,0.1544
OCC1CNCC(=O)O1,0.2387
CN=C(c1nnon1)N,0.1703
OCC1CC2C3CC1N23,0.303
C1CC2C1C1OCOC21,0.3139
CC1N(C)C2CC2C1=O,0.192
C1CC23OCC4C2OC134,0.2843
CC1CCOC=NC1C,0.2538
CC1=NC2C(O1)C2C#N,0.2574
O=C1C2NC3CC1NC23,0.2053
CCC1N=C(C)NC1=N,0.2299
CC12CC1(C)OC=NC2,0.268
NC1(C=CC2OC12)C#N,0.2387
c1c(ncc(n1)O)O,0.176
CCC1(CCO1)C=O,0.211
c1cc(oc(=O)c1O)N,0.1568
CN1C(=N)ON=C1C#N,0.1734
C1C2CC3COC3CC12,0.3193
Cc1c(cc(o1)OC)O,0.2218
CC12CCC1(O)C(O)C2,0.2922
CC(C)c1c(n[nH]n1)N,0.2227
CC(=O)N(C)C(=N)C=O,0.1963
CCC1CC2(C)CC1C2,0.3709
CN1CC1CC1(C)CC1,0.3029
CC1COC(C)C1(C)C,0.3088
CC(=NO)CCOC,0.255
COc1c(oc(=O)[nH]1)O,0.2419
CC1C(CO)C1NC=O,0.2534
CCCC(COC)C=O,0.2281
CC1CC(CO)N=CO1,0.2631
CC(C)(C(=O)OC)OC,0.2722
OCC1CCNCC1=O,0.2042
C(C=O)C(=NO)CC=O,0.2054
C1NC11CCOC1,0.3146
CC(=O)N1CC2(C1)CN2,0.2664
OC1(CC1)C1COC=N1,0.2671
CCC1(C)OC2COC12,0.3093
O=C1CC2NC1C2C#N,0.2092
CCN(C=N)C(=O)C=O,0.1696
ON=C1C2C3OC1OC23,0.2411
CC(=O)N1CC2CCC12,0.264
CC(C)(O)C1C2CC1C2,0.3204
COC1C(C)CC1C#C,0.2864
Cc1cc(cc(c1)C)C,0.2378
O=CC12C=CC3C1CC23,0.2047
COC1C2CCC1O2,0.3226
C1OC23C=CC4C2C1C34,0.2135
CC1=CC(=N)C(O)=NN1,0.1768
C(C#CC(=O)C(=O)N)O,0.1635
CC(=O)C1(C)CCOC1,0.228
C1C2CCC12,0.3506
CN=C1OCC(O)C=C1,0.2079
c1c[nH]c(c(c1=O)F)O,0.2021
CC(O)C1=NON=C1,0.2327
CC(O)C12CC3OC1C23,0.2999
CNc1ncnnn1,0.1671
CC1=NC(CO1)C1CN1,0.2645
CC1CCNCC(=O)O1,0.2414
C(=N)Nc1c(non1)N,0.1934
CCCC1OCC1C,0.3252
O=CC1CN1CC#C,0.2119
CNC(C=O)(C#N)C#N,0.2096
OC1CC2C3CC(C1)C23,0.3166
CN(C=O)c1ccc[nH]1,0.2368
c1cc([nH]c1N)NC=O,0.1755
COCC(C)(CO)C=O,0.2179
CCC12C3C4N1C4(C)C23,0.2818
CC12C3CN=C1OC23,0.1608
COC1(C)C2NC2C1=O,0.199
CCC(OC)C(=O)C#C,0.1886
C1CN(CC1=O)CC#N,0.2013
CCN=C1C(CO1)(C)C,0.2803
NC(=O)C1CC(O1)C=O,0.2015
CCc1c(nc[nH]1)NC,0.2083
CC1CC2(O)CC=CC12,0.2589
O=C1CC2C3NC(=C1)C23,0.1699
OC1C2CC3CC1C23,0.3199
COCCCC#N,0.303
O=C1CN=C2OCOC12,0.2073
CCOCC#CCOC,0.285
CC(C)OC(=O)CCO,0.2851
CN1C=CCNC1=O,0.2173
COC1CCC1CC#N,0.3015
COCC1(CCC1)CO,0.32
OC1C2CC2C1C=O,0.2117
c1c(nnnn1)N=CN,0.1613
C#Cc1ccnc(n1)N,0.1767
Cc1ccoc1N2CC2,0.2268
CCC(O)C(C)(O)CC,0.3123
CC1(CC1O)C1CO1,0.3332
CC1C2CC3C2OC13,0.3147
CC1=CCC=CC=CC1,0.1853
OCC1CN1C(=O)C=O,0.1704
OC1C2CC1(O)C1CN21,0.2816
CN1CC(C=O)C1=O,0.2167
OCC1NC1CCC#N,0.2963
CC(=NO)CCCO,0.2565
CC1C2OC1(C)CC2O,0.3134
O=CC1CN1CC1CO1,0.2123
OC1CCC2=C1NC=N2,0.2388
CC1OC(C#N)C(=O)O1,0.2718
OCC1OCOC11CC1,0.3261
CNC(C)C1(CO1)C#N,0.2439
CC12CCC(C)(CC1)C2,0.3518
OCC1(CC=CC1)C=O,0.2201
c1c(nco1)NCC#N,0.2191
c1c(c(=O)[nH]c(=O)[nH]1)N,0.1741
CC1(CO)CC(O)C1,0.3242
CC1C2C3CC3(C#C)C12,0.2755
N#CC1OC23CN(C2)C13,0.2363
COC1OC2CCC2=C1,0.2427
C1CC1C(C=O)C=O,0.1958
C1C2C3C4C3C2C14,0.34
C1C2C3C4CC2C1N34,0.3375
C#CC(CC1CC1)C#N,0.2949
Cc1c(cnnc1N)F,0.1936
CCCC1OCC1CC,0.3206
OC12CC3CCC1(O)C23,0.2794
CC(O)C(O)C#CC=O,0.201
NC1(C#N)C2C3CN3C12,0.2534
C[NH2+]C1CC1(O)C([O-])=O,0.1966
C#CC1OC1C1COC1,0.2646
CC1OC(=O)C2CCC12,0.2698
OC1CC2(O)C1OC2=O,0.2628
CC1CC1CCN1CC1,0.3201
OC1CC11CC2CC1C2,0.3321
CC#CC#CC=O,0.1772
O=CC1C2C1C1CC2C1,0.2262
CC1CCC11NC1C#N,0.2815
CC1=CCCC1OC=O,0.2561
CCNC(C)C(=O)OC,0.2315
[O-]C(=O)CCC1CC[NH2+]1,0.2746
c1(=O)[nH]nc(o1)O,0.2664
CCn1nc(nn1)OC,0.2295
COCCC(=NO)C#C,0.2081
CC1CN1CCC#C,0.2859
CN1C2C1C1NC2C1O,0.306
[NH3+]CC(CCO)C([O-])=O,0.2747
c1c(nc(nc1N)N)N,0.2223
CN=C1CC=CC(=O)N1,0.1947
C1=C(NC(=O)C1=O)C=O,0.1238
NC(=O)COC(=N)C=O,0.183
CC1CCCC(O)C1C,0.3307
OC1C=CC2=C1C=NO2,0.1778
c1c(ncc(n1)O)C=O,0.1816
Cc1cc(on1)N,0.2344
CC1OC11CC(=O)C1O,0.2063
CN1CC1C1(O)CC1O,0.2828
CN(CCO)CC=O,0.2094
CC(C)C1OCC2NC12,0.309
N=C1NC(=O)N=CC=C1,0.1617
COCC1CC(CO)O1,0.3126
c1c2c(co1)OCO2,0.2423
CCOC1CC(CC)C1,0.3283
CC1OC1C1(CN1)C#C,0.2802
OCCC1CC1C#C,0.2912
N=C1OCC11OC1C=O,0.2143
CC1(C)C2CC3OC3C12,0.3261
C#CC1(CN2CC12)C#C,0.2631
CC1C2OC=NC12C#N,0.256
CN=COC1CCC1O,0.2662
CC1C(CO)C1(O)CO,0.2977
CC(C)C12CC3CC1C23,0.3262
O=C1OCOCC11CO1,0.2505
CC(O)C#CC(F)(F)F,0.2856
c1c[nH]nc1C(F)(F)F,0.2626
CC1(C)C2CN1CCO2,0.2861
N#CCCC1C2COC12,0.285
CC1(CCC1=O)C=O,0.1971
CC(O)(C#N)C1COC1,0.2932
OC1CC2OCC12C=O,0.2163
CCCC[NH2+]CC([O-])=O,0.2691
OC1C2C3C2C2C3C12,0.3018
Cc1ccc(c(n1)F)O,0.2047
C1C2CC3COC(C3)C12,0.3182
CCC(CCO)C1CC1,0.3415
OC1CC=CCC2NC12,0.2628
CC1(CO)OC(=O)C1N,0.2467
NC(=O)C1CCCO1,0.2649
CN=C1OCC1OC=O,0.2599
COCC12CC3OC1C23,0.3027
CC1OC(C)C2C(O)C12,0.3095
Cc1c(c(n[nH]1)NC)N,0.2184
CC1C(N)C(C#N)N1C,0.2566
CC1=CCCC1CC=O,0.2131
CC1CC2OCC2(O)C1,0.3114
COC1C2CC1C(C)=C2,0.2392
OCC12CC1CC2=NO,0.246
C1OC1C1=NNN=C1,0.2487
CC1COC2C(O)C12C,0.3064
COCCN=C1CCO1,0.273
OCC1C2CC2C11CC1,0.3139
CC1(CCC1)OCCO,0.3314
COC1(C)COC1CO,0.3044
N=C1CC2CC=CC2O1,0.2555
CC1OCCOCC1O,0.3153
CC1OC2C1OC21CC1,0.2955
CCC(O)C(C)(C)OC,0.3171
CC12CC3CC(N13)C2=O,0.2155
OCC12CCC3C(O1)C23,0.3003
CCC1C2COC12C=O,0.2169
Cn1ncc(n1)CC=O,0.2166
CC12CC1N1CC2(O)C1,0.2791
N=C1NCCOC(=O)N1,0.2433
CCn1nc(nn1)C#C,0.2261
OC1COC2OCCC12,0.3086
O1CC11C2CC2C11OC1,0.3197
CCOC1CCC=C1,0.2635
CC(O)C(C)(C)O,0.3261
CC1=CCOCC1C=O,0.2069
CC#CCC1CO1,0.3007
CN1C2CC(C2)NC1=O,0.2799
CC(O)C1CC1(C)C#C,0.2925
CC12CC1(CC=O)CC2,0.2169
CC#CC1(C)OCC=C1,0.2503
CC#CC1(CO)OC1C,0.2749
CC1NC(=N)C(=O)C=C1,0.1557
CC(C)C(O)C1CCC1,0.3243
CC1C2N3CC2(C#C)C13,0.2734
CC1C(O)C(O)C1C=O,0.2267
c1ncnc(n1)OC=O,0.216
C#CC1=CCCCC=C1,0.175
CC(O)C1(CCO1)C#N,0.2786
CC(O)C1C(N)C1C#N,0.2535
CN=COC(=O)NC=N,0.2381
N#CC12C3CC1N=CN23,0.2323
CNC1(C)C(C)OC1=O,0.2461
O=CCC1COC1C#C,0.2255
O=CC12CC(C1)C1CC21,0.2216
C#CC1CC2C=CCN12,0.2361
c1c([nH]c(n1)O)CC#N,0.2363
CC1=NC2CNC2CO1,0.2424
C#Cc1c([nH]cn1)N,0.2128
CC1OC1C1CCC=C1,0.2634
CCC1CC1(C)CC=O,0.2226
CC1C2C3CC3(CO)N12,0.299
OCC1COCC2OC12,0.317
NC1CC(O)COC1=O,0.2472
CC1(COC1)NC(=O)N,0.2948
CN1CC(C=O)C1C#C,0.2109
CC(O)C1=CC=C(C)O1,0.228
O=CC1OC2C1OC2=O,0.2125
CCC1(CC1)NCC#N,0.2626
OC1CCOC1C#N,0.2847
OC(CCOC=N)C=O,0.2167
N=COC1COC(=O)C1,0.2734
c1c(nn(n1)C=O)CO,0.2119
NC12CC1CNC2C#N,0.2639
C1CC=C(C1)C#CC=O,0.1694
CC1NCC2=C1N=NO2,0.1937
COC1C2CC3CC3C12,0.3104
c1cc(cnc1)CC#N,0.2281
c1coc2n1cc(n2)O,0.2059
C1C2OC3=C(OC=C3)C12,0.2102
CC1=NCC(=O)N1C,0.2317
COC1CN2N=CC=C12,0.2645
CC12CC3OC(=N)C1C23,0.2744
c1c(nc(=O)[nH]n1)N,0.1872
CCCc1c(cno1)C,0.2382
CC12OC3(CC1C23)C#C,0.2523
CC1C(CCO)C1(C)O,0.3152
CC12CC3C(CO)C1N23,0.3068
C(CC(=O)CC=O)C=O,0.2103
CC1(O)CC2OCC1O2,0.3216
CC1CC2(CCC2)CO1,0.3183
NC12CN3C(C13)C2C#N,0.2569
COC1CC2=CCCC12,0.2453
CC(=O)CC(C)(C)C,0.2297
O=C1COCOC1C#N,0.2008
CC1=CCN=COC1=O,0.2102
CC12CC3(CO3)CC1N2,0.3224
C1CC1Cc2nnon2,0.2319
CCC(=O)N1CC1(C)C,0.2557
CCC1CCC11COC1,0.3098
CC12CN1CC1OCC21,0.3045
CC(C#N)C(O)C(C)=O,0.2371
OC1C2OC3CC2OC13,0.3084
C1OC23CC4CC2N4C13,0.2787
CC(O)C1CCCC1,0.3327
CC1CC2C1C(=O)N2C,0.2664
CC1OC1(CC#N)C#C,0.2828
CC(=N)OCCC(N)=O,0.2784
N=C1NC2=C(O1)C=CO2,0.199
c1c(nno1)CNC=O,0.2255
OCC1N2CC2C11CC1,0.2978
N#CC12OCC1CC=C2,0.2435
O=CCC1C2C3OC2C13,0.2154
CC1C2CC1(C)C2C,0.3762
N=C1OCC2C3CC12O3,0.2614
NC(=O)C(O)C#CC#N,0.2233
OC1CC1C1CCOC1,0.3093
Cc1c(c(c[nH]1)N)N,0.2294
Cc1cn[nH]c1C=O,0.1943
O=C1CC2(CO2)C1C#C,0.2079
CC(O)C12OCC1C2O,0.2896
CC1NC11CCCC=C1,0.2387
CNC1=NCCN1C=O,0.2052
CC1(CCC1)O,0.3269
CC1C2OCC(C)=CC12,0.241
OCCC12CC1(O)CO2,0.2991
CCc1c(cn[nH]1)C#C,0.2246
CCC(CC)CC(C)C,0.3767
CC1(C)OC1CCCO,0.3342
CC1(O)CC(O)CC1=O,0.2132
OC1CCC1CCC#N,0.3068
OCC1CC2CN2C1=O,0.2351
c1c(coc(=O)c1O)N,0.1584
CN(C)CC(=NO)C#C,0.1801
CC1=CCC(O)C1C=O,0.2174
CC12CN1C(=O)CC2O,0.2411
CC12CC1(C#N)C1OC21,0.2872
C1c2c(nn[nH]2)OCO1,0.2224
CCC(C)C=O,0.227
CC1=C(OC=N)OC=N1,0.233
CN=C1CCC(=O)N1C,0.2375
N=COCCCOC=N,0.2819
O=COC12CC1C(=O)C2,0.2313
c1c(c(cn1C=O)O)O,0.1884
CCC1C2OC1C(C)=C2,0.2353
C(=N)NC(=O)NC(=N)N,0.2112
OC1(CC1)C(C#C)C#N,0.2796
COC12C(N)C1NC2=N,0.2299
CC1=C2CC3C(C1)C23C,0.1731
CC#CC#CC1(CC1)O,0.2082
CC1C2CC1(C)CC2C,0.3602
CC1C2OC1C(=O)C=C2,0.1715
CC1(O)CC(CC#N)C1,0.3039
CN1C(=N)C2CN2C1=O,0.2425
CC1(CC2CCC12)C#N,0.3213
CC1N=COCC11CN1,0.273
O=C1CN2CC3C(C2)C13,0.2005
OC1CC2(CC2)CC=C1,0.2584
O=C1C2C3CN(C23)C1=O,0.1553
CC1=CC(=O)C(O)C1=O,0.1608
COC(C)(CO)C1CN1,0.3047
NC1=CC(=N)OC(=O)C1,0.197
C1C=CC=CC(=C1)C=O,0.176
COC1CC1(CO)C#N,0.2839
CC([NH3+])C#CC([O-])=O,0.2217
CCOC1C2CN2C1C,0.3049
Cn1cnc(n1)C#C,0.2254
CC1NC(=O)C=CC1C,0.2058
OC1CC2OC2(C1)C#C,0.2763
CC12OC1C1OC21C#C,0.2463
COC1OCC2C(O)C12,0.3202
CCCC(C)(C#C)C#C,0.2937
Cc1cc(nc(=O)[nH]1)C,0.1847
Cn1ccc(c1)CC#C,0.2453
CCC1(C)C=CC2NC12,0.2451
CC(C)C(=NO)C(=O)N,0.2106
OC12C3CC1(O)C=CC23,0.2408
CC1=C(CC(=O)N1)C#N,0.191
Cc1cn(c(n1)C#N)C,0.2027
CC12CC=CC1NC2=O,0.2454
CC1(C)CC(O)CO1,0.3084
CC12CC(O1)C21CCO1,0.3141
CC1(C)C2C1C1(C)CN21,0.2831
CC#CCCCNC=O,0.2736
O=C1C(CC#C)C2CN12,0.2303
CC(CC=O)OCCO,0.2237
CCC(C=O)C(C)OC,0.2293
CCC1(O)CCC1C,0.3228
COC1C2CC1(C)OC2,0.3211
CC1=C(NN=N1)C1CO1,0.2368
CC(O)CCOC(C)C,0.3157
CC(C#C)N1CC1C#C,0.2646
CC(=O)c1c(non1)O,0.1908
C#CC1C(C#N)C2CN12,0.2621
Cn1cc(nc1)C(=O)N,0.2317
c1c(c(c[nH]c1=O)O)O,0.1739
Cn1c(=O)c(ccn1)F,0.1786
CC12C3OC4C1C4(O)C23,0.2952
CC12CC3CCC1C23C,0.3196
OC12CCC3C(C1)OC23,0.3068
OC1CC=CNC(=O)C1,0.2164
CC1=CC2OCC(C1)O2,0.2461
CC1(OCCC1=O)C#C,0.2105
OC1C(O)C1(O)C1CC1,0.2882
OC1CCC2CC1C=C2,0.2534
OC12COC3CC1C2O3,0.2914
C1OC11CC2CCC2=C1,0.2373
CCC1OC11CN(C)C1,0.297
CC12CCC(=O)CC1O2,0.2244
c1cn(cn1)CC(=O)N,0.2511
C1OC1C1C2C3CC3N12,0.2754
CC1(C)C2CCC12CO,0.3149
CC1CC1C1(CO)CN1,0.3121
N=C1CC(O1)C1CO1,0.2914
CC#CC1C2CC1OC2,0.2789
CC(O)CCCC1CC1,0.3334
C1C=C(C(=O)N1)NC=O,0.2056
CC1CNC(=O)N2CC12,0.2846
CCOCCC(C)O,0.3186
C1CNc2c1oc(n2)O,0.2129
O=CC12CC=CCC1O2,0.2138
NC1(C#N)C2CC1O2,0.2779
COC1CC2CC1CO2,0.3162
CC12C3NC1C3OC2=O,0.2537
O=C(C#C)N1CC1C#N,0.2197
CC12COCC1CC2=O,0.2143
CC1(C)CC1(C=O)C#C,0.2168
CC(CC1CO1)C1CO1,0.3445
C(c1nnn(n1)C=O)O,0.2001
c1c(nc([nH]1)O)C(=O)N,0.2174
COC1COC(C)C1C,0.3112
CCCN(CC)C=O,0.2707
CN1C2CC2(C)C1=O,0.2468
CN=C1ON=CC(F)=N1,0.1589
CCC1=CCOC1C#N,0.2529
CC1C2C3(C)CC2(O)C13,0.3327
CC12NC3C1NC23C,0.2966
OC(C#C)C(O)C1CN1,0.2908
CC1(C)CCC1(C)C=O,0.2219
CC1OCC(CC#C)=C1,0.2431
CCOC1C2OC(=N)C12,0.2704
CC12CC1C(CC2)C=O,0.2248
OC1CC(=O)NC=C1,0.2099
CC12CC3(C1)OCCC23,0.326
c1c(nnn1CC=O)O,0.188
CCc1c(onn1)CC,0.2249
CN1C=C(F)N=CC1=N,0.1399
CC(=O)C1=CC2NC2C1,0.1897
CC1C2CC(O2)C=C1C,0.2378
OC1CC(C1)C(=O)C#C,0.2042
FC1=NOC=NC1=N,0.2064
COC1CC2CC1(C)O2,0.3274
O=C1NCC2CC1O2,0.2489
CC12CCC1=CC1NC21,0.2362
COC(=N)C(O)CCO,0.294
O=CN1C2CC1C21CC1,0.249
OC1CC2OC12C1CO1,0.3118
O=COC1C2CC1OC2,0.2514
Cc1c(ccnc1O)F,0.222
c1cc([nH]c1N)N2CC2,0.2251
CC(O)CC#C,0.3167
C1C2CC3NC3C3C2N13,0.2818
COc1c(=O)oncn1,0.1853
CN=C(OC=O)C1CO1,0.2304
CC1C2C(C)=CCC12O,0.2446
COC1CC2CCC=C12,0.2429
O=C1NC2COC1C2,0.2498
CC(C)CCC(C)C#C,0.3154
O=CNC12CC3C1OC23,0.2594
c1nnn(n1)C(=O)C#N,0.1946
COC1CC2NC12C,0.2989
CNCc1ncccn1,0.1755
O=C1C(CC1C#C)C#C,0.2057
CC1(CC=CC=CC1)C,0.1896
Cn1cc(c(c1)O)C=O,0.1688
C#CC1(CCC1)CC=O,0.2202
CN1CC(C)(N=C1)C#N,0.2368
CCCC(C)(OC)C#C,0.2973
CCCC1(CC1C)C#C,0.2928
C1C2N1CCCC21CC1,0.2957
C1C2C1C1C3C4C3N1C24,0.3078
OC1C2NCC12OC=O,0.2441
CC1(CC1)N2CC2,0.3114
CC1CCC(=NO)C1O,0.2487
O=COC1CN2CC12,0.2597
C1C(=O)C(=O)CN1,0.126
C(CC=O)CNCC#N,0.227
CC1C2C=CCOC12C,0.2437
CC(C#C)C1(O)CC1C,0.301
CCC1(O)CC2C1N2C,0.2874
CN1C=NOC(=N)C1=N,0.1948
O=C1C2CC3CN2C13,0.2229
NC12C3CC1OC23C#N,0.2474
CC1CC1(C)NCC#N,0.2704
Cn1c2nncn2cn1,0.2046
CCC1OC(=N)CC1=O,0.2169
CC12CCC1COC=N2,0.2677
CC1(O)CC1(C)OC=N,0.2741
c1(c(n[nH]n1)O)C(=N)N,0.2006
CNc1nc([nH]n1)O,0.246
CCC1C2CC3N1C23C,0.3285
CC12CC3C1C(CO)C23,0.3366
NC1=C(O)OC=CC1=N,0.1651
C#CCC1(CC1)OC=O,0.2711
O=CC1CC2CCCC12,0.224
C#CCNc1ncno1,0.2408
C1C=CC2OCOCC12,0.2536
C#CCN1CCOCC1,0.2626
CC1(C)OCC1(O)CO,0.2933
CC(=N)N(C=N)C(=O)C,0.2355
O=CCC1(CCO1)C#N,0.2208
N=C1NC(CCO1)C#C,0.2532
CCC1CN(C1)C=O,0.2664
CCC1(CNC1=O)CC,0.28
CC1C2C3OC3C(C)N12,0.2834
COC(CO)C(O)C=O,0.2162
C1OC1C1CC2CC2O1,0.3177
OCCC12CC(O1)C=C2,0.2352
Cn1cc(nc1)CO,0.2491
Cc1c(c([nH]n1)OC)O,0.2361
c1c2c(no1)COCC2,0.2408
CC1CC2(CN2)C1=O,0.2058
CC12C3C=CC1C(O)C23,0.2321
CC1C2NC2(C=O)C1=O,0.1969
CC(O)C(CC#N)C=O,0.2176
CN(C=O)c1[nH]ccn1,0.2092
Cc1cc([nH]n1)C(C)C,0.26
C#CCC(=O)N1CCC1,0.2595
C(CO)C(=O)C#CC#N,0.1788
CCCC(CC#N)C=O,0.2247
CC(C)(O)C(O)CCO,0.3131
C#CC1CCC2OC2C1,0.3115
COc1coc(n1)C#C,0.1764
N=C1C=CNC=CC1=O,0.1714
CC12CC1(O)CC21CO1,0.3221
ON=C1CC2C3CC1N23,0.241
c1nc(on1)C(=O)C=O,0.1416
C1CC(C1)COCC=O,0.229
CCC1(CCC1)CO,0.3341
CC1C=CC2(NC12)C#N,0.2388
OC1=CC(=N)NN=C1O,0.1587
C1C2NC2C11CCC=C1,0.2492
CC1(O)COC1=N,0.2864
O=CC1(CN1)C1CCO1,0.2136
C#CC12C3C1C1CC3C21,0.2609
N#CC1(CC2CN2)CO1,0.2512
COC1CC2CCC12O,0.3233
CCC12CC1(C)CC=C2,0.246
O=C1C2CC3OC3C1N2,0.2364
c1cc([nH]c1CO)C#N,0.2025
CN1N=C(O)N(C)C1=N,0.2356
O=C1CCC2C3CC1C23,0.2166
Cc1cnn2c1OCC2,0.2416
C1CCOC(=O)COC1,0.2494
CC1OC2(C)CCC1C2,0.3127
CC1CC(=CN1)C(N)=O,0.1935
O=CNC12C3CC1CC23,0.2613
CC1C2OC1(C=C2)C#C,0.2359
NC1CC1(C#C)C#N,0.2485
COC12CC(C=C1)C2C,0.2382
CC1CCC2(OC12)C#N,0.2898
CC(=O)Oc1c[nH]nn1,0.2388
Cc1cc(c[nH]1)COC,0.2425
c1coc(=NCC=O)[nH]1,0.1926
OC1CCCOCC1O,0.3103
CN1CC1C1CNC1=O,0.2603
CCCC1OC1CC#N,0.3108
CC1=C(CC2NC12)C#N,0.2079
C(Cc1nnon1)CO,0.2095
CCC1CC(CO)C1C,0.336
C1CN1C(=O)C#CC#N,0.1884
CC1CC(N1)(C#N)C#N,0.2477
[NH3+]CC1=C([N-]N=N1)C#C,0.2257
OC12CC1(OC2)C#N,0.2424
C1CC12CC(=NO)C2,0.2467
C#CC12CC(C1)C2,0.3036
c1cn(c(=O)[nH]1)CC#N,0.2251
CC(O)C1C2CC2C1=O,0.2274
CC1CC2C3COC2C13,0.3151
ON=C1COCC1C#N,0.2441
C1C2C3COCC1C23,0.3227
CCC(CO)CCC=O,0.229
C#Cc1ccnoc1=O,0.1587
CC1COCC1C(N)=O,0.2647
CCC1CC(C#C)C1=O,0.2121
NC1=C(O)C(=N)ON=C1,0.1575
N=CN1CCOC1=N,0.2395
CCCN(CCO)C=O,0.258
CC1NC1(C)CC#C,0.2868
CC(C)(C)C1COC1=N,0.2883
OCC12OC1CC2C#N,0.3039
CC#CC(C)(C)C#CC,0.2825
C1C(CO1)(C#CC=O)O,0.191
C1CC(C1)CCOC=O,0.2864
CNc1ncnc(=O)o1,0.2047
N#CC1CC11CCO1,0.2768
COCC1=CCC(C)C1,0.2593
CC1C2OC1(C)C1CC21,0.333
CCC12CCC1N=CO2,0.2634
COC1(C)CCCC1C,0.3158
CC1(C)CC(O1)C1CC1,0.3212
CCC(CN(C)C)C#N,0.2585
CC1C2CC1(C)C1CN21,0.3074
CC(=N)OCC#CCO,0.2801
CC(C#N)C(O)CO,0.3125
O=C1CCCC2OCC12,0.2172
CC12CCC1C2C(N)=O,0.2607
C#CCC12CC3CN1C23,0.2917
CNc1cn(cn1)C,0.2172
COC(C)CC1CCO1,0.3234
CCc1cc(on1)NC,0.226
CC1CC1(C)C#CC=O,0.2029
OC12CC1(NC2=N)C=O,0.2027
CC1NC11CCC=C1,0.237
Cc1c(c(ccn1)F)F,0.2339
CCCC(CC)CC=O,0.2278
CC1CN1CC1CN1,0.3177
CCCCOC(=O)N,0.3235
CCC1(C#N)C(C)C1O,0.3038
COC1(C)C2CN2C1C,0.3073
COc1cc(n[nH]1)CO,0.2482
CC#CC(C)(CO)CO,0.2902
CN1CC2(C1)OC1CC21,0.2957
N#CC1CC1OC1CC1,0.2887
NC(=O)C12CC1(O)CO2,0.2499
OCC(O)C=O,0.2186
COC1OC=NC1C=O,0.2294
CN1C2C=CCC(O)C12,0.2208
NC1(CC1C#N)C1CO1,0.2873
CC(O)C1COC(=N)C1,0.2862
COCC1COC1(C)C,0.3178
c1c(c(c(nn1)O)N)O,0.1997
N#CC1C2OC2C11CO1,0.2897
N=C1OC(C#C)C2CC12,0.2752
C1CC1C1C2OCOC12,0.3095
CC(CCC1CO1)C=O,0.2265
CC1(CC1O)N1CC1,0.2952
CC1(O)C2C=CC(O)C12,0.2264
CC1=C(C)C(=O)C(=N)N1,0.1518
OCCC1C=CC2CN12,0.2312
CN(C)CC1(CN1)C#N,0.2534
CC(=O)C(C)(C)O,0.2301
CCC1CC1(CC)CC,0.3359
CCC(=O)CC1CC1O,0.2344
N#CC12CC1N1CC1C2,0.2704
NC(=O)C1C2CC1C2=O,0.2499
CC(=O)C#CC(C)(C)O,0.209
CNc1c(nco1)C#N,0.2089
OC1C2CC1OC(=N)O2,0.2874
CC(=N)OC(C#C)C#C,0.2692
CC1C2CCC2CC1O,0.312
COC1C2C=CCC12C,0.2408
OC1CCOC(C1)C=O,0.2275
CC(C)CC(=O)C(C)C,0.2298
N#CC12CC1NCC=C2,0.2216
CCC(C)CCCC#C,0.3158
c1c(con1)OCC=O,0.2014
CCCN1C(C)C1CO,0.2788
COC12COC1CC=C2,0.2565
ON=C1CCC2OC12,0.244
C(=O)n1c(nc(n1)O)O,0.2037
C1CCC(=CC1)CCO,0.2582
CCC1(CO)OC2CC12,0.3085
CC1(C)CC2CC3C1N23,0.3117
NC1=NC(=N)NN=N1,0.1637
CC1(O)C2C1C(O)C2O,0.3048
OC12CC3(C1)CCOC23,0.3254
C(=O)Nc1c(nn[nH]1)N,0.209
CC1(CC12CCCC2)C,0.3325
CC1(C)NC=NC1C#N,0.2493
CCC(O)(C=O)C1CN1,0.2162
CC12CN3C1CC=CC23,0.2265
CC1OC2CC2OC1=O,0.2529
[O-]C(=O)C12CC([NH2+]1)C=C2,0.1556
CC1CC2CC3CC1C23,0.3373
COC1OCCC1C#N,0.3089
CC12OC3C1CC23C#C,0.266
Cc1c(c([nH]c1O)C)O,0.2136
CCC12CC3C1OC23C,0.3092
CC1C2C3OC(=N)C2C13,0.2759
CCC12CN1C(=O)C2O,0.2213
C1CN(C1)C(=O)C=O,0.1732
CC1(O)COC1C1CO1,0.3138
C(C=O)C(CC=O)C=O,0.2098
CC1CC(=O)C=C1C,0.1933
CNC1=CC=CC(=N)O1,0.1606
CC1N2C(=O)CC12C,0.2345
CCC1(CC1)C#CC=O,0.2043
CC1C2C3C4C1C2C34C,0.3237
CC1C(CO)C2NC12C,0.2865
CCOC=NCCO,0.2581
CC1C2CC3C2C13O,0.3137
CC1OCOCC1(C)C,0.3301
CC1OC2OC1C1NC21,0.3143
c1(nc(nc(n1)O)O)O,0.2658
CCC(=NO)CC#C,0.2541
CCC1CC2OC12C,0.331
CNc1c[nH]nn1,0.2093
NC1C(N)C1(N)C#N,0.2474
CC12CC(C1)C(=O)C2=O,0.1537
OC12C3NC1C(=O)NC23,0.2342
CC1=C(OC=N)N=NO1,0.2029
COC1C2CCC1C=C2,0.259
C1CC23COC2CC=C13,0.2434
O=CC1(COCO1)C#N,0.2057
CC1CN=COC(=O)N1,0.2512
OC1C2OC2C11CCC1,0.3245
CC(C)(C)C1CC1O,0.3272
C1CC(=O)C2(C1=O)CN2,0.1866
OCC1C(OC1=N)C=O,0.2228
CCC1(O)CCCC=C1,0.2622
CC12CC(O)C1OC=N2,0.264
CC1CCC2OC(=N)C12,0.2875
OCC1NC2C(O)C12O,0.2852
CC1C(CC1C#C)C=O,0.2197
CCN1CC11CCC1O,0.3195
COC1C2CCC2C1=O,0.1951
O=C1CN2CC12C#N,0.2243
CC1CC1C1OC1C#N,0.2791
OC1CC(=N)NC1=O,0.2464
ON=C1CCC1(O)C#N,0.2376
CCC(O)C1(C)CN1,0.2929
CC(C)C(=O)NC(=N)C,0.2429
CC1=CC2C3C=CC1N23,0.2102
OC1C(=N)OCCC1=O,0.2168
CCCC1CC(C)C1O,0.3126
CC1C2OC3C2OC13C,0.3072
C(C=O)Nc1nnon1,0.1876
CC1OCC1(C)C1CO1,0.3302
CC1C2C(O)C2(C)C1O,0.3054
CC(=O)C1CC2CC2O1,0.2137
c1cn[nH]c1OC2CC2,0.2581
C(c1nnc(o1)CO)O,0.2524
CC1CN1C1=CNN=N1,0.2156
CC(=N)OC1(CC1)C=O,0.2302
CC1OC1(CO)CC#C,0.3029
OCC1CN(C=N)C1=O,0.2274
Cn1ccc(n1)N(C)C,0.2151
CNc1cnccn1,0.1793
CC12CC(C1)N2CC=O,0.2076
CC1(CC(=O)C1)OC=N,0.2216
CC1CC23CN1C2CO3,0.2589
CN1C2C3C1=NCC23O,0.1738
CC12C3CN1C(=N)C23O,0.2525
CC1C2CC(=O)C2N1C,0.1762
CCN1C(C#N)C1(C)C,0.2596
c1c[nH]c(c1CO)C#N,0.2067
CC1OCOC2CC12,0.3333
C#CCC1=CCC2NC12,0.2449
CC1(C(=O)CC12CC2)C,0.2162
CC1(CC(=O)C=C1)C#N,0.1904
CC1C(C#C)N1CC=O,0.215
CC1C=CCOC2CC12,0.2579
CC1N=CN(C)C1=O,0.2293
c1cncnc1CC=O,0.2001
CC12CC3(C)CC1(C)N23,0.3249
c1c(ocn1)C#CCO,0.1972
OC1COC1=O,0.2616
CNC(C)(CN)C#N,0.2725
CCC(C#C)C(F)(F)F,0.3151
OC1(CC1)C1CN1C=O,0.2588
CNC(=O)OCCO,0.3145
CN1CC11COC1=N,0.2603
COC1C2NC2C1(C)C,0.3053
C1CC2C3OC1C2C=C3,0.2445
CCC1C(C)N1C(C)=O,0.2549
OCC1C2NC1C21CN1,0.3022
CC#CC1CC(=O)CN1,0.2173
C1C(=NO)C(=NO)CN1,0.1839
OCC1CC=CC1,0.2653
CN1CC11CCC11CO1,0.2899
CC(C)C(C#C)C1CO1,0.3043
CCc1c(nc[nH]1)C#N,0.2279
CCC(O)CCCO,0.3311
COC1CC(=O)C1(C)O,0.2097
CC1CC1(O)CC1CC1,0.3241
N#CC12CC=CC1O2,0.2466
CC#CCC(=O)CC=O,0.2088
CC1C=CC(O)C1C=O,0.228
CC1CN(C=N)C(=N)O1,0.2393
CC1(O)CC(C=C1)C#C,0.2582
COCC12NC1CC=C2,0.2428
CC(O)(CCO)CC#C,0.2988
O=C1CNCCC2NC12,0.2004
CC1C2C1(C)CC2(C)C,0.3276
OC12CN3C4CC4C1C23,0.2928
C1CC23CCC(O2)C13,0.3294
CC(C)C(=O)C=O,0.1544
CC(CCO)NCC#N,0.2687
CCC#CC1CNC1=O,0.2635
CC12COC(=O)C1C2O,0.2576
CC(C)(C)OCC1CN1,0.3085
CN1CC(C1)C(=O)C#N,0.1452
O=C1OC2(COC12)C#C,0.2435
CC1C2(C)OC(=O)C12O,0.2582
CC1C2OCC1N=CO2,0.2685
N=C1CCC(=O)CCO1,0.2273
O=C1CN2CC1C2,0.2069
C[NH2+]CC(=N[O-])C(N)=O,0.1427
C#CC(=NO)C1CC1,0.1996
O=C1CC(C#C)C1C#C,0.2122
O=C1C2C=CC11CCC21,0.2361
OC12C3C1C1C3C21C#N,0.2509
CC12CC(CO)(C1)O2,0.3189
CC1=CC2CC3C2C13O,0.236
CC(C=O)C(F)(F)F,0.2272
COC(=O)C(C)C(N)=O,0.2483
COC12CC1C(=O)C=C2,0.1844
CC1(NC(=N)C1N)C#N,0.2651
CC1CC2(C)C3NC3C12,0.296
CN1C2CCC3(CO3)C12,0.2976
C1C2C3OCC=CC3N12,0.2413
c1c[nH]nc1OCCO,0.2477
CC(=O)Nc1cnc[nH]1,0.2059
CC1CC(C)(C)OCO1,0.3363
CC12OCC3C1CC23O,0.3053
CC1(O)C2C3CC1CN23,0.3043
C#CC1C2C3CCC1C23,0.2956
OC1C2CC3OC3CC12,0.2918
C1C2N=C3OCCN3C12,0.2593
OC1CCN2N=NC=C12,0.2525
CCn1c(ccn1)C#N,0.2224
C1NC1C1=CN=NN1,0.2435
O=CC1CC2=CCOC12,0.2087
CCC1(O)C2C3C1CN23,0.297
CCC12CN1CC1OC21,0.2918
CCCOC1CC2CC12,0.3286
c1c(c(c(cn1)F)O)N,0.2077
CNc1[nH]c(cn1)C#N,0.1945
CCC1=CC2CC2OC1,0.2341
CC1C2C(C#N)C1C2=O,0.2494
OC12C3CC1(C3)CC2=O,0.2067
CC1C2OC11CC(=O)C21,0.1859
FC1=NOC(=N)C(=N)N1,0.1988
FC1=CON=NC1=O,0.1655
CC(C)OC1CCOC1,0.3215
C1COC(=O)CN1C=O,0.2544
C1OC1C1=CN=CO1,0.231
CC1OCC(O)C1=O,0.2179
NC(=O)N1CC2CC2C1,0.2887
OCC1(O)C2OC1C2O,0.2892
CC(O)C1(C)CCOC1,0.3263
Cc1ccc(oc1=O)F,0.1778
N#CC1COCCN1,0.2565
N#CC1CC2OCC2=C1,0.2406
C1C=CC=C(C=C1)CO,0.1856
C1C2CC3C4CC3(C4)C12,0.336
CN1CC1(CO)C#N,0.2724
CCN=C(C)N(C)C=O,0.2281
O=CC12CC3=NCC1N23,0.1883
COc1cc(c[nH]1)C#N,0.208
CC1OCC11COC1=O,0.2594
c1nc(nc(n1)O)CO,0.2158
CC12C3C=CC1(O)CN23,0.2223
CC1(CC1)c2cnc[nH]2,0.2479
N=COC1CCC2CC12,0.2812
CCOC1CCC1C#C,0.2948
CC1CC=CCOCO1,0.2496
COCCC(C)C#C,0.3102
CCCC(C)(C)C#CC,0.3065
O=C1CC2CN3CC2C13,0.2059
c1nc2n(n1)C(=NC2)N,0.2255
Cc1c(nc([nH]1)C)C#C,0.2139
O=C1C2CC1C1OC1C2,0.2277
Cc1noc(=O)n1C=O,0.2185
CC1OCC=C1C1CN1,0.24
CNc1c[nH]nc1OC,0.2182
CCC1(CC1)OCC=O,0.2276
CC12C(O)C1CCC2O,0.3046
OC1=COC(=N)C(O)=N1,0.148
C1CC1C(=O)C#CC=O,0.1956
CCC1OC1C,0.3538
CC1C2CC2(C)C11CC1,0.3249
C#Cc1cnccc1F,0.2024
CN(C)c1ccc([nH]1)O,0.2285
C1OC2OC=NC3C1C23,0.2622
CN1C2CC(=O)CC12,0.2123
CC(C)N1CC=CC1=O,0.2101
CC1NC1C1=NON=N1,0.2023
[NH3+]C(C(O)CO)C([O-])=O,0.2621
CC1C(O)C2C1C1CN21,0.2755
CC1C=CC(=O)C11CC1,0.1946
CC12CC(O1)C(O)C2O,0.3197
CC1OC2C(OC12)C#C,0.2667
CCCCNC(=O)NC,0.3026
CCC(O)(CCO)C#C,0.298
CC(C)C1=NCC(=N)N1,0.2289
CC1OCOCC1C=O,0.2188
O=C1C2C3OCC1C23,0.2385
Cn1cc2c(c1)onn2,0.1745
C(C(F)(F)F)OC=O,0.2855
CC1(C2CC1C2)N1CC1,0.3107
COC12CC1NC2=NC,0.2439
COC(=NCC#C)N,0.2778
N#CC12CCC3CN1C23,0.2716
CC1OCOC2CC12C,0.3302
O=CC1=CCN2CC12,0.1708
CC1C2COC12CC#N,0.2767
COC1CC1(O)CC#N,0.2787
COC1CC(C1)C1CC1,0.3237
COC12CC1(O)CCC2,0.315
CC1CNC(=O)C=C1N,0.2088
CC1CC2NC2C(=N)O1,0.2641
OC1C2C3CC2C13C#N,0.299
OC1CC1N(C=O)C=O,0.2155
C1C2NC11CN=COC21,0.2642
C#CC#CC1CN=CO1,0.2168
OCC12NC1C1C(O)C21,0.2623
CC#CC(CC=O)C=O,0.2075
[NH2+]=CN[C-](C#N)C#N,0.1353
OCC1(CO)C2COC12,0.3015
Cc1[nH]c(nn1)C,0.2641
CCC1(CC)CC1C#C,0.2886
CCNC(=O)OCC#C,0.2823
CNc1c(nc([nH]1)O)N,0.225
c1c(c[nH]c1C=O)C=O,0.1871
O=CN1CC2C3OC2C13,0.2694
O=CC1CCOC=N1,0.2194
OC1CC(CC=O)C1,0.2247
Cn1c(nn(c1=O)C)O,0.2496
OC1C(O)C11CCC1O,0.2746
CC(O)C(CO)C(N)=O,0.2684
N1C2C3C4C1C2N=CN34,0.221
CC1OC2C1OCC2O,0.3114
CN1CC2(O)CCN=C12,0.2315
OC1CC23CCC12CO3,0.2797
CC(O)C1C2OC2C1=O,0.211
OCC1(CN2CC12)C=O,0.2067
CC(C)CC(C)(O)C=O,0.2259
CCNC(=O)C1CN1,0.2702
O=C1OC2CN3C2C13,0.2536
C1COC2C3OC(C1)C23,0.307
CC(O)C1=CC(C)OC1,0.2423
NC(C#C)C1=CON=N1,0.2127
CC1(CC1)NC(=N)C=O,0.1695
CC1C2OC2CC11CO1,0.3452
CC12COC1C2C1CC1,0.3045
CN1C2C3C4C1C2C34O,0.2938
OC12CC3CC1OC23,0.3095
COCc1cc[nH]n1,0.2656
CC(C(O)C[NH3+])C([O-])=O,0.2787
C#CCOc1ccn[nH]1,0.2279
Cc1c([nH]c(=O)[nH]1)C#C,0.1844
N#CCNC1CC2OC12,0.266
OC1C2COC1C21CC1,0.317
CC(=O)C1CC(O1)C=O,0.2046
O=CC12CC3C4C(C14)C23,0.2149
CCCCN1CC1,0.3205
CCC1=CCC(C1)(C)C,0.2585
c1ccnc(c1)C=O,0.1829
CCCC(=O)C(=O)CO,0.1574
O=CC1NCC2OC12,0.2073
CN(CCCC=O)C=O,0.2167
CC(C=O)C1=CC=CN1,0.1623
CC1OCC1C(O)C#N,0.2623
OC1(CC#C)C2CC1C2,0.2993
N=C(CCC#N)OC=O,0.2611
CC1C(O)C1C#CC=O,0.1975
NC1(CC#N)CN2CC12,0.2615
C1C2OC11C=CCCC21,0.2317
CN1C(=N)C2OC2C1=O,0.2258
CCc1c(c(on1)N)C,0.2266
CC1=CC2NC2CC=C1,0.2009
OCC12CC1C(O2)C#N,0.2646
OC12CCOC11CC2C1,0.2987
CCC1OCC(=O)C1O,0.2203
O=C1CCC2(CN2)C1=O,0.1388
C1OCC2OCCOC12,0.3152
Cc1cc(on1)CC=O,0.2118
OCC12CN(C1)C2C#C,0.2536
CC1(C)NC(=O)C2OC12,0.2512
OC12CC3C1N3C2,0.2936
CCCc1cc(n[nH]1)N,0.2319
NC12CC1(NC2)C#N,0.2361
CCN(C=O)C=O,0.2154
OC1CCC2OC12,0.3295
CC12CN1C(=O)NC2=N,0.2473
CC1OCOCC11CC1,0.3425
CC#CC1C2OCOC12,0.2741
OC1C(=O)C2CN2C1=O,0.2029
NC1=NC(=N)ON=N1,0.1567
O=CCC1C2OC=NC12,0.2221
C1C2C=CC3CCC12C3,0.2438
N#CC1COC11CC1,0.2647
CCC12NC1C(O)C2=O,0.201
CC(OCC#C)C=O,0.2262
CC(C)C1OC1C1CN1,0.3305
OCC12OC1C1CCC21,0.3076
CCNC1CCOC1=O,0.2446
COC(=O)CC(=O)N,0.2432
O=CC1C2CC1N=CO2,0.2159
COC(C)COCC#N,0.2828
COC(CN(C)C)C#N,0.2392
CC1CC1C(O)C1CN1,0.2959
CCCc1cc[nH]c1O,0.2325
O=C1CCN2C3CC2C13,0.2112
CCc1c(cn[nH]1)CO,0.2478
CC1(OC1C#N)C1CN1,0.2516
COC(COC=N)C#C,0.2814
CC(COC=N)OC=N,0.2746
OC1(CCC1C=O)C=O,0.1978
COCC1(O)C(C)C1C,0.3108
C1C=CC(=O)OC=N1,0.2084
CN1C2C1C(=O)C=C2N,0.1901
C1CC=C2CCC=C2C1,0.1961
CC1CC(C)(O)C1,0.3259
c1cc(c(cc1F)N)O,0.1993
CC1=CC2CC1OC=N2,0.2371
COCC(CO)C(N)=O,0.2731
C1OC2CCC=CC2O1,0.2527
CCC1NC1C1CN1C,0.2902
CC#CCC(C)(C)OC,0.2962
OC1C2CCC12C=O,0.2227
CC1C(C#C)C1(C)C#C,0.2605
CC12CC(CCCC1)O2,0.3161
CN(C=N)C(=O)N,0.2517
CCC1COCC1OC,0.3163
CC1CCOCOC1=O,0.2734
CC(C)C1NCC1=O,0.2172
CC1OCC2CCC1O2,0.3115
OCC(O)CCNC=O,0.2805
C1CC1CC(=O)C2CC2,0.2326
O=C1COC1CCC#C,0.2208
CC1COC2CC2(C)O1,0.3082
C1OC11CN2N=NC=C12,0.2561
CC1C2CC2C2OC12C,0.3312
C#Cc1ncc(cn1)F,0.2023
C#CC1(CC1)NC=O,0.2676
CC1C2N1C1CCC=C21,0.2337
c1c2cn[nH]c2[nH]c1O,0.2197
CC1NC(C=O)C1=NO,0.2055
CC12CC3C1CCC23O,0.3263
CC1CC(=O)C1C#N,0.222
O=CC1(NC1C#N)C=O,0.1969
O=C1NC2C3CC(C3)C12,0.2734
CC(CO)C1OCC1O,0.2996
COC(CC1CN1)C#N,0.2678
C1C2C1C1C=CCC21,0.2632
CN1C2CC(=O)C12C,0.2089
OC1COCC=CC1=O,0.1983
CCC1CC(O1)C(C)C,0.3189
CC#CCN(C)CC#N,0.251
C#CC(C#C)C(=O)C#N,0.1869
O=CC1CN2CC2C=C1,0.1954
CC1CC2(CO2)CCO1,0.3324
CC1(CCCC=O)CO1,0.2284
CCC1CC2CC12OC,0.3249
O=CC1CC2CN3C2C13,0.2058
CCCC12OC1CC2O,0.3226
OC1CC1OCC1CC1,0.3182
NC(=O)COCC1CO1,0.2662
COCC(O)C(C)(C)O,0.3311
CCC(CC1CC1)C=O,0.2261
C#CC(=O)NC(=O)C=O,0.1612
COC1(CCC1=O)C#N,0.1955
CC12COC(=O)C1N2,0.2609
CC1NC11CCC(C)=C1,0.2347
CC12CC1OC(O2)C#C,0.2789
CC1(O)C(O)C1CO,0.2918
[NH3+]CCC1(CC1)C([O-])=O,0.2757
CC1(O)CCCC(O)C1,0.318
c1nc2n(n1)CCC=C2,0.1931
OC(C#N)C1=CN=NO1,0.2312
CC1(CC(C1)CCO)C,0.3421
C#CC12COC1CCC2,0.2912
CC1C2NC2C1OC=O,0.2528
Cc1c(cco1)C(=O)N,0.2136
OC1C2COCC12,0.3105
OCC(NC=O)C1CN1,0.2585
CC1CC(O)COC1=N,0.2749
COC1C(C)C2OC12C,0.3181
CC1C2CCC(=O)C12,0.2232
OC1CC1C(=O)C#C,0.1829
CC1(O)C(N)C1(O)C#N,0.2647
CCC(=O)CC(O)CO,0.2305
OC1CC=CC=CC1=O,0.1628
C#CC1OC2CCOC12,0.2655
CC#CCC1CCCC1,0.3009
C#CC1C2OC1C2=O,0.2387
CN=COC(=O)CC#C,0.2365
C1C2OCC11CCOC21,0.3145
CC1(CC(=O)C#C)CO1,0.1992
C1CC23COC2CCC13,0.3094
CCC1CCOC1,0.3196
CC1CCCC(C1)C#C,0.313
C1CC23COC(C=C2)C13,0.2367
CNc1c(nnn1C)O,0.2166
CC1OCOC(=O)C1O,0.2764
C1CC2CC=CC(C1)O2,0.2622
OC1=NC=CC(=O)C=N1,0.1593
CC12CN3CC1(O)C23C,0.2773
O=C1CC2C3C4C3N1C24,0.2245
CNc1cn2c(n1)CC2,0.2127
COC1CC2OC(C)C12,0.3043
CC(C)(C)CC1(CC1)O,0.2977
O=C1NC=CC2COC12,0.2013
CC1C2C(C)C(O)C12O,0.3128
C1CC1C12CC(C1)C=C2,0.2395
CCOC1CC2CC12O,0.3291
CC12CC1C(C2)=NO,0.2451
CC12C3CC1CC23C#N,0.2813
COCC1(CC#N)CN1,0.2898
c1c2c(c(o1)N)NCC2,0.2119
CCCCOC(=O)CN,0.2623
c1c(ncc(n1)N)C=O,0.1754
CC1C2OC3(C)C2NC13,0.3059
O=CC1CC2C(C#N)C12,0.2253
CC(C)N1CC1CC=O,0.2054
OC12CCCC1C2C#N,0.2944
Cc1cc(co1)N(C)C,0.2136
CC12CC1(CO)CC2,0.316
N#CC12CC1C1(CC1)C2,0.283
CN=CN(CC#N)C=O,0.2285
CCC1CC1OCC=O,0.2239
CCC1CC(C#N)N1C,0.2557
N#CC1=CCC2CN2C1,0.1996
CC(C)Oc1nc[nH]n1,0.2441
OC1CNC(=O)C1C#C,0.2696
C1CC2C=CC3NC23C1,0.2371
c1c2c([nH]c1O)CC=C2,0.1795
C#CC(=O)N1CCC1=O,0.2067
Cc1cn(c(=O)cn1)C,0.1642
C1C2CC3=C(N=NO3)C12,0.2026
CC1C2(C)OCOC12C,0.3162
CC1=CCNCC1=O,0.181
CCN(C)C(=NC)C=O,0.1627
C1CC1(CC#N)C(=O)N,0.2672
CC1C2(C)CC1(C)O2,0.3148
OC1CC2OCC2=C1,0.2463
OC12C3OC1CC23C#C,0.2626
CC12CCC1(C)COC2,0.3243
CC(=O)C(CC=O)C=O,0.1934
OCC1CC(=O)C(=O)N1,0.1724
CCCC(O)C1CN1C,0.2953
CCOc1cc(on1)N,0.2425
C1C23OCOC12C1OC31,0.2643
OC1C(CC11CN1)C#C,0.2868
CCC1(CC2(C1)CC2)C,0.3411
CC1CC(C)OCCO1,0.3202
CCNC(CC#N)C#N,0.2553
CC12OCC1C1(O)CC21,0.3155
CC(=O)C1CC1OC=O,0.232
CC1C2CC3(O)C2C13O,0.281
O=C1NC=NCC11CN1,0.2257
Cc1cc([nH]c(=O)c1)N,0.1794
COC1(CC1(C)O)C#N,0.2826
OCC1C2CCC1CC2,0.3351
CC(NC=O)C1CC1,0.2794
C1CC2CCCCC2C1,0.3687
c1c(coc1CC#N)N,0.2104
CCC(CO)(OC)C#N,0.2921
CC1OC(=N)C(C=O)=C1,0.1787
CC(C)c1cc([nH]n1)N,0.2441
COC(C)(C#C)C(C)C,0.2982
C#CCC1CC2CC2C1,0.3128
CC1=CC2C3CC2(C)C13,0.2246
C#CCC12CC1CC2,0.3019
C1N2C3CC4=CCC13C24,0.1663
N#CC1C2CC3C(C2)N13,0.2869
CC(O)CCCN1CC1,0.299
CC(C)(C)c1cnn[nH]1,0.2534
OC1CC(C=O)C1C#C,0.2233
C#Cc1cnc(o1)O,0.1979
OC1C2COC(=O)OC12,0.3065
CN=COC(=O)CC=O,0.2232
CC1=CN=C(O)C(=N)O1,0.1663
CCC12CC(C1)OC2C,0.3088
O=CCCC12CC1OC2,0.2122
OCC(CC1CN1)C#N,0.2747
CC1(C)CCC1(O)CO,0.3069
N#CC12CC3C4C1N4C23,0.2638
CCCCCOCC#N,0.2927
CC(=NO)C1(CC1)C#N,0.2424
CC1CC2(NC12C)C=O,0.2098
OCC1CC2(CN2)C1O,0.3056
CC(C#C)C#CC1CO1,0.2688
C(C1CO1)C1=NC=CN1,0.247
C[NH2+]C1(CC1)C([O-])=O,0.2642
OC1CC11C2CC1O2,0.2903
CC1(CC1)CCCC=O,0.2283
CC(C)C(C)NCC#N,0.2667
OC(C#C)C1=NC=CN1,0.238
CC1CC(=O)C2(CO2)C1,0.2067
CC12C3OCC(C13)C2O,0.2899
CC1OCCOC11CC1,0.3228
COC1C2CC1(C)CO2,0.3042
Cn1c(c(cn1)C#C)O,0.2304
CN(C)CC1(CO1)C#N,0.2324
CC1=CC(O)C2C(O)C12,0.2349
CCCC1=CCCC1=O,0.197
CC1=CCCC(=O)N1,0.2146
CC1(O)CCC1(N)C#N,0.2767
CC#CCOC1COC1,0.281
CC1=C2C3CC3N2N=C1,0.2285
CC1C(CC#N)N1C=O,0.2539
CC1COC(=O)CC1C,0.2716
CCCC12OC1C1OC21,0.2917
CC1COC1C#CC#N,0.2206
COC(=O)c1c[nH]nc1,0.2391
CC12CC1OC(=O)NC2,0.3019
CC#CC1C=CCC1=O,0.211
O=CNC1C2C3CC1C23,0.277
c1cnc-2cocnc12,0.1645
CCCOc1cnno1,0.22
CC12C=CC3C1C2C3O,0.2317
OC1CC2NC12C1CO1,0.3036
CCCC(=O)CC1CC1,0.2284
Cc1cn2cnnc2o1,0.2281
CC1=CC(O)CCC1=O,0.1916
OCC1OC(=N)C(=N)O1,0.2341
CN1C2CC2C11COC1,0.2884
CC1=CC(=N)NC(=N)O1,0.2147
c1cnc(nc1)N2CC2,0.1972
C1COCOCC=C1,0.2522
CC1C2OC11CC=CC21,0.2365
CN=C1CCC(CO)O1,0.2733
CC1CC=C2CCC12O,0.2412
CC(C)C(C)C#N,0.3497
N#CCC1NC1CC#N,0.3042
CN1CC11CCCC1O,0.3155
CC(C)c1cc[nH]n1,0.2675
CCC1(CCC1)C(=O)C,0.2281
O=CC12OC(C=C1)C=C2,0.2018
CC#CCCN=COC,0.2572
CC(NC(=O)CO)C=O,0.2178
CN=C1N=CNN=N1,0.166
c1nc(nnn1)C=O,0.145
c1c(cncc1N)C=O,0.1616
COCCC1CCOC1,0.321
CCN=COCC#CC,0.2687
C1C2CCC3N4CC23C14,0.241
COCC(C)(O)C#C,0.2959
N=C1NN=CC(=C1)C#C,0.1456
CC1CCCC2(CC2)C1,0.3402
O=C1CC2OC(=O)CC12,0.2166
c1c(oc(=O)o1)O,0.2605
O=CCC12CC3OC1C23,0.2122
CC(=O)C#CC#CC=O,0.1769
Cc1c(n[nH]c1N)C#N,0.2079
CC#CC1(C)CC1C#N,0.2665
O=C1CNC2COC12,0.1843
OC1CCC2(O)CC12O,0.3032
c1cncc(nc1=O)N,0.1619
OCC12CC1OC=NC2,0.2725
COC(CO)C(C)(C)O,0.3051
CC(=O)C1CC2(C)CN12,0.218
CC12CC3OC(CC13)O2,0.3377
O=CC1C2CC3CC2N13,0.2073
CC1CCC1(C)C1CO1,0.3437
CC(CC#N)(CC#N)O,0.3002
CC12CNC1(C=O)C2O,0.1847
CC1OCC11CC2CN12,0.3146
O=C1OCCN2CC12,0.2445
CC1C(=O)C(O)C11CN1,0.2067
CC1CC2CCCCC12,0.3497
Cc1cc(oc1N)C#N,0.1804
CC(C)C(=O)OCC=O,0.2303
OCC1C2C3CC1C23O,0.3049
CC1OC2C1=CNC2=O,0.191
CNC(=O)C1C2CC1O2,0.2513
CC1C(=O)CC11CN1,0.2146
CC(O)C1(O)CC1(C)C,0.3074
NC1=C(NN=N1)C1CO1,0.2078
CC12CC(O)(C#C)C1N2,0.2694
N#CC1CC2CC1C2,0.3403
CC1C2C(C)C(=O)N12,0.2325
CCc1c(c(on1)C)C,0.2404
CC1C=CC(C)C1O,0.2626
O=CC1=CNC(C1)C#C,0.1813
CC1(OCCC1O)C#C,0.2912
OCCC1CC1N1CC1,0.3139
CC(O)C1CCCC=C1,0.2643
CC1OC2CC2(C)C1O,0.3067
CN=C1OC2CC12C,0.2732
NC(=N)C1=NOC(=N)O1,0.2011
OC1CC(NC1=O)C#C,0.2708
CC1NC1(CO)C#C,0.2726
N#CC1CC2OC2C1,0.313
CC1(O)C(NC1=O)C#C,0.2522
N#CC1C2C3CCC2N13,0.2603
C(C=O)OCC(=O)C=O,0.1334
COCC[NH2+]CC([O-])=O,0.2692
CC12CN1C(=O)OCC2,0.2671
CCCC(OC)C=O,0.2133
CC(O)(CO)COC=O,0.2764
CC12C=CC3OC1C23,0.2227
CC1CCC1C(N)C#N,0.2941
C1C2(N1)COC2,0.3037
CC(C)(C)CCCOC,0.3241
CN=COC1CN(C1)C,0.242
CC12COC34CN(C13)C24,0.3094
Cc1cn2cn[nH]c2n1,0.2108
CC1CC(C)C(=O)C1,0.2218
C1CC2=CC3NC3C2=C1,0.1908
CCC1OC1CC(N)=O,0.2712
O=CC1C(C#N)C1C#N,0.2203
CC1C2N1C(C)C2=O,0.2155
OC1CC2COC12C#N,0.2532
OC1CCC2(CCO2)C1,0.3078
C1C(=NO)CN1CC#N,0.2339
COC1C(O)C1C1CC1,0.2921
CC#CC1=CCCC1O,0.2063
c1cc([nH]c1)CC2CC2,0.2421
CCC1NC1C#CC#C,0.2173
COC(C)C([NH3+])C([O-])=O,0.265
C1C2OC3=NNN=C3C12,0.2214
CC12NCC1OC2C=O,0.2063
CN=C1CCCCO1,0.2646
CC1CC1(C)CC1CO1,0.3367
CC1C2C3CC2(O)C13O,0.3167
CCC1(O)C2C3OC2C13,0.2895
CC1C2N3C1C(C)C23C,0.3207
OC1C2C=CCC(=O)C12,0.2155
OC1C2C(O)C1C21CO1,0.3052
N#CC1C=CC2CC1O2,0.2371
COC1CCC1(C)OC,0.3239
NC(=O)C1N2CC2C1=O,0.2146
C1C(CO1)CC=O,0.2239
CN1C=CCOC1=O,0.2195
OC(C=O)C(O)C1CN1,0.2046
CCn1cc(nc1C)C,0.2412
CC1CC1(C#N)C1CO1,0.3043
OC12CC(C1)CC2=O,0.2309
C1OC1C1CC2OCC12,0.3145
CCC1(CC1)OC2CC2,0.3192
COC1CCCCC1,0.3279
N=C1OC(C=C1)C#C,0.2188
CCCCCOCCO,0.343
CC1(O)CC=CCC1O,0.2682
O=C1OC2CC2C1C#N,0.2745
C1N2C3C4C=C1C2C34,0.1814
COCC12OC1C1NC21,0.2754
CC#CC12CC(N1)C2O,0.2683
C1C2CC11CCOC1C2,0.3293
N=C1OCCC1C=O,0.2257
C1CC(=O)CC1=O,0.1984
CCCC(N)C(=O)OC,0.2495
CN1C2C3NC3C(=O)C12,0.1839
OC1C=CC2(CC12)C#N,0.2397
OC1CC11N=CNC1=O,0.2157
O=CC12CC3C(O1)C3O2,0.2075
CCCC(CCC)OC,0.3279
C1C2CC11NC1COC2,0.3149
OC1CN2C=CN=C12,0.2467
C1N=C2COCC3C1N23,0.2296
COc1cc(oc1)C=O,0.1726
OC1COC11CC2CC12,0.2987
CC(OC(=N)C=O)C#C,0.1903
CC(C)(C)C(=O)C(=O)N,0.1742
C1OC2C3C4OCC13C24,0.3306
CC1CC11CC2COC12,0.3066
O=CC1C2CN1C1CC21,0.2088
CCN1C2C3OC2C13C,0.2892
CC1COC(O1)C1CC1,0.3349
OCC12CC1NC(=O)C2,0.2659
CCC1C2N=COC12C,0.2547
CC1(CN1)C1CC1C#N,0.2793
C1OC2C3CC(O3)C12,0.3199
CCC(C)OC=O,0.285
CC(C#N)C(=O)C#C,0.2064
C1C2(CCC2)C11CCO1,0.2966
CC(=O)n1cncn1,0.2265
C#CCOC(=O)N,0.2957
N=C1NC(C#N)C2OC12,0.2548
C1CC2C=CCC=CC12,0.2602
CC(O)C1(O)C(C)C1O,0.3027
CC1(O)C2CCC12C#C,0.2649
C#CC#CC1CC1C#C,0.2156
C1OC1C12CN1CC2,0.3158
O=C1OCC2CC1O2,0.2467
NC(=O)C1C2CC1O2,0.2501
OCC12CC1C(O2)C=O,0.2128
CC1CC(OC1=O)C#C,0.2761
NC(=O)C1CCC1=NO,0.2301
CN1C(C)=CC(=O)C1=N,0.1473
CCC1(C)C2CCC12O,0.2998
C#CCN=C(N)NC=O,0.221
C#CC12OC1C1CC2O1,0.2555
CC1OC2(C)C(O)CC12,0.2985
O=CN1C2CC3C2CC13,0.2664
OCC1CCC(O)C1O,0.2964
COC(C)C1(O)CC1,0.3223
O=CC1=CC2OC3C2C13,0.1769
CC1NC1CC#N,0.3017
COc1c(c[nH]n1)C=O,0.2015
Cc1nc(c(o1)CO)O,0.2144
CCC1N2CCC12C#N,0.2524
OC1C2CC2(C#N)C1=O,0.2121
C1OC1C1(CC1)N1CC1,0.3124
CC1C2OCOC12,0.3381
CC(C)C12CC3C(O1)C23,0.3034
COC1COC1C#C,0.2743
OC1CC2C1N2CC=O,0.2219
CCC1OC2(C)CC1C2,0.3231
CC(=O)CC1CC1C#N,0.235
CC1C2OC3C2C=CC13,0.2382
CCOCC(C)(C)C=O,0.2294
OC1CCNCC1C#N,0.2723
O=C1CN2CC1(C2)C#C,0.203
CC1(CC2CC12)C=O,0.2281
COC1C2CC1(C2)C#C,0.2972
COCC1OCC1OC,0.3135
C#CC(CC#N)(C#C)O,0.2741
CCC(OC(N)=O)C=O,0.229
OC12CC3C(NC1=O)C23,0.2615
Cc1ccn(c1C#C)C,0.1986
CC1C2C=CC1C(C)=C2,0.2147
CC(O)C1CCC(=O)O1,0.2787
C1COCC(=C1)C2CC2,0.2547
CC1CC=CC(=O)C1,0.1885
CC1C2C3C4N1C2C34O,0.2877
C1C=CCN1C2COC2,0.2272
Cc1ccnc(c1C)C,0.228
[O-]C(=O)C1CCCC[NH2+]1,0.2739
CC1COC(=O)C(=O)N1,0.2091
CCC1N2CC3C2C13O,0.2857
CC1CC11OCC2OC12,0.3177
CC1(CN1)C(=O)C=O,0.1491
C#CCc1c(nn[nH]1)N,0.2204
CCC#CC1CCC1C,0.2916
CCC1(CC)CC1C,0.3373
CC1(C#C)C2COC12,0.2701
c1cn2c(c1N)NCC2,0.2157
CN(CC#N)C(=N)C=O,0.1738
CCc1cn(c(n1)O)C,0.2457
C1CC23OC(C4NC24)C13,0.3011
NC1(C#N)C(O)C1O,0.267
CC(=N)OC1=CNN=C1,0.2572
CN1C2(C)CC(O)C12C,0.2937
CCN=COC(=O)C,0.2398
O=CC12COC3CC1C23,0.2218
COC(C)C1OC1C#C,0.2734
OCC1CC(O)C1CO,0.3126
O=CN1CC2OC3C2C13,0.252
C1C2C3COC(CN12)O3,0.3064
CC(CC1C[NH2+]1)C([O-])=O,0.277
CC1=C(C)C2OC2CC1,0.2353
CNc1c([nH]cn1)OC,0.213
N=C1OC23CC4C2C1C34,0.2631
Cc1c(ocn1)NC=O,0.2108
CC1=CC2OC3C2C13C,0.2257
O=C1CC(CCC#N)N1,0.2812
C#CCCCOCC=O,0.229
CC1N(C)C11CCC1O,0.2855
CC1C=CC=CCC1=O,0.2052
c1c2c(c(o1)N)C=CC2,0.1812
CC(C)(C1=CCCC1)O,0.2597
C#CC1C2CC1(C2)C#C,0.2749
NC(=O)C1CC1CO,0.2708
O=C1OC2C3CC2C1C3,0.2764
CC1CC(CO)C11CC1,0.3261
CC1CCOCC=C1C,0.245
OCCC1C2C3OC2C13,0.304
ON=C1C2OC2C2OC12,0.2327
C(CCC=O)CC=O,0.2221
N=C1OCCC=CC1=O,0.1825
c1c(onn1)CCC=O,0.2164
C1C2COC3(COC3)C12,0.321
CCCCC(C)(O)C=O,0.2256
COC1(CNC1=N)C=O,0.2055
CCN1CC1C1CC1C,0.3015
N=COC1CC2OCC12,0.2652
CN1CC1CO,0.2927
Cc1cc([nH]c1C)C#N,0.1994
CC12CN1C=CC(=O)C2,0.183
COC12CN(C1)C2CO,0.315
O=C1CN2C3C=CC1C23,0.1887
CC1C2C3CC1COC23,0.2984
CC1C=C(C)C2OC12,0.2432
CCN(C=O)C1CC1O,0.257
CC1CC2COC3C1C23,0.3076
C1CC2OC1CC1OC21,0.3279
CC1C(O)C11CN2CC12,0.2867
CN1C2C1C1OCC2O1,0.3104
N=C1OC=C2C3CC3N12,0.2054
N=C1OC(C#C)C11CO1,0.2659
C1CC2CC1OCO2,0.3301
COCC(O)CCCO,0.3296
COC1CCC(C)CC1,0.3233
c1c2c([nH]cn2)oc1N,0.2164
Cn1c(=O)c(=O)ocn1,0.1881
CCC12CC3(CC3)C1N2,0.3248
N=COC12CC3CC1C23,0.2722
C1C(=O)C(=O)COCO1,0.1683
C#CCOC1CC1C#C,0.2734
C1C=CCNC(=O)C1=O,0.1961
OCC1OC1(CO)CO,0.3136
C1CC2OCOC1C=C2,0.2421
CCC1C(C#C)C1(C)O,0.2786
CC12OC1(CO)C1OC21,0.3047
c1c(oc(n1)CN)C#N,0.2061
OC12C=CC34CN(C13)C24,0.2193
C#CC1NC1CC1CO1,0.2823
CC1CC=C(C)C2CC12,0.2455
O=C1OC2CC2C2CC12,0.2605
CC12CC=C3CCC1C23,0.2193
CCC1OCC1C1CO1,0.3207
CN1CC2C1CC2=O,0.1981
CC1NC(CC1=O)C=O,0.1993
N=C1ON=CC=C1,0.1649
COCCC1CC1C,0.3407
N#CCOC1CC=CC1,0.2577
CC12OC3(C)C4C1C2C34,0.3131
Cc1c(ccc(=O)o1)F,0.1657
CC1NC(C=O)C2OC12,0.2071
O=C1OC2C3CC12C=C3,0.2216
CCC1=CC2C(O)C2C1,0.2333
CC12CC(C1)(C=O)C=C2,0.2137
CC1CC11CC2(C)CC12,0.3265
COc1c(c(n[nH]1)O)O,0.2395
c1c(ocnc1=O)CO,0.2065
CN=C1OC2C(O)C12O,0.2525
CN=C(N)C(O)C#CC,0.2477
O=CC1C=CC2CC1C2,0.2071
C1CC2=CCOC12,0.2359
OC12C3C1C1C3C=CC21,0.2378
CC12OCC3(O)C1OC23,0.3028
CC1C=CCCC11CO1,0.2676
CC1CC1C(CO)=NO,0.2342
CC1OCC2(O)CC2O1,0.3146
OC1CCC1CC#C,0.3129
N#CC1CN2CC3C1C23,0.2725
Cc1cc(c([nH]1)O)C=O,0.1721
CC(O)C(=O)C(=O)C#C,0.1535
CC1=NCC(OC=N)O1,0.2751
COC1C2OC(=O)C12N,0.2439
OC12C=CC3C1NC23,0.2228
CCC12CCC1(O)C2O,0.2891
CCCOCC#CCC,0.2844
OCC#CC12CN1CC2,0.2437
CCC(=O)c1cnco1,0.198
CCC1=C(C)C2CC1O2,0.23
C1C2C3C4C=CC2C1N34,0.2371
O=C1CN=C2NCCC12,0.2054
C1OC1C1OCC=C1,0.2482
C1CC11C=C2CC3C2C13,0.1683
CC1COC2C3NC3C12,0.291
C#CC12CC1OCCN2,0.2583
CNC(=O)C(=N)NC=O,0.2054
CCC12CC(N1)C2C#N,0.279
COCC(O)C1CCO1,0.3211
OC1CC11C=CC2CN12,0.2208
c1(=O)nc(oc(n1)O)O,0.2366
CCCC1(CCN1)C#N,0.268
[NH3+]CC1=N[N-]C(=O)O1,0.1401
N=C1COC(=O)N1C=O,0.2324
OCCC12CC(O)C1O2,0.3216
CC(CC#N)C1(C)CC1,0.3178
CC(C)C1(O)C(O)C1O,0.2732
CC1CC11COC=NC1,0.2722
CC1COC(C1)C(N)=O,0.2653
c1c(c[nH]c1CO)C#N,0.2226
CC12OC1CC1CC2C1,0.3445
C1CNc2c1[nH]nc2N,0.2204
CN=C1OCCC1(C)O,0.2777
CC(=O)C1C2CC2C1O,0.2249
CC(CNCC#N)C#C,0.2714
C(#N)C(=O)n1nnnn1,0.1953
CN=C1OCC(=O)C1C,0.2101
c1(c([nH]c(=O)[nH]1)O)O,0.2184
CC12CC1OCC2O,0.2995
NC(C#N)C1CCC=C1,0.2483
Cc1c(c(no1)O)C#C,0.216
CC#CCC(C)(C)C#N,0.2872
CC1(CCC12CC2)C,0.3458
CC1(CC(C1)CC#C)C,0.3119
CC(O)C(=N)OC(N)=O,0.2558
NC12C3NC1C(=N)OC23,0.2353
O=C1CC2CCCN2C1,0.2035
c1c(cnc(n1)N)CO,0.1979
CC(COCC#N)C=O,0.2307
N=COCC(=O)CC=O,0.2048
CC1OC2COC1OC2,0.3327
CC(C)(C#N)C(=O)CO,0.2312
CC12CCC(C1O)C2=O,0.2143
CN=COC1CCCO1,0.2769
OC(C#N)C1=CNC=N1,0.2532
COCC1CC(N1)C#N,0.2656
CCCC(C)C#CC#C,0.2313
CCC(NC=O)C#CC,0.2699
O=CC1C2OC1C1CC21,0.2172
O=CC1NC(=O)C2CC12,0.2091
O=CC1CC2(CC2)C=C1,0.2019
CC(O)C1CC(O)C=C1,0.2461
N#CC12COC1CC=C2,0.2572
NC(=O)CC12CN(C1)C2,0.2478
CCC1C2OC(C)C12C,0.3092
OC(CC#N)C#N,0.3095
CC1C2NC2C(O)C1=O,0.2139
CC12CN1C(=O)OC2=N,0.2583
O=C1NCC11CO1,0.2609
OC12CC3OC1COC23,0.2891
C1NC1C1OCC2NC12,0.3106
C1CCC2(C1)CC2,0.3514
CC1CN1CC(=O)C#C,0.1804
N1C=CC=CN=CN=C1,0.1925
CCC12COC1C2(C)C,0.2933
CC1C2CC1C2(N)C#N,0.2932
CC1=NN2CC(O)C2=N1,0.2572
c1cc(=O)occ1C=O,0.1814
OC1CC2(OCC12)C=O,0.2075
c1nc(no1)CO,0.2503
CC12COC3OC1CC23,0.3252
N#CC1=CCC2OC2C1,0.226
C(=O)C#CC(=O)C#N,0.1746
CC1C=CC2(CC2)C1C,0.2442
CC1=NC(=CN1)C1CO1,0.24
c1cc(c(c(c1)O)O)O,0.2219
N#CC1CN1C1CCC1,0.2677
CCOc1c(c[nH]n1)C,0.244
CC12CCC1OC1CC21,0.31
NC1=CC([O-])=CC(=[NH2+])N1,0.206
CC1=NNC(=O)C(=N)N1,0.1907
CC1C2(C)C3CC3C12C,0.2824
CC1=NC(C=O)C(=N)N1,0.2054
COC1CC2COC2C1,0.312
NC(=O)C1(O)CC1C#N,0.2582
O=CC1(CN1)C#C,0.2142
CC1CC2OC(=N)C2O1,0.2699
OC1CCC2(CC2)C1O,0.3197
CC(C=O)C1CN2CC12,0.2111
C1NC11C2CC3OC2C13,0.3124
CC(O)C1OC1C(C)=O,0.2227
C#CC1CN=C(N1)C#N,0.2037
c1[nH]c(=O)c(c(n1)F)N,0.1734
NC12C3NC3C1OC2=N,0.261
CC#CC1(CN1)C(N)=O,0.2526
CC(=O)C1(C)CC2OC12,0.2243
CC([NH+]1CCC1)C([O-])=O,0.2646
c1c(nno1)C2CC2,0.2228
Cn1c(ccn1)C=O,0.1975
O=CC(CC1CO1)C=O,0.208
[NH3+]CC1=NOC=C1[O-],0.2156
C(C#N)OC(=N)C(=O)N,0.2156
CC1CC23OC(C2O)C13,0.2869
OC1CC1C1COC1=N,0.2898
C(=O)c1c(nn[nH]1)N,0.1688
OCC12CNC1C(=N)O2,0.2501
C1OC2OC=NCC2=C1,0.2465
c1c(nc([nH]1)O)OC=O,0.2179
OC1CC2OC1C2C#C,0.2993
CCCc1ncc(o1)N,0.2208
C#CC12C=CC3CC1N23,0.2132
Cc1c(c(n[nH]1)N)C=O,0.1758
CC1=CC=CNC(=O)C1,0.1892
CCC(=O)N1CC(=O)C1,0.2086
Cc1nc(no1)C2CC2,0.2424
C#Cc1cnc([nH]1)C#N,0.1834
COC(C)(C=O)C(C)C,0.212
OCC12NCC1C2C#N,0.265
O=C1C2CC3CC1CC23,0.2209
CCN=COC1CC1O,0.2569
CC1CC1(CO)OC=O,0.2779
C#CC#CC1=NCCO1,0.1848
Cc1cc(=O)nc(o1)C,0.2057
CC(C1CN1)C(=O)C#N,0.1693
CC1=C(C)CC2CC2C1,0.254
CC(C#N)C1C2CCN12,0.2753
OC1COCC(C1)C=O,0.2223
c1cc(=O)oc(c1F)O,0.1619
CCCC(OCC)C=O,0.2133
CC1C2OC(C3CN3)C12,0.3081
CC1(CC1O)C#CC#N,0.2259
C#CCCC1COCO1,0.3129
CCN1C2C3C1C2N3C,0.2839
O=CC12C3CC1CC2C3,0.2184
CCC(CO)C(N)=O,0.2767
c1c2c(co1)NCC=C2,0.1918
C1C2OC3CN(C3)C12,0.2956
c1cnoc1C2CC2,0.2316
COC1C2CCC1C2O,0.3157
CC(C=O)C#CC1CC1,0.2102
CCOC12CC1(C)CC2,0.333
CNc1c(c(on1)N)N,0.2218
OCC(OC=N)C=O,0.218
C1OC2OC3CC1C2C3,0.3305
CC(O)(CO)C#CC#C,0.2219
OC12CC1C1C2NC1=O,0.2609
OC1CC2CCOCC12,0.3143
OCC1C=C2CN3C1C23,0.1738
CCC(O)C1COCO1,0.3323
COC1CC2(C)C(O)C12,0.3063
CC(CC=O)CN1CC1,0.2204
CC1(OC2CCC12)C#N,0.2825
OCC1NC1CCC=O,0.227
CCc1c(=O)occn1,0.1749
CC(O)CC1C(O)C1O,0.2784
O=C1OC2OC3CC2C13,0.2659
O=CC12CCCC1O2,0.2212
OC1CC(CC=C1)C=O,0.2251
CC1(C)C2CC3(CC3)C12,0.332
C1C2N3C1C21CC=CC31,0.224
CN1CC11CNC1C#N,0.2597
C1C=CC=CCC2OC12,0.2183
CC1(O)CC2(C)CCC12,0.3209
OC1C(O)C11COC=N1,0.2423
[NH3+]C1(CC1)C(O)C([O-])=O,0.2606
O=C1OC2(CC#C)CC12,0.2761
CC1(C)C2CC1(CO)C2,0.3376
NC1C=C(NC1=O)C#N,0.1831
N=C1OCC2OC12C#C,0.2501
Cc1cc(nc(n1)N)C,0.1991
CC1(NCCC1=O)C#C,0.2134
C1C2(N1)CN(C2)C(=O)N,0.2886
CCC1CC1(O)C#C,0.2752
CC12CC(C1)([NH2+]2)C([O-])=O,0.213
COc1cc([nH]n1)N,0.2456
C1C2NC2C2OC12,0.3083
c1c(nc[nH]1)CC(=O)N,0.2375
CCOCC(CC)OC,0.3254
N=C1C=NNC(=N1)C#C,0.1686
CCC1C(C)C1CC#N,0.3176
CC12OC3CC1C2(O)C3,0.2972
O=C1C2OC2CC11CN1,0.2116
Cc1cc2c([nH]1)nn[nH]2,0.2026
COC(=O)c1cnoc1,0.2361
CC(O)C(=O)NC1CC1,0.2713
c1c(oc(n1)N(=O)=O)N,0.1513
CC1(C)C=CC2CCC12,0.2596
CC1=NCC(=O)CCO1,0.2136
N=C1NN=CC=NC1=O,0.1608
OC12CN3C1CC(=O)C23,0.2175
N=COCCC#CC=O,0.2047
CC1(O)CC=C(C1)C#N,0.2204
COC(C#C)C1(C)CN1,0.2659
OCC1(CO1)C#N,0.2888
N=COC1(CCC1)C#C,0.2776
COC(C#C)C1CC1O,0.2532
OC1CC2OC(=N)CC12,0.2802
CC1(NCC2NC12)C#N,0.264
CC(O)(CCC=O)C=O,0.212
CC#CCC1CC(=O)O1,0.265
CC(C)(C)OCC1CC1,0.3236
CC(CC(N)=O)C=O,0.2308
O=C(CC1CCO1)C#N,0.1801
OCC1COC2CC2C1,0.2927
C1C(=O)CN(C1=O)C=O,0.193
c1c[nH]c2c1C=CCN2,0.1837
CC1(O)CCC1(C)C#N,0.3087
Cc1cc2c([nH]1)CCC2,0.2297
CC1CCCC1CC#N,0.3471
COC(C)C1=NOC=C1,0.2496
CC(O)C12CC1N1CC21,0.2864
CC1(O)CCNC1=O,0.2741
CC12CN1C1CC2(O)C1,0.2942
c1c(c(on1)CO)N,0.2023
COC12CC1CC2=NO,0.2428
CCCC(O)C1(C)CC1,0.3281
c1cn2c([nH]1)ncn2,0.237
C#CC1=CCOC(=O)C1,0.213
O=C1OCCC2CC1C2,0.2623
CC#CC1OC2CC1C2,0.2794
COC(C)(CO)C(C)C,0.3189
O=CCC12CC3C1CC23,0.2262
C1NC1C12C3C4C3N1C24,0.2744
CC12CC(O1)C2O,0.3328
CNC(C#N)C(C)OC,0.2845
c1cc(=O)onc1O,0.172
CC1C=CC2=C1OC=C2,0.1911
Cc1cnc(oc1=O)O,0.1906
CCCC12OC1C1NC21,0.2793
CC(=O)C1C2CCC12C,0.2186
COC(CO)(C=O)C=O,0.1959
NC(=O)N1CC2C(O)C12,0.2695
OC1C2OC(C=O)=NC12,0.179
CC1CC11OC2CC12,0.3039
CC(CO)C#C,0.3166
C1C2OCC=CC3C2N13,0.2221
OCC1=CCC2NC2C1,0.2603
CC(C=O)C12CC(C1)O2,0.2172
C1CC=CCOC=NC1,0.247
C#CC12CC3CC1C2C3,0.2875
O=CC1N=COC1C#C,0.2177
CC12CC3N1C2CC3=O,0.2193
CC12CC1(O)CC2=NO,0.2442
CC(C)C1=CCOC1,0.2491
O=CC12CCC(O1)C=C2,0.2191
OC12CCNC1=NCC2,0.2466
CC12C3C4C5C(C1N35)N24,0.2261
CC1CC2OC2(C)C=C1,0.2455
CC1CC2(CC1C2)C=O,0.2214
CCCC#CC1CN1C,0.2589
N=C1OC2(CC2)C1C#N,0.2712
Cc1c(nc(o1)C=O)O,0.156
CC1C2CN1CC2=O,0.2061
O=C1NC2(CNC12)C#C,0.2383
OC1CC2=CCCC2=C1,0.1973
C#CC12CC3(CN3)C1O2,0.2595
CC(C)CC([NH3+])C([O-])=O,0.2671
C1OC2CC3CCC12C3,0.317
CC1CCC(=O)C(=N)N1,0.1725
OC1CCC1C1CC1,0.3249
Cc1nc2c(o1)ocn2,0.2173
COC(C)(CC#N)C#C,0.2936
CC1C2C3CC3C12O,0.2848
CC1CC(N)(C#N)C1O,0.2871
CCOC1(CNC1)C#N,0.2583
Cc1ccc([nH]1)NC,0.2305
Cc1c(ccc(n1)O)F,0.1993
CC1(CO)NC1C1CN1,0.2862
NC1(CCOC1=N)C#N,0.2568
C#CCC1(CCC1)C=O,0.2246
CCC(CCOC)OC,0.3259
OCCC12OC1C1CC21,0.2933
Cn1c(=O)[nH]c(n1)CO,0.2234
CC1COCCOC1,0.3259
CC12COC3CC1C2O3,0.3183
NC1=NOC(OC=N)=C1,0.2206
OC12CN3CCC1C23,0.2911
COC1CC(C1)C(N)=O,0.2725
CC1(C#N)C(O)C1C#C,0.2645
OC12CC1CCCOC2,0.3235
CC1CC(C#N)C1C#N,0.321
CC(C)C#CC(C)(C)C,0.3026
CC12OCC1CCC2O,0.3119
CC1OC1C1C(C)N1C,0.2968
CC(C)(C#C)C(O)C=O,0.2147
OC1COC2CCC1O2,0.3165
CC1CC2(CN2C=O)C1,0.2516
c1c-2cnonc2cn1,0.1353
CC1CC2(C1)CC(=O)C2,0.2207
Cc1c(nc(o1)C)N,0.2077
CNC(=N)C(=O)C#C,0.1437
CC1COC1C1CC1O,0.318
N#CC1C2CC1OC2,0.2858
CC12C3CN4CC(C14)N23,0.2786
C#CCC#CC#N,0.2386
COC(C)(CO)C#C,0.2836
CC1C2C1C1OCCC21,0.3206
CC#CC(C#N)C1CN1,0.2689
CCC1OCC=C1C,0.2494
CC12NC1C=CNC2=O,0.2072
C(c1c(non1)O)O,0.2336
O=CC(C1CO1)N1CC1,0.2215
OC1C2CC2C1C1CC1,0.3132
C#CCN1CC(=NO)C1,0.2285
OC1C2CCCOC12,0.304
C1OC1C1OCCC=C1,0.2643
COC=NCC#CC#N,0.2193
CC1C2NC2CNC1=O,0.2742
CC12CCC1CO2,0.3148
CC1(O)C2C3OC2C13C,0.2919
C(C1CO1)C1=CON=C1,0.2464
N#CC1CC1CC1CO1,0.301
NC(CO)C1=NOC=N1,0.2265
NC(=O)C12OC3C1CC23,0.2594
CN(CC=O)C=O,0.2069
CCCc1cc(co1)C,0.235
CC1=NC2CCC(C2)O1,0.2686
c1nncn1C=O,0.2081
CCC(O)CCCC=O,0.2284
CC1=CN=CC(=N)C=N1,0.1636
CC(C)(CC=O)C1CC1,0.222
CC1=CC(=O)NC1C#C,0.2165
CC(NC=O)C(C)C#C,0.2736
CC1(CO)NC11COC1,0.2871
OCC(=O)C1CC2CC12,0.2254
CCCNC(=O)C1CC1,0.2767
C#CCCCC(=O)CO,0.2348
CCC#Cc1c[nH]nn1,0.2216
CC(C)CN1CC1C#N,0.2685
CC1C2C1C(C)(C)C2=O,0.2222
CN=C1C=CC=NN1C,0.1462
C1C=CCC12COC2,0.2639
CC1CC2C3C4C2C1N34,0.3067
CC(=O)CC(=O)CC=O,0.1961
CC1OC(C)C2(C)OC12,0.3368
CCC1CCC2(O)CC12,0.3323
CC1C2NC(C#N)C12C,0.2477
O=CC1CC(=O)C=CN1,0.1827
CCC12CC1(C)C(=O)N2,0.252
NC(C#N)C(O)C#C,0.2917
OC12CC(=O)C3NC1C23,0.2113
[NH3+]CCCC#CC([O-])=O,0.2364
CCC1(CC1)OC(C)C,0.3204
CC1(OCCO1)C(=N)N,0.2667
C(CO)C(=O)C(=O)C=O,0.1183
C(CO)C(=O)NCCO,0.2778
CN1Cc2c(nn[nH]2)C1,0.2162
C(CC(=O)CC=O)CO,0.2111
OC1COCC1CC=O,0.2274
CC(C)(OC=N)C#N,0.2849
Cn1ccc2c1CCN2,0.2102
O=CC1C2OC(C#C)C12,0.2144
CCC1CC1C(F)(F)F,0.3728
CNc1cnn(c1N)C,0.2373
OC12CC(C1)CC21CN1,0.2991
CC(O)C(=N)OC1CC1,0.2736
N#CC1CCCC2NC12,0.2963
CC(C)C1(CC1)C(=O)C,0.2312
CN=C(C=O)NC=O,0.1791
CC#CC1CCC(C)C1,0.2992
C1C2C3C4C1C2CCN34,0.3098
CC12CC(C)(C1)C2CO,0.3349
CC12CCC(C=O)C1O2,0.2223
CC#CC(O)(C#C)C#N,0.2508
CC1COCOC1C#C,0.2857
CNc1cnc(o1)CO,0.2063
CCC1CC2CC12C=O,0.2198
C(C(=O)NC=N)NC=O,0.2306
C(C#N)OC(=O)CN,0.25
Cc1conc1NC,0.2299
COC1(C)CC11CCO1,0.3
OCC12CCC1C1NC21,0.2901
C1NC11CC2OC12,0.3189
COC1CC(C)=CC1=O,0.1741
c1conc1C#CC=O,0.186
c1c(ocn1)C#N,0.214
C1NC23COCC2OC13,0.2888
CC(O)C12CC1C(O)C2,0.3163
[O-]C(=O)C1CNC=[NH+]C1,0.1062
COC1COC2(CC2)C1,0.3149
CCCCOC1COC1,0.3183
CCC1CC11CCC1,0.3444
c1cncnc1C=O,0.1709
Cc1c([nH]nn1)C#C,0.2092
Cc1coc(n1)N,0.2377
CC1CC2(C1)OCC=C2,0.2423
OCC1(CC1O)OC=O,0.2713
CCN1CC(C1=O)(C)C,0.2792
COC(=N)NC(=O)C#C,0.2108
N=C1NC(=N)N=CN=C1,0.1495
c1c(nc(o1)N)CC=O,0.1948
c1c(c(ncn1)F)F,0.2252
O=COCC1(CN1)C#N,0.2791
COC(C)COCC=O,0.2283
C(COCC(=O)N)C#N,0.2761
CC1CC2(CC=O)NC12,0.2045
CC1OCC2=C1C=CN2,0.24
Cc1c(cn[nH]c1=O)F,0.1825
C#CC(=O)CCCC#N,0.2094
COC(=O)C(=O)OC=N,0.208
CC1CC(=O)C=CN1,0.1884
CCC1C(C)N1C1CC1,0.2959
CC1NC(=O)CC1(C)O,0.2703
N#CC12CC(C1)(O2)C#N,0.2483
COC1CCC(=O)C1,0.2205
C(c1c(c([nH]n1)N)N)O,0.2159
OC1(C#N)C2OC1C2=O,0.2311
CC1OC2CC11CCC21,0.2992
CC1C2CC(=O)C1C2=O,0.2055
CC1C2C3CC3(C)C12,0.3481
Cc1ccc(o1)N2CC2,0.2218
Cc1cocc1OC=O,0.2301
CC(C=O)C1=COC=C1,0.2052
O=CC1CC2C3NC3C12,0.2302
CCC1=CC(=N)C=NO1,0.1825
CN=CN1C=NCC1=O,0.223
c1cnc(=O)nc(n1)O,0.1493
CC1(CO1)C#CCCO,0.2783
CC1C2C(=O)N(C)C12C,0.2477
Cc1cn[nH]c1CCO,0.2513
CC1OC2CC1C(=O)C2,0.2222
COC1CC2CN2C1,0.3009
O=CC12OC3CC1OC23,0.2022
c1cnc(oc1=O)O,0.196
OCC1C2CC(O)C1O2,0.3087
CC(=N)OC1CC1C#C,0.2752
CC12C3C4C3(O)C1C24C,0.2909
OC1C(CC1=O)N1CC1,0.2187
OC(CC(=O)C=O)C#N,0.1568
CC1N(C)C1(C)C,0.2917
c1c(oc(=O)c(=O)o1)F,0.1724
CCC1CCC=CC1C,0.2683
OC1CC(=O)C1CC=O,0.2117
C1OC11C2C3C2N2C3C12,0.2908
CC1=NC(F)=NC(=N)O1,0.1918
c1nc(no1)C(=N)N,0.1985
CC1CN2C1C2(C)C#N,0.2757
CC(O)(C=O)C1(C)CN1,0.1961
C#CCC1OCC11CC1,0.291
CC1(C)C2C3CCC1N23,0.3066
OC(C#C)C1OCC=C1,0.25
CC12CC1C1C=CCC21,0.2626
CN=C1OCCC1O,0.2781
C1CC=C(C1)CCCO,0.2592
CC1CCC(=N)OC1,0.2762
CC1C=CC2CC12C=O,0.2184
CC1COC2=CON=C12,0.2167
OC1CC(C1)C(=O)C=O,0.1548
C1CC(C1)C1CN=CO1,0.2707
CC(O)CC1CC2OC12,0.3193
CCN1C2CCC12C#C,0.2707
CC1C2(CO2)CC1(C)O,0.3268
O=C1OCC2(CC12)C#C,0.2533
O=CC1N2CC1(C2)C=O,0.1872
CCCC1NC1C1CN1,0.3012
COC(=O)C1(CO)CN1,0.2563
C1CC#CCOCOC1,0.259
CC1CC11C2C3CC1C23,0.3311
O=C1OC2CC3C(C2)C13,0.2715
OCC1COCC1CO,0.3117
N=C1OC(C=O)C1C#N,0.2151
CC(O)C1CC(C)C1C,0.3226
CC1(C)CCC=CC1O,0.2563
C#CC#CC(=O)C(=O)N,0.1497
OC1(CC#N)C2CCC12,0.2901
COC12CC3C1CN3C2,0.2951
Cc1c([nH]c(c1O)N)C,0.2283
CC1OCC11COC1C,0.3143
CN1CC1(C#C)C#N,0.2494
CC(O)C1C2CCC1O2,0.3085
CCN=C1OC2CC12O,0.2597
C1C2NC2C2=CON=C12,0.2367
NC1=C(OC=N1)C1CN1,0.2092
CC1C=C(C)C(O)C1=O,0.2236
CC1CC2OCC3C1C23,0.316
CC#CCCCC(=O)N,0.2725
N=C1N=CC=CN1C=O,0.1573
OCC1C2CC(O)CC12,0.3087
CC1(CO1)C1CCOC1,0.3225
CC1OC11C2CCC1O2,0.3344
CC1=CC(O)CC=CC1,0.2431
CCCCC(CC)C#C,0.3129
CCCC1(OC1C)C=O,0.2189
N#CC1CC2C3NC3C12,0.2742
OC(C=O)C#CC1CN1,0.1995
CC(CO)C1(C)OC1C,0.3207
CC12CC1C1OC1C2=O,0.2035
O=CC12OC1CCC=C2,0.2166
CC(O)C(O)COC=N,0.2834
CN1CC11C2CC1C2O,0.3048
CCC12NC1CC1OC21,0.3017
C1CC1C1CCO1,0.3288
CC1OC2C(O1)C2C#C,0.2751
OCCC1CN2CC12,0.3072
CC1CC(=O)C2CC12C,0.2258
CC1(CC(O)C=O)CN1,0.224
C1OCC23COCC12N3,0.3256
OCC1CCC1C=O,0.2244
Cc1[nH]c(c(n1)O)NC,0.2232
CC12OCCC3CC1C23,0.3081
CC(C)C1C2COC12C,0.3069
NC12C3OC1C3C2C#N,0.2651
CC(C)OC=NC,0.2738
OCC1CC1C#CC#C,0.2177
CCC(CCOC)C#C,0.3003
CC1C2C3CCC2C13,0.3864
CC1(O)C2CC1(O2)C#N,0.2626
c1cnnn2c1ccn2,0.1667
C#CCCC1(CO1)C#C,0.2777
CNC(=O)OCC(C)O,0.2925
CCC12CC3C(C1C)N23,0.3059
C1C2C3CC4OC3C4N12,0.3065
NCC(N)(CCO)C#N,0.2874
C1CCCC=CCC1,0.2592
CC12C3C4C3C(=O)N1C24,0.2225
CC1C2CC2(C=O)N1C,0.193
CCC1CC(C)(C)C1=O,0.2155
N=C1NCC=CN1C=O,0.2164
CCC(C)(CC)CCO,0.3317
CCCCC#N,0.354
CC1OC2C1C(O)C2=O,0.1896
COC1=NC(=N)ON=C1,0.1708
O=CC1=CC2CCC1C2,0.1913
Cc1[nH]c(c(n1)N)C=O,0.1704
CC1C2C3NC3(C)C12C,0.3289
O=C1NC=C(O1)C1CO1,0.2229
C#CC1CC2(COC2)O1,0.2659
OCC1(CC2CO2)CN1,0.305
CC1CC23CC4C2C1C34,0.3578
CC(CO)C(O)C1CN1,0.2934
COCC#CC(C)OC,0.282
CC12OC3C(OC13)C2O,0.2845
c1c(noc1N)C2CC2,0.2323
CCCC(C=O)C(C)O,0.2183
N=C1NC2=C(CCC2)O1,0.2269
CC12CC1(C=O)C1NC21,0.2129
ON=C1C(O)CC1C#C,0.2423
O=CN1C2CC(=O)CC12,0.2237
C1CC11OC2COC1C2,0.3167
CC12C3CN3C1CC2O,0.28
CC1OC(=O)C11CO1,0.2573
OC1CC(=O)NC1C=O,0.2145
CCC1=CC2CC3C1N23,0.2174
C1CC2C3OC3C2=C1,0.2395
CC1N=COCC1C=O,0.2122
CC1CC(O)CN2CC12,0.2893
Cc1cc(=O)occ1N,0.16
C(COCCO)C#N,0.3014
O=CC1C2CC(=O)N12,0.1958
CCC(CC)C(=O)OC,0.2818
OC1C=CC(C#C)C1O,0.2424
OC(C#N)C1(CO1)C=O,0.221
Cc1c(c(c[nH]1)N)NC,0.2306
CCC12CC3NC1C3O2,0.3063
CC1(O)CC2CC12C#C,0.27
OCC12C3C4C3N1C24,0.2799
N1C2C3C1C1N=C3OC21,0.1366
CC(=O)C1OCC1=NO,0.2113
N#CCCC1C2CC1C2,0.3432
CN(CC(O)C#N)C=O,0.2539
C1C=CC2C3OC1OC23,0.2418
O=CC1CCC(=O)N1,0.2077
N#CC1CC2CC3C2C13,0.3106
CC12OC3CN4C(C14)C23,0.2893
CC(=O)n1cn[nH]c1=O,0.2019
CC1C2C3(C)OC1C23C,0.3104
C(C1CO1)N1C=NC=N1,0.2681
CN(C)c1coc(=O)o1,0.2423
CC1=CC2C3CC1(C)C23,0.2357
CN(C)CC(=O)COC,0.2038
CC1=NNC(=N)C(F)=N1,0.1597
CNC(=O)CC(O)C#C,0.2531
OC12CC1NCCC2=O,0.1995
CCC1NC(C#N)C1N,0.2636
COCCC1NC1C#N,0.2735
CCN=C1COCO1,0.2747
CC(OC=O)C(F)(F)F,0.2849
CN1C2(C)CC(=O)C12C,0.2101
CC1(Cc2n1ccn2)C,0.2586
N1C2C3OC4OC3C2C14,0.2916
CC12CC1(CC#N)CC2,0.2952
CN1C2CC2C1CC#N,0.2506
CC(CCC#C)C=O,0.225
CC(C)(C)C(=O)NC=N,0.2379
CC12COC1CC(=O)N2,0.273
NC1=NC(=O)NC(=N)N1,0.2348
CC1=CCC(=N)NC1=O,0.2038
CCC1=C(CCCC1)C,0.251
CCCCc1ccon1,0.2551
CC1C2C3N2CC1C3=O,0.2181
CN1CC23OC(C12)C3=O,0.2075
OC12CC34N=CN(C13)C24,0.2134
CC1OC(=O)CC1=O,0.2105
OCC(=[NH2+])NCC([O-])=O,0.2493
COC1(C)C2CC1(C)C2,0.3365
OC1C2OC2C1NC=O,0.2701
c1cnoc1CCC#N,0.2435
CC1(C)CC11C2CC1O2,0.3077
CC1C2CC3OC3CN12,0.2997
CCCC1(CC1)O,0.3264
C(C1CN1)C1=CNN=C1,0.2578
CC(C)COC=O,0.2866
Cc1cc(oc1)NC=O,0.197
N=COCC1C2CCC12,0.2816
CC1CN=C(O1)C#C,0.2174
C1CNCC(=O)C=C1,0.1632
OC12CC3C1OCOC23,0.3194
c1cnoc1NC=N,0.2076
CC1C2CCC(C)CC12,0.3285
CCC#CCC(C)(C)O,0.289
CC1=CC(O)C2NC2C1,0.2595
CC1C=C(C)CC1C#C,0.2586
C1CC1COC(=O)N,0.322
COCCCC(=N)OC,0.2836
CC(O)C1=NC=NN1C,0.2623
CC(NC=O)C1CCC1,0.2799
CCC#CC1NC1CC,0.2766
N=C1OCCC=C1C=O,0.1782
N#CC1OCC2CC2O1,0.289
CC1OC(C)C11CCC1,0.3165
O=C1CC2CC=CC12,0.2087
Cc1ncc(o1)N=CN,0.178
CC(CC#C)C(=O)C=O,0.1528
N=C1OC(C#N)C1C#C,0.2657
CCC1(O)CCC1C#C,0.301
OCCC12CC1C1CC21,0.2839
COC1OCC(=O)C1C,0.2222
C1OC2CCC3CC12O3,0.3089
O=CC1=CC2CC2CC1,0.1945
CC1=NC(=N)NC(F)=N1,0.1942
NC(=O)NCC1CC1O,0.2604
OC1CC2(O)CC12,0.3193
CC1(C)C(O)C(=O)C1O,0.2188
CC1=CC(CC1)N1CC1,0.2544
OC(C=O)C1CC=CC1,0.2069
OC12CC1N1C(C=O)C21,0.1948
CC12COCC1N2C=O,0.2566
C1CN1C1C2C3C1CN23,0.3204
CC(C)(O)C#CC1CO1,0.2696
CC1(O)CC11CN=CO1,0.2584
CCCCC(F)(F)F,0.417
CC1CN=C(N)C(=N)O1,0.2021
CC1(C=O)N=CNC1=N,0.2092
c1coc2c1cncn2,0.1997
CC1CC1C(CO)C#N,0.305
C#CC1OCC1N1CC1,0.2645
CC1CC11CC(C1)C#N,0.3089
O=C(CCC#N)C1CN1,0.2276
OCC#CC(O)C1CC1,0.2838
O=CC1CCC(=O)NC1,0.2091
CC1C=C2CC3(O)C1C23,0.1759
CCC1(O)C2CC1(C)C2,0.3236
CCC(C)(O)C(=O)C=O,0.161
CC1NC11C2OC2C1C,0.3144
CC(C)CC1CCCC1,0.371
CC12CC1(O)C1CC2O1,0.2883
CC1C2CC3N2C13C=O,0.2099
N=C1C=NC=CN1C=O,0.1437
OC1C2CN3CC3C1O2,0.2703
CC1CC1C1CC(C)O1,0.3294
OCC(C=O)C1(O)CC1,0.2152
c1c(ncc(n1)F)CO,0.2052
CC12CC(C1)OC2C#C,0.2783
COC1CC1C(O)C=O,0.2132
OC(C#C)C1CN=CO1,0.2648
CCCCC(=O)C#CC,0.2089
CC(=NO)CCCCO,0.2558
CCC1(CC1OC)C#N,0.2908
CC1C=CCC1(C)O,0.2612
OCC12CC(C1)C1CC21,0.3255
CN=C1NC(F)=NC=N1,0.1802
CNC(=O)C(C)COC,0.2756
Cc1c(n(c(n1)C)C)O,0.2327
CC1(C)C2CC1C(=N)O2,0.2841
c1c([nH]cn1)CN2CC2,0.2492
CC(C)C#CC1CC1,0.2806
Cc1c(nno1)N,0.1986
N#CC1CCC=CCC1,0.2568
COCCC1(O)CC1O,0.2872
CC12C3CC3C3C1OC23,0.3198
OC1C=CCCC11CO1,0.2576
CC(=O)C1OCC11CO1,0.2199
C1CC1(CO)O,0.306
CC12C3CC1=CCC23O,0.182
CCCc1nc[nH]n1,0.2682
OC12CC(C=C1)C21CN1,0.2415
C#Cc1coc(n1)N,0.2031
CC12OCOC1C1CC21,0.3352
CC1CCC(=O)C2NC12,0.216
COC1(CC1C)C1CN1,0.3242
CC(O)C1(OC1C)C#N,0.2835
NC1=C(O)N=CC(=N)N1,0.1297
CCCOCC#CC,0.2841
CC1CC1C1CCOC1,0.3178
OCC1C2C1C1OCC21,0.3093
CC(C)C(O)C(O)C#C,0.2812
Cc1c(c[nH]c1N)NC,0.2287
O=CC(C#N)C1CCO1,0.2165
CC1OCC2CCC1C2,0.3185
CCCC1(O)CC1C#C,0.2874
C(=O)n1c(c(nn1)N)N,0.1735
COC1C2CC1(CO)O2,0.3076
CCCCC(=O)N,0.2788
COC1CC(=O)C=C1C,0.192
CCCC1CC2C(C)C12,0.3283
CCC1CCCC11CO1,0.3274
CC1(C)CC(=O)CC1O,0.2199
CC1CCN2CC2C1O,0.2803
OC(C=O)C1=NON=N1,0.2132
Cn1cc(c(c1)N)N,0.2254
OC12CC1(O)C1NC21,0.2854
CCCc1c([nH]cn1)C,0.2434
CC1N2CC(C)(O)C12C,0.2863
c1c(nc[nH]1)C#N,0.2339
CCCC(O)C1CC1,0.335
CC1NC2(CC12O)C=O,0.1941
OCC1CC(=N)O1,0.2869
C1OC23C=CC4C2CC134,0.2098
CC1CCC(C)(O)C=C1,0.258
CC1C2N1C1CC21C#N,0.2495
C1OC2CC1N=COC2,0.2688
Cc1c(c(ncn1)C)F,0.214
CC(CCCC#C)C#N,0.3041
CC1COCCCO1,0.3258
COC1CC2OC2C=C1,0.2434
CCC12CC(C)(C1)C2O,0.3161
CC12CC1C1OCC21C,0.3054
OC1=NC(O)=NC(=N)N1,0.2071
C1C=CC2OC1C=C2,0.2324
CC12CC1C1(CO1)CC2,0.3324
CC(C)(O)C1C(O)C1O,0.3017
CC(C)CCOC(=O)C,0.2847
O=C1CC2CC1CC2=O,0.2168
N#CC12CNC1CO2,0.2431
CC1(CN1)C(CO)C#N,0.2865
CC(CC#N)N1CCC1,0.2583
OC1C2C3CC3CC12O,0.2975
C#CC(CO)(CO)C#N,0.2803
O=CCC1C2C3NC3C12,0.2021
CNC1CNC(=O)C1=O,0.1622
CC#CC(C)OCC=O,0.2247
CC1C(O)CC1C(N)=O,0.2507
OC1C(C#C)C1C#N,0.272
[NH3+]CCC1=CC=C([O-])O1,0.1632
CC(=O)OC(CN)C#N,0.2573
OCC1CC(=O)OC=N1,0.2325
OC1CC2(CC=O)OC12,0.2207
OC12COC1C21CCC1,0.2842
CC1OC11C2NC2C1C,0.3032
O=CC1C2CC2N1C=O,0.2033
OCCN1C2CC=CC12,0.2324
ON=C1C=CC2CC1O2,0.1899
CCC(C)C(C)C1CC1,0.3603
O=C1C2NC2CC11CO1,0.2034
C1CC23OC2CCCC13,0.3315
CC1=CC2C3OC1(C)C23,0.2285
CC12CNC1(C)C(=N)O2,0.2552
C#CC1COCC2OC12,0.2996
NC1COC2=C1ON=N2,0.1843
CN1C2C=CCC(=O)C12,0.2091
CCC(O)C1CN1C=O,0.2509
OCC1(OCC1O)C#C,0.2628
CC1(CC1C=O)OC=O,0.2258
CC1CC(O)C2CC1O2,0.3121
C1C(=CNC1=O)CC#N,0.2103
Cc1c(=O)cnon1,0.1676
CC1COCC(=O)C1C,0.209
CC(N)C1(CCN1)C#N,0.2596
C(C1CC1)C1CC2OC12,0.3386
CC1COC(=O)N1C=N,0.2477
CC12CC3C=CCC1C23,0.2563
CNC(C)(CC#N)C#N,0.2687
Cc1cc(on1)C(=O)C,0.1943
OC1C(O)C1OC1CC1,0.2899
CC1C2CC(C)C1C2C,0.3678
CC1=NC23CC2(CC3)O1,0.2344
C#CC(=O)C1=CCCC1,0.1804
NC(C#N)C1(CN1)C#N,0.2749
OCC1C2OC(C#C)C12,0.2558
CC1C2C3CN3C1C2C,0.315
OC12CCC(CC1)C2,0.3251
CCOC1CC(C1)OC,0.3221
OCC12CC1CC=CC2,0.2661
O=C1NCC23CC12CO3,0.2518
CC1COC(CC#N)=N1,0.2612
C(CO)C(=O)NC(=O)N,0.2431
NC1=C(O)N=NNC1=N,0.1487
CC12CC3C4C(OC14)C23,0.315
c1c2c([nH]n1)CCCO2,0.2278
CCCC(C)(C)CCO,0.3345
N=CN1C=NCCC1=O,0.2272
CC12CC1(O)C1(CC1)O2,0.2906
CNC1=C(N)OC(=N)O1,0.2341
CC1(C)CC1(C)C=O,0.2234
CN1C2CC1C(=N)OC2,0.25
O=C1C2OC3CC1CC23,0.2014
COC1CNC(O1)=NC,0.2805
CCC12CC3CC(C1)C23,0.3358
Cc1cn2c(n1)onn2,0.1804
CC1C2OC3CC2(O)C13,0.3075
COC(C)C1CC(=O)O1,0.2795
C#CC1(CC1)CCCO,0.2956
C1CC1OC(=O)C(=O)N,0.2057
CC(C)C1CC1(O)CO,0.3125
CC1(C)C=CC(O)C1=O,0.2188
C#CC1C2C3NC3C12,0.2507
CCCOc1ncno1,0.2574
O=CC12CCC(CC1)C2,0.2275
OCC(NCC#C)C=O,0.2203
CC1CNC(=N)NC1=O,0.2293
C1CC1(C=O)C(=O)C#N,0.1778
CC12CC1C(=O)C=CC2,0.1898
COCCCCCC=O,0.2291
Cc1nc(nc(=O)o1)O,0.22
CC1OCCC2CC12C,0.3256
Cn1c(cc(n1)OC)N,0.243
COC1OCC(C)=C1,0.262
COC1C2CC1(C2)OC,0.3349
CC1(O)CC1(C)NC=O,0.2705
CC1CC(C)(C1)C=O,0.2282
OCC1C2CC(C=O)C12,0.2049
CC1=CCCCCCC1,0.2544
CC1C2OC=NC12CO,0.2505
CC1N2C3CC=C1C23,0.1746
CC(CCC=O)C#N,0.2278
CCN1CC1CCC=O,0.2069
CC1C(O)C2N1CC2=O,0.2025
CC(OCC1CN1)C#C,0.2821
CC1C2CC3(C#N)C2N13,0.2748
C1OC11CC2OC2C1,0.347
CC1(O)C2NCC(=O)C12,0.196
CC1CC(=NO)C1(C)C,0.2521
CC12NC1CC21CCO1,0.3017
C#CCC1=CCCCC1,0.2592
CC1OC11CCC=CC1,0.2681
NC1=NC(OC=N)=NO1,0.2367
CC1CCC1(C)CC=O,0.2241
O=C1CCCC2(CO2)C1,0.2241
CN1C2CC=CC(=O)C12,0.1774
CN1CC(N2CC2)C1=O,0.2477
CC(=O)CC(C=O)C#N,0.2196
CNC(=O)C1COC1=N,0.2606
OCC12CC3CC(O1)C23,0.3023
C1CC23NC12CC=C3,0.2135
C1CC=CC(=O)C=CC1,0.1816
CC1=CC(=O)NC1=NC,0.1846
OCC1(CO)CN2CC12,0.2815
N=C1NC=CC(=O)C1=O,0.1321
c1c[nH]c2c1CC=CC2,0.2256
OC12C3C1N1C3C21C#C,0.2289
CC1CC2C(O)C2O1,0.3089
C1CC1(C(=O)N)C(=O)N,0.2549
CCC#CC(C)C#C,0.2883
COCc1c([nH]nn1)N,0.2279
CC1OC=NC1C#C,0.2696
CCCC1CO1,0.3582
CC1C2CC(CO)C12O,0.292
O=C1CC2CC2NC=C1,0.1817
c1nc(on1)OCC=O,0.2232
CC12CCCC1C2CO,0.3165
CC(=O)c1cnoc1N,0.1974
N#CC#CC1CCOC1,0.2318
c1c(c(=O)oc(n1)O)N,0.1637
OC1CC1(O)C#CC=O,0.194
OC12CC3C1C1CC2N31,0.2864
N=C1OC2C(OC12)C#C,0.2601
OC1(C#N)C2CCCC12,0.2869
O=C1OC2CC3C(O2)C13,0.2687
N=C1OCC2CN3C2C13,0.2535
CCC(C)C(OC)C#C,0.2892
CC1C(=O)C2(C)OC12C,0.2114
NC(=O)C12NC1C1OC21,0.2296
CCC1(CC=O)CN1C,0.2075
CC1C2CC(C)(C2)C1C,0.3614
CN(C)C(CO)C#N,0.2716
C1C2CC=CC3CC2C13,0.2515
CC1C2OC3CN(C3)C12,0.2862
CCN1CC2OCCC12,0.3004
CC1CC(CO)C(=O)C1,0.2193
Cc1c(oc(=O)[nH]1)NC,0.2367
COC1C2NC2C1O,0.2992
CC1C(O)C11COC=N1,0.2488
CC12C=CC3(O)C1OC23,0.218
OC1CC11CNC(=O)N1,0.2929
CC1C(CNC1=O)C=O,0.212
C1CN=CN(C=N1)C=O,0.2114
CC1CC2CC(=O)CC12,0.2218
CN1C2C3CN3C(=O)C12,0.2087
CC12CC3(C#C)C1OC23,0.2686
ON=C1COC1C1CO1,0.2465
COC1C2CC(C#C)C12,0.2911
CC(C)NCC(F)(F)F,0.3025
CC(O)C(C)C1CO1,0.3261
N=C1C=NOC=C1C#C,0.1704
CC(C)(C#C)NC(=O)N,0.2889
CC1OC2C1C2(N)C#N,0.2682
N#CC1CC2(NC12)C#N,0.2572
C1CC(O1)C1OCCO1,0.3165
CC1C=CC2NC2C1=O,0.2084
OC1C2C3CC1(O)C23,0.3163
c1[nH]c(=O)c(c(n1)N)N,0.1712
c1cc(=O)occ1F,0.1683
CC1=CCC(O)COC1,0.2504
C(CO)N=C(C=O)N,0.1825
OC1CC2CC2C1=O,0.2117
CC1(CO)CC1(C)C=O,0.2212
CC(C=O)C#CC#C,0.2028
CC1(CC2NC12)C#N,0.2849
Cc1c(cnnc1F)F,0.1954
CC1(C)C(O)CC1C#C,0.3009
CC1CCNC1(C)C#N,0.2708
CC12C3CC1(O)C(=N)N23,0.2721
CC(=O)C1C2NC1C2O,0.2285
CC1OC(=N)C1C(N)=O,0.2611
CC1OC2CC(C)=CC12,0.2562
CC(O)CC1C2CC1O2,0.2915
c1c(oc(n1)CC#N)N,0.2129
O=CC#CC1CC2CN12,0.1844
OC1CC(O)(C1)C#N,0.2777
C1C2C3CC1OCC23,0.313
OC12CC1OC2C1CO1,0.2987
CC(C)C(=O)NC=O,0.218
C1C2OCOC3CCC123,0.3297
CN1CC1C(C)(N)C#N,0.2563
CC1(CO)OCC(=O)O1,0.2699
CCN1CC1C(C)(C)O,0.2874
CC1(COC2CC12)C=O,0.21
CCCC1CCCC1O,0.3295
CC1(CC1)C1CCC1=O,0.2198
CCCC1(CCO1)C#N,0.2833
COc1c(n[nH]n1)CO,0.2286
CC1C2CCC2(O)C1=O,0.2202
C1CC1CC(=O)CCO,0.2284
O=C1OCC2CC3C1N23,0.2541
CC#CCCN(C)C=O,0.2674
CC(=O)C12CC3CC1N23,0.2175
c1cc(oc1)OCCO,0.2311
O=C1OCC11C2COC12,0.253
OC1(C=O)C2C3CC3C12,0.1888
COC(C#N)C(C)C,0.3036
CNC(=NCC=O)C#N,0.1926
N=COC1=CN=CO1,0.2329
C1C2CCC3C=CC2C13,0.2452
OC1C2CC=CC12C=O,0.2171
C1C2OCC3OC3C12,0.3349
CN1C2CCC1(C)C2=O,0.236
CC1C2C3N1CC23O,0.2889
C(CO)C(=O)C#N,0.1989
CNC1COCC1C#N,0.2528
O=CC(CCC#C)C#C,0.2197
CC1=C(CCC1O)C=O,0.1903
N#CC12C3NC1CNC23,0.239
Cc1cccnc1C#C,0.1973
CC1NC(C)C(=O)C=C1,0.1769
NC(=O)C(O)CCC#N,0.2792
CCC(C)C1=NOC=C1,0.2546
OC1CC11OCCC=C1,0.2417
CC1(C)CCCC1(C)O,0.3206
C#CC#CC1CC=CC1,0.2295
c1cc2n(c1)CC(=O)N2,0.1916
C1CNc2c1onc2N,0.2139
CC12CC3N1CC23C#N,0.2701
CN=C1OC2(CO)CC12,0.271
c1cc(c(c(c1)F)O)N,0.2133
O=C1C=C2C=CC3C1C23,0.1631
C1OC11C2COC1OC2,0.3369
OC12CC1CC2(O)C#N,0.2871
N#CC1C2NC2C11CN1,0.2675
C1OC23C=CCC2NC13,0.2209
CC(C)(CCCO)O,0.3233
NC1C2C3CC1(C#N)N23,0.2492
OC12CCCC1CC=C2,0.2597
CC12OC1CC21CC1,0.3304
C1CC1CCOC2CC2,0.3365
NC12CC1OC2=O,0.2484
N=C1OCCNC11CC1,0.2529
CC12CC3CC(C1)C3O2,0.3302
CC(C)C(C#N)N1CC1,0.2829
CC1OC1CC(O)CO,0.328
OC1C2C1C1OCOC21,0.3211
CCC1CC=C(C1)C#N,0.22
C1CC(O1)C1C2CN1C2,0.3016
CC(=O)OCC1CC1O,0.2338
CN1CC1CC1CO1,0.3144
OCC(O)C1C2CC1C2,0.3182
OC1CCC2CC3C2C13,0.3236
CC1=CCOC1=O,0.2313
CCOC1(C)CC2OC12,0.3302
CC(=O)Cn1cccn1,0.2096
COCc1cncnc1,0.2102
OC1C2CC1(CO2)C=O,0.2103
c1cc([nH]c1)C(=O)C=O,0.1445
CC1CCC(=O)CN1C,0.2049
C#Cc1cnc(o1)CN,0.1994
CC1OC2(CCO)CC12,0.3082
Cc1cn(c(n1)C)C,0.2414
CC(O)COC1CCC1,0.3355
CC1C2C(=O)C1C2(C)O,0.2544
CC1=CC(O)C2OCC12,0.2548
C1C2C3CCCC1OC23,0.2949
N=C(CC=O)OCC#C,0.2316
CC12C3C4CN1C2C34O,0.2937
O=C1OC2CC2O1,0.3229
CCC1=CCOC1C#C,0.2522
CNC1=NC(=N)OC=C1,0.1816
CC1CC(C)=CC1=NO,0.1919
c1c[nH]c(c1C=O)CO,0.1931
C#Cc1c[nH]c(n1)C#N,0.1937
NC(=O)N1C=NOC1=N,0.2308
OC12CCC(C1)C=C2,0.2578
COCC12CC3CN1C23,0.3217
CC1C(C#N)C1N(C)C,0.2606
OC1CC(CC=C1)C#N,0.2657
CCC#CC(O)COC,0.2859
CCOC(=N)C(C)C#C,0.2915
CC1OC(=N)C2CC12C,0.2783
COC1CN2C3CC3C12,0.2788
CCC(O)C12CC1OC2,0.2993
CN(C1CC1O)C(N)=O,0.2777
COC1C(C)C11COC1,0.3095
N=C1NCC2OC12C#C,0.2352
CCOCCOCC,0.3363
COC(C)C(C)C1CO1,0.3369
CNC1=NC(=N)OC=N1,0.1807
FC1=NOC(=N)N=C1,0.1563
CN=C1NC=CN=C1O,0.1543
OC1(CC1)C(C=O)C#N,0.2201
CC1=CC(F)=NC(=N)O1,0.1782
Cc1coc(=NC)o1,0.2326
CC(O)C1=CNC=C1O,0.2347
O=C(C#N)C(C#C)C#N,0.1926
Cc1cc(n(n1)C)C#C,0.2111
CC1(O)C=CCC1=O,0.2151
C#CC1=CCCC1=O,0.187
COC(C#N)C1(O)CC1,0.2811
COC1CC(C1)C(C)C,0.3281
OC12CC1(O)CCC2,0.297
Cc1c(n(c(n1)O)C)N,0.2449
CC1(CO)CC(=O)CO1,0.2211
OC1C2CCC(=O)C1O2,0.2081
CC1=CC2CC=CC2C1,0.2567
CCC1=NC(C)C(=O)N1,0.2333
CN1C(=N)C=NC=C1O,0.1587
C1CC(=O)C2(CC2)OC1,0.2117
C#CC1(CC2(C1)CC2)O,0.2878
O=CNC1CC1C1CO1,0.2684
C1C=Cc2n1c(=O)[nH]n2,0.1732
CC1=NOC(N)=CC1=N,0.1801
OC1CCOC(=N)OC1,0.2947
NC12C(CO)C1OC2=N,0.2418
CC1CC2(C)OC2C=C1,0.2404
C#CCC1CCC=C1,0.2631
COC1OC(C=O)C=C1,0.2069
CC1C2OCCC(=O)C12,0.2197
C#CC12C3C4C3N1C24,0.2335
OC(CC1COC1)C#N,0.2578
CN1C=NCC1=N,0.2182
CCCC#CCOC,0.2836
c1c(=NO)cn[nH]c1O,0.155
C#Cc1cc(n[nH]1)C=O,0.1963
N=C1CC(O1)C(=O)C#C,0.1948
CC1CNC(C=O)=NC1,0.17
CC12C3OC1C3C21CC1,0.3198
CC1=CCNC(=O)C1O,0.253
OCC1(O)CC1OC=O,0.2581
CN1CC2(C1)CC(=O)N2,0.2612
COC1(C)C2CCC12,0.3252
COC1CCC=C1C=O,0.1876
CC(O)C1=C(O)N=CO1,0.2165
OC1CC2NC(=O)CC12,0.2739
C(CO)NC(=N)NC=O,0.2104
CC12C3OCC11CN2C31,0.3105
CCC(C)(C)CCCO,0.3366
C1COc2c1nc([nH]2)O,0.2379
C1CC12COCOC2,0.3439
CC12CC(C3CC13)C2O,0.3201
OC1C2C3C(C=O)N2C13,0.2137
CCC(C)(O)CC1CO1,0.3195
CCC1CC(C)C1=NO,0.2481
CC1CC2=NNN=C2N1,0.2079
CC(O)C1CCCCO1,0.3314
CC12CC1(O)C=CCO2,0.2297
N=C1OC(=CC=N1)C#N,0.1463
CC(O)(C1CO1)C(N)=O,0.2735
N=COC1C2NC1C=C2,0.2234
CCC1=CCC(=O)N1C,0.2078
CCC12CC(C=C1)C=C2,0.2163
CC1C2CC1(C)N=CO2,0.2619
C#CCCOCCC#N,0.3005
C1C2OC2C2=COC=C12,0.2362
Cn1c(cnn1)N,0.2368
COC1CC(C)C11CN1,0.3144
N#CCC1CC1CC#N,0.3317
Cn1cc(nc1)CC#N,0.2516
O=C1CC2OC(O1)C=C2,0.247
N=C1NC2=C(O1)C=CN2,0.2105
CC12C3C4C3C1(C#N)C24,0.2543
COCC1OCCC1C,0.32
COC=NC12CC(C1)C2,0.2614
CCC12NC1(C)C1NC21,0.3218
CC1CC(=NO)C1O,0.2454
N#CCC#CCC1CO1,0.2861
CN=C(C#N)N(C)C,0.1924
CC1CC2OCC2C=C1,0.2552
C1C2OC1C1=C2NN=C1,0.2363
CC1CCOC(C)C1,0.331
CCC(COC)C#CC,0.3051
N#CCC1CC2OC12,0.3065
COC1CCCCCO1,0.3306
OC12CC1(COC2)C#N,0.2773
CCC(=NO)CCC#N,0.2509
N=C1CC(O1)C#N,0.2768
CC1CC2OC(C=O)C12,0.2164
Cc1cnc(c(n1)O)F,0.1956
CC1=CC=C(COC1)C,0.1841
CC1CC(C)C(O)CO1,0.3213
Cc1c(c(oc1O)O)C,0.226
CC1(CC#C)CO1,0.3065
CCC(O)C(C)(C)O,0.3123
CC(C)(O)C1C2CCN12,0.282
CN(CC#N)CC1CN1,0.2601
C1C2C3C4CCC2C1N34,0.3062
OCC12CC3C(C1)C3O2,0.3192
CC12NC(=N)OC1C2O,0.2736
CC(C)(C)C(CO)C#C,0.3156
C1COCCN1C=O,0.2638
c1cnc(nc1C#N)F,0.1963
CCC(CC)C(O)C#N,0.3091
COC1CNCC(=O)O1,0.2378
CCN1C2COC(=O)C12,0.244
CC1C(CO)N1C(C)=O,0.2489
O=C1NC2CCCC12,0.2785
OC1C2CCC1C(=O)C2,0.2187
CC1C(O)C11CC2CC12,0.3002
C1OCC11C2CCCC12,0.3071
CCC12NC1C1CC2O1,0.302
O=C1CC(CCN1)C#N,0.2625
C1CC(=O)NC=CC1=O,0.1839
N#CC1C2CC1CCC2,0.3258
O=C1C2CC3CC1N23,0.2149
Cc1cc(c(n1C)O)N,0.2168
CN1C2CC3OC3C12C,0.2833
COC1CC(O)CC=C1,0.2616
C1CN1C(=O)NCC#N,0.2718
CC12CC(C=C1)C2=O,0.2463
N#CCOC12CN(C1)C2,0.2666
OCC12C3CC1CC23O,0.3059
OC1C2C3CN3C(=O)C12,0.2356
N=CN1CC2(CN2)C1=O,0.2187
CC1N2CC(=NO)C12C,0.2289
C1C2C3CC1C1OC2C31,0.3086
CC#CC1(O)C(O)C1O,0.2477
OCC1=CC(=N)OC=N1,0.1813
CC1CCC=CC=C1,0.1899
CC(C)C(C)(O)C1CO1,0.3387
CC(O)C1CCC=CC1,0.2667
C1C2C=CC3CCC2C13,0.2482
CC1OCC11NC1CO,0.3051
OC12C3CC1N3C21CC1,0.3094
C#CCC1COCO1,0.304
CC1CC=CC1(N)C#N,0.2437
OC1COC(C1)C#N,0.2908
C#CCN1CC1C1CN1,0.2597
Cc1c(oc(n1)NC)N,0.2276
CCC12CC(=O)C1C2C,0.23
CC1CNC(=O)C(O)C1,0.2639
CCC1C2NC2C1C#N,0.2767
c1c(c(c([nH]1)N)CO)O,0.2146
O=COC1COC11CC1,0.2435
CC12CC1C(=O)C1NC21,0.2033
C1C2CC=CCC12,0.2662
CN=C1COC(=O)CO1,0.2542
CCOC1C(O)C1C#C,0.2691
CCC12CCC3C(O1)C23,0.3049
CC12CC3(C)C(C1)OC23,0.3203
COC1(C)C(O)C1CO,0.288
OCC12CC1OCCC2,0.3147
c1c(nco1)C2CCC2,0.2441
C1CC2C3OCCN2C13,0.2957
O=C1CCC2OC3C2C13,0.2189
OC1=CNC(=N)C(F)=N1,0.1386
CCOC1CC1CCO,0.3237
CC(CC1CC1)C=O,0.2261
O=CC1NCC11CCO1,0.2076
CC1C([NH3+])C1(C)C([O-])=O,0.1367
CC(C)OC=NC1CC1,0.2523
CC1(CNC1=O)OC=N,0.2611
c1cc(oc1)C(=O)N,0.208
CC1=CC(O)CN2CC12,0.2316
CC12CC3C(O1)C3C=C2,0.2413
CC(N=C(N)C=O)C#C,0.187
CCC1NC2C1OC2=N,0.2558
CC1C2NC(=O)C12,0.2534
NC1(CO)CCOC1=O,0.2418
OCC(O)C12CN(C1)C2,0.2819
COC=NC1COC1,0.2511
C(=O)Oc1c(onn1)N,0.2017
CC(=O)C1COC(N)=N1,0.2094
CC1(CC2COC2)CO1,0.3132
CC1C(CO)C1(O)C#C,0.265
CC1(O)C2NC2C1C#C,0.281
CCC1CC2NC12CO,0.2941
CC1CCOC1OC=N,0.2864
CC1COC1COC=N,0.2768
CC1=CC23CCC2C1O3,0.2223
N=C1OC(C#C)C1C=O,0.2213
C#CC(=O)C#C,0.1902
C1CC23CCCC2(C1)O3,0.3385
OC12CC1OC2CC#C,0.2867
N=C1NC(=N)C=NO1,0.183
NC(=O)C(O)C#CCO,0.2605
CC1(O)CC2C3CC1N23,0.2948
CC1NC(=O)C(C)C=C1,0.2491
OCC1C(O)C2CN12,0.2955
c1cnnoc(=O)c1=O,0.1421
CC1N(C=O)C1(C)C=O,0.2135
CC1CC1C1=CON=N1,0.2199
CC(=N)N(C=NC)C=O,0.2257
COCC(C)(O)CO,0.3188
CC1C2C3CN2CCN13,0.2814
CCCOCCC#CC,0.305
CC(C#C)C1OCC1O,0.2906
c1c2c(co1)OCCN2,0.222
CC1CC(=O)N1C(N)=O,0.2504
CCc1c(c[nH]c1O)N,0.2196
CC(=N)N1C2CC2C1=O,0.2286
CC1(C)N2CCC2C1=O,0.2007
CC1(C)C2C3CC1(C)N23,0.314
CN1C(CC1C#N)C#N,0.2462
c1nc(on1)NCC#N,0.2438
CCC1(CC)OC1CO,0.3302
CC1N(C)C(C)(C)C1=O,0.1941
CC1CCCOC1=N,0.2764
c1c-2cncoc2cn1,0.1288
c1(c(c(oc1N)O)N)N,0.2194
COCC(C)O,0.3359
CC1C2CC(CO2)C1=O,0.2215
O=C1OCC2CC12C#N,0.2696
CC(=O)C(=N)NCC=O,0.1858
OCC12NC1COC2=O,0.2515
CNC1=NC2(CC2)CO1,0.2593
CC(=NO)C1CNC1=O,0.241
CC(CO)C#CCCO,0.3041
CNC(=O)C1(CO1)C=O,0.1988
CC12OC(C1O)C21CO1,0.3153
OC1C=CC2CC=CC12,0.2556
OC1(CCCOC1)C#N,0.2765
O=CC12CC3(CN3)C1N2,0.2195
c1c(oc(n1)CO)C=O,0.1926
COC1C=CCC1C=O,0.2272
CC(C)C1(C)C(O)C1O,0.2814
CCC1CC1C(N)C#N,0.2806
CC(NCC=O)C#N,0.219
CC1(O)CCC(=O)OC1,0.2724
O=C1CCOCC1C#N,0.2208
O=C1OC=NC2CC1C2,0.2264
CC1C=C(CC1O)C#C,0.2079
CCC1(C)OC1C#C,0.279
CC(N)C(F)(F)F,0.3237
CCC1(O)C2OC1C=C2,0.2369
c1cnoc1,0.2538
CC1(O)COC(=N)C1,0.2863
O=CC12CCC1OCC2,0.2202
COc1cocc1C#N,0.2097
CCc1cc[nH]c1CO,0.2332
CN=CNc1ccno1,0.2053
CCc1cc(=O)ocn1,0.1973
CC1(C)C2CC1(N2)C#N,0.2667
N#CC1=CC2(CN2)CC1,0.1957
CCC12OC3C4C3C1C24,0.3167
CN=COC(C)C(N)=O,0.2629
N#CCC1CCN=CO1,0.2737
CC1(CN1)C1=NC=NO1,0.2374
COC1CCC(=O)CO1,0.2113
C1C2CC3=NOC=C3C12,0.2338
Cc1cc(co1)CC=O,0.1985
OCC12C(O)C3C1OC23,0.2883
O=C1OCC11CCCN1,0.2365
CC12CC(O1)C1COC21,0.318
Cc1nc(cc(n1)F)F,0.2433
CC1C2CC(C)(O)C12C,0.3145
OC1C2CC3C(O2)C13O,0.2852
O=CC1NC2CC1C2=O,0.1996
OCC12CN3CC1(O)C23,0.2785
OC12CC(CC1)C2C=O,0.2186
N#CC1=NCC2(CC2)N1,0.1888
CC12CC1C(O)C21CO1,0.3078
OCC12OCC1CC2O,0.2884
C1OC1C1CCOCO1,0.3464
CCOC(C)C(=N)OC,0.2689
CC1(C)C2C=CC(=O)C12,0.184
CNC1C2CC2OC1=O,0.2359
CC12C(C=O)C1N1CC21,0.1983
C1C2C3COCCC1C23,0.3139
C#CCc1ccoc1,0.2425
OC(C=O)C1OCCO1,0.2123
CC1C2OC(=N)C(O)C12,0.2693
CC(O)C1(CO1)C#C,0.2791
CCC12CCC1(O)CC2,0.319
COCC(O)C(N)=O,0.281
C1c2c(n[nH]n2)C(=N1)N,0.2038
c1c[nH]c2c1CC(=O)C2,0.189
CCc1conc1N,0.2377
CCOC(=N)C(C)C#N,0.289
CCOc1cc[nH]n1,0.2454
CC1C(C#C)C11COC1,0.2815
OC12CN3C4C(CC14)C23,0.2805
CC1=CC2C3CC2(C3)C1,0.2521
C1C2CC3=COC=C3C12,0.234
CC1(CO1)C1(CO1)C#N,0.282
CC1(COC1)NC=O,0.2742
CN1CC(=N)NC1=O,0.2475
CC12CC3(CO1)OCC23,0.2813
CC1CC2C3OC3C=C12,0.2366
CCC12CC1CC2C#C,0.2991
OC1C2OC2C1CC=O,0.2248
CC([NH+](C)C)C([O-])=O,0.2572
CC1C2CC(C=O)C1O2,0.2195
CC12C(O)C1CC2C=O,0.213
CCC1OC(CC)C1O,0.3022
CCCC1OC(C)C1=O,0.2205
CCOC1C(O)C1OC,0.278
OC1CC(=O)OC2CC12,0.2688
CC1(O)COC(C)(C)C1,0.3002
CC1COC(C)(C1)C#N,0.3001
CC1(C)OCC11CN1,0.3088
CC1=NC=CC(=N)C=N1,0.1638
O=CCC1OC2CC12,0.225
COCC1(COC1)OC,0.3136
Cc1nc2c(o1)non2,0.2162
CNC12C3OC1C(=O)C23,0.2227
C1C2CC1C1=NON=C21,0.2468
CC(O)C1NC1CC#C,0.3046
COC1CC2(O)CCC12,0.3106
CCOC1(CC1)COC,0.3345
COCCc1ccoc1,0.2419
CC(O)C1CC1C(N)=O,0.2655
CC1CN2C1CNC2=O,0.2849
CCC1CNC(=N1)C#N,0.1979
Cc1cc(cc(c1)O)N,0.211
NC12CC1N(C=O)C2=N,0.224
CC(CC=O)CC(N)=O,0.2257
CC#CC#CC(C)CO,0.2266
OCC1NC(=O)C2OC12,0.2509
CC(CC1CCO1)C#N,0.2975
CCC1COC(=N)O1,0.3093
CC1OC(=O)C11CN1C,0.2486
c1ccc2c(c1)COC2,0.2233
CC12CC1C(=NO)C2O,0.2407
CC#CC1(C)CCC1C,0.2982
CN=C1OC(C)C1C,0.2782
C1C2CC1OCCO2,0.3153
O=C1C=CC2NC=NC12,0.1714
COCC1CC2OCC12,0.3174
CN=C(CO)NC(=O)N,0.2397
c1cnc(c(=O)[nH]1)CO,0.175
CC12CC(C)(C)CC1O2,0.3353
CC1C(C)C1(O)CC=O,0.2174
CC1OC2C3NC2C3O1,0.3186
OC1CC=CN(C1)C=O,0.2144
COC12CC3OC1CC23,0.3138
CNC1(CN2CC12)C#N,0.2565
CC1C2C(C)OCCN12,0.2971
CC12COC1(C)C2O,0.2828
CC12CC1(O)C=CC2O,0.241
CCCCCC(=O)N,0.2788
C#Cc1cn[nH]c1C#C,0.1896
OCC(O)C1COC1,0.2916
CCC1NC11CC(=O)C1,0.2162
C#CCOCCNC=O,0.2712
O=C1CC2NC(=O)OC12,0.2049
CC(C)C(C)(O)C(C)O,0.3157
CCC1CC1C1CCC1,0.3435
CCC#CCC(=O)NC,0.2744
OC(C#CC#C)C1CC1,0.2227
C#Cc1c(onn1)CO,0.2061
O=C1CC2CC(CN1)O2,0.2673
CC12C3C1C1C=C2CC31,0.1193
CC(N)(COC=O)C#N,0.2836
CNc1ccn2c1CC2,0.2159
CCOC1COC1C=O,0.2118
CC1(CN1)C1OC1(C)C,0.3134
CCC1(C[NH2+]C1)C([O-])=O,0.2751
OCC12OC(=N)C1C2O,0.2634
CC1OC=NCC=C1C,0.2384
CCC1NC1(C)C1CN1,0.3044
Cn1cc(c(c1)O)N,0.225
CC12CC1C(C)(CO)O2,0.311
CC(O)C1CC1(O)CO,0.3017
CC1C2N3CC3CC12C,0.3023
CC12CC3C1C(C=O)C23,0.2208
CC1CC1(C)C(O)C#N,0.2949
CC1NC1C1(CO)CC1,0.3136
COCC(O)C1CC1,0.3272
CC#Cc1c(cco1)N,0.1826
CCC12C(O)C1CC2O,0.3103
OCC1=NC2CC(C2)O1,0.2682
C1C23CC=CC12CO3,0.2334
CCC1CC1(C)C#C,0.2935
CC1NCC2=NNN=C12,0.2146
CC(C)C(C#N)(C#N)O,0.2901
c1c2c(c[nH]1)OCC=C2,0.1895
OC1CC2CC3C1N23,0.2972
CC(=O)n1cccc1O,0.1591
CCCOC(=O)C=O,0.1809
CC(C)(O)C1NC1C#C,0.2713
c1nc([nH]n1)CC=O,0.2175
C#Cc1cc(oc1)C#N,0.1946
CC1=CC23CC2(C1)OC3,0.2345
O=CCC12CC1CC=C2,0.2141
OCC1CC11CC(O)C1,0.2945
N=C1CC2(CC2)N1C=O,0.2205
CC1CC11C(C)OC1=O,0.2778
O=C1OCCC2CC2O1,0.2922
OCC#CC1COCO1,0.2802
OCC1(O)CCC11CN1,0.2895
CCC1C(CC)C1OC,0.3096
CN=C1OCC=CC1O,0.2533
CCC(O)C1(C)CCO1,0.3023
OC1CCC1(C=O)C=O,0.2022
O=C(C#N)C1CN=CO1,0.1779
CC1C2CC1(O)CC2O,0.3204
OC1C2CC3OCC3C12,0.294
CC#CC1(CN1)C(C)=O,0.2145
OC1CC=C(C#N)C1O,0.2186
COC1CC=CC(=N)O1,0.2163
CC1=CC2OC2C(=O)N1,0.2063
C1CC23CC=CCC12O3,0.267
CC12CC1C(O)C2(C)C,0.3104
CC(C)N1C2CC(=O)C12,0.2085
CC1(C)CCC2COC12,0.3177
OC1C2(O)CNC12C=O,0.1985
CC1=CC2CC2OC1=O,0.2104
CC1(CC(=O)C1)N2CC2,0.2137
OC1=NC=CC(=N)O1,0.1868
CC1CC2C1C2(C)CO,0.323
CC1CC(O1)C=O,0.2124
Cc1cc(=O)c(co1)C,0.2008
OCC12C(O)C1CC2O,0.2941
CC1(CC(O)C1)OC=O,0.2747
CCNc1cc(oc1)C,0.218
CC1OC(=O)C(N)C=C1,0.2379
CC1(O)CCOC1C=O,0.2158
COC1CC(C)C(O)C1,0.3172
C1OC1C#CC1CCC1,0.2675
CN=C(C=O)NCC#C,0.164
CN=c1[nH]cnn1C=O,0.1897
COc1coc(n1)C=O,0.1583
CC(NC=O)C(O)CO,0.2798
C1C(=O)COCC(=N1)N,0.2006
CC1CC2(C)CC1O2,0.3295
CC12CC(O)(C1)C21CN1,0.2997
CCN1CC1C(C)(C)C,0.2914
O=C1C2CN(C2)C1C#N,0.2044
OC1(CC2CCC12)C=O,0.2244
CC1C(C#C)C1C(C)=O,0.2201
Cc1cc(cc(c1)O)O,0.2179
O=CC1OC1(C#N)C#N,0.2069
CCOC1(CCC1)C#N,0.2925
CC1CCC2CCC12,0.3548
OCC(O)C1CCO1,0.3141
N#CC1C2CC2C11CO1,0.2942
CNC(=O)N(C=N)C=N,0.2301
CC1C2N3C1C(O)C23C,0.3059
CC(C)CCN=COC,0.2691
Cn1cc(c(n1)C#C)N,0.1962
CC1CCN(C=O)C1=N,0.2243
c1cncc(c1CO)N,0.2022
C1OC23C=CCC2CC13,0.2346
C1C2OC1C21OCC=C1,0.2405
CC1CC1NC(=O)C=O,0.1728
CC1=CCOC1C(N)=O,0.2351
C1C(CO1)C#CCC=O,0.2193
OC1C2OC1C1NC21,0.3124
CC1C(O)C(C)C1(C)C,0.3058
C1C2C3OC4C2C1C34,0.3161
CCc1nc(on1)C#N,0.2214
c1c(ncc(=O)[nH]1)F,0.1561
COC1(C)COC11CC1,0.3011
CN1CC11C=CCC1=O,0.2008
N=C1C=CNC=C1C#N,0.1694
CC12NC1CC2(C)C#N,0.2782
CC(O)C1=CC=C(N)O1,0.2164
CC(O)C1CC2CC12C,0.3086
C#CCOc1cocn1,0.2196
CC1CCC2C(C=O)C12,0.2223
CC1(CC#C)OC1C=O,0.2152
CC1(CC1)C(C=O)C=O,0.212
NC(C[NH3+])(C#C)C([O-])=O,0.2661
CC1C(C)(C)C11CCO1,0.2946
CC1OCCC11CO1,0.3221
NC1=CC(=O)OC(=N)C1,0.2043
OC1=COC(=N)C(=N)N1,0.169
COC1=NC(=N)NN=C1,0.1623
CN1C2CC1C(CO)=C2,0.2229
C1CC(=O)C(=C1)CC=O,0.1919
C1C2C1C1OC2C2NC12,0.3129
CC1CC(C=O)=CC1C,0.1933
CC1C2OCOC12C#N,0.2755
C1CC23C=CCC2OC13,0.2427
CNC1=CC(=N)NC1=O,0.1565
CC1OC2C1CCC2=O,0.2021
O=CC12CC3CC1CC23,0.2177
CC1=C2C3C(C2O)N3C1,0.1652
O=CN1CC1CC1CO1,0.2533
CC1=CC2OC1C(C)=C2,0.2011
CNC(=O)CNC(=O)N,0.2576
N=C1CC2=C(NC=N2)O1,0.2114
CC1NC1C1CCCO1,0.3095
COCC1C2C3CC3C12,0.2855
CCC1OCOC1C#N,0.2923
C#CCC12C3CC1CC23,0.2976
CC(O)C12CN1CC2C,0.317
CCC(O)(COC)C=O,0.2172
Cc1conc1CCO,0.247
C#CC(=O)N(C=N)C=N,0.2009
C#CCC12C3CN1CC23,0.2738
c1c(c(on1)CO)C=O,0.2004
CC(=O)C1C2COC12,0.2193
N=C1OC23CCC12NC3,0.2471
O=C1N[C-]2C3[NH2+]C3C2=C1,0.1744
CN(C)C1=NCCC1=O,0.1647
c1c(nnnn1)CC#N,0.1637
CC1(O)CCCCC=C1,0.2489
OC1C(OC1=O)C#C,0.2591
O=C1C2N3C1CC23C#N,0.2281
C1CN=COC1,0.2732
C1CC=CC=CCC=C1,0.2236
OCC1(O)C(O)CC1O,0.3032
OCC1(O)C2NC1C2=O,0.2511
C1C2C3NC3CCN12,0.286
O=C1N2CC2C11CN1,0.2286
COC1C=CC2CC12,0.2418
c1cocc1C(=O)CO,0.2026
OC12CC1OC1CCC21,0.2944
C1OC1C1C2CCC12,0.338
CC12NC(=N)C1(O)C2O,0.2313
O=CC1OCOC1C=O,0.1983
Cc1c2c(on1)COC2,0.2335
CC12C=CCC1C2C#C,0.2404
OCC1(CC#C)CN1,0.2857
CN=C1C=NNN=C1,0.1715
CC12C=CC34CC(C13)C24,0.2212
Cc1ccc(n1C)C#C,0.1953
c1c([nH]c(n1)N)C#N,0.1989
CCCC(C)OCC#C,0.2872
OCC1=CCOC1C=O,0.2008
C1OCC11NCC2OC12,0.2965
CCC1C2C3C(C)C2N13,0.3141
CC(=O)c1cncnc1,0.1845
CCC(CNC=O)OC,0.2832
CC12CCC1OC=N2,0.2642
C1C2C3C1C1OC3OC21,0.3499
CC12CC3CC1C23C#N,0.2718
CC(O)CC1(O)CC1,0.3046
O=C1NCCC1C1CC1,0.2666
C#CC(=O)COC1CC1,0.185
OC12C3CC3C1C2C=O,0.194
c1conc1C=O,0.194
CC1(NC1CCO)C#C,0.2752
OC1CC(O)C2CC1O2,0.3048
C1CC2=C(C1)CC(=O)C2,0.217
CN1C=NC(OC=N)=C1,0.2291
OC1CC(=O)C2CC1O2,0.2097
O=CC1(CNC=N1)C#N,0.1962
CC1C(C)C11OCC1=O,0.2159
CC12NC1C(O)C21CN1,0.296
OCC1N2CC1(C2)C#N,0.2785
N#CC1C2CN=COC12,0.2738
CC(O)C1C2CC1C2=O,0.2517
CCC(C)(O)CC(C)=O,0.2268
CC1CC=C(C)C11CN1,0.2457
C1C2OCOC3COC123,0.2985
CCC1(COC1)CC#N,0.2833
CN=C1NC2C(N)C12O,0.2393
O=C1OC=NCC2OC12,0.2312
C#CC12CCC(O1)C=C2,0.2566
C(C1CO1)C12CC1CO2,0.3056
O=C1NC=C(O1)C1CN1,0.2249
Cc1cnc(=O)oc1F,0.179
C#CCC12CC(C1)O2,0.2841
CCC(C)C1OC1C,0.3396
COCC1C(C)C1(C)O,0.3141
COC(C)C1(CO1)C=O,0.2192
CC1C=CC2=NNC=C12,0.207
Cc1ccc(o1)C=O,0.1825
OC12C3OC1CC(=O)C23,0.2207
CC1NC(=O)CC1O,0.2694
CC(C#N)C1=NON=C1,0.2581
CC1CC2=CNC=C2C1,0.2427
c1(=O)onno1,0.2469
C1CC(C1)(CCO)CO,0.3282
OC1CC1(OC=N)C#C,0.2578
CC1(C)OC(=O)C1N,0.2494
CCNC(=O)NC(C)C,0.3011
c1c(nc(c(n1)N)N)N,0.1668
NC1=C(O)C(=N)N=CN1,0.1781
OC1C(O)C1C(=O)C#C,0.1714
OCC12CN3CC3C1O2,0.2858
c1c(nc([nH]1)C#N)N,0.1763
Cc1cncnc1NC,0.2104
CCC12CC(C1)(C2)C#N,0.3332
c1c2c(c([nH]1)O)OCC2,0.2213
O=C1C=CC2(CN12)C#N,0.1986
CC12COC1=NCC2,0.2615
N#CC1CCCOC1,0.301
CC(C)N=C1CCCO1,0.2733
CC1(CCOC1)OC=O,0.2703
Cc1cccc(n1)C#N,0.2085
CC12CC(CO1)C2C#N,0.2768
CN1CC1(C=O)C(C)=O,0.1915
CCOc1c(nno1)O,0.1912
CC#CC(O)C(=O)C#N,0.1729
Cn1c(c(cn1)C#C)N,0.222
CC(C)N1N=COC1=N,0.2147
ON=C1CCC2NC12,0.2408
N#CCCC1CCOC1,0.2924
CC1(C)C2OC2C11CN1,0.3062
CC1COC1=NCC#C,0.2681
CN1C2CC(C2)CC1=O,0.2595
OCC1(O)COC11CC1,0.2802
CCCC1CC(=O)C1C,0.2212
C1COCc2c1[nH]nn2,0.2436
NC(=O)C1CC(=O)CO1,0.2162
CC1CC23CCC12OC3,0.2879
O=C1CC2CC1(N2)C#C,0.2182
Cc1nc2c(o1)cno2,0.2036
COCc1ccccn1,0.2285
OC1C2C=CC1C2=O,0.2405
CC1(C)OC11C2CC1C2,0.3386
COC(CO)(C=O)C#N,0.2145
c1cc2c(nc1)nno2,0.1885
COC12CC1C1(C)OC21,0.2952
C1CC1OCC(F)(F)F,0.3339
OC1C(C=O)C1C1CO1,0.2063
CC1C2OC3CC=C1C23,0.2124
CCC(=O)CC#C,0.2334
CC1C=CN2N=CC=C12,0.2026
O=C1NC2CC1C1OC21,0.2578
CC1C(CC=C1C)C#C,0.2591
N=C1OCC2CC1C2=O,0.2224
O=C1C2C3C(C2C#N)N13,0.2406
C1C2C3OC1CCOC23,0.301
CCc1cc(on1)C#N,0.2156
C#CC(=NO)C1COC1,0.2055
COc1cncc(n1)F,0.1976
CC(C)C(CC#C)C=O,0.2247
c1cc(nc(c1O)N)F,0.1897
c1c([nH]c(n1)CCO)O,0.2378
CC(C)(O)C1OCC=C1,0.2447
CC1N2C3CC2C13C#N,0.2694
CCC#CC(O)CC#C,0.2797
CCC1(CO)C(C)N1C,0.2949
CC(O)CC1CC1,0.3332
CC(=O)N1C=NCC1=O,0.2186
CCCC12CC1CC2=O,0.2311
c1cnccncc[nH]1,0.1508
CCCC1(CO)CO1,0.3473
OCC1CC(CO)C=C1,0.2622
CC(=O)C(=O)OC=N,0.1753
CC1(CC1)CC(=O)OC,0.2718
CCCC(C)(O)CO,0.3157
OCCC12CC1NC2=O,0.2518
CC1(C=O)C2CC1OC2,0.2228
Cc1cn(nn1)CC#C,0.2471
CNc1[nH]nc(n1)C#C,0.212
CC1=CCC2C=CCC12,0.2564
OC12CC3C4C(C14)C3C2,0.3245
CCC1(OC1C#N)C=O,0.214
OC1(C#N)C2NC1C=C2,0.2249
CCOCC1(COC1)C,0.3209
N#CC1C2COCCN12,0.2553
CC12CC(O)C1OC2=N,0.2836
CCC1CC1(O)C1CC1,0.3246
CC(C#C)C#CCC#N,0.2799
CC12CNC1=CC(=O)N2,0.2115
C#CC1=CC=CC=CC1,0.159
Cc1nc(=O)cco1,0.2061
CC(O)CN(C)C(N)=O,0.2873
OCC(C#N)C#CC#C,0.2258
CN=C1CC(=O)OCO1,0.2556
CC1=CC2CC1COC2,0.2477
COCC12CC1C(=N)O2,0.2801
COC(CO)C#CC#C,0.2213
CC(C)(C#C)C#CC#N,0.2384
CC(O)C(O)C1(C)CO1,0.318
O=C1CCC2CC1O2,0.2097
CNc1cc(c([nH]1)N)O,0.2251
CC12C3C4CC1C(=N4)N23,0.1672
OC(C#N)C1OCC1O,0.2878
OC12C3CN(C13)C2C=O,0.1981
c1c(nn[nH]1)C#N,0.2453
N#CC1OC2C3CC2C13,0.2825
CCC1NC1CC=O,0.2208
CC1CC2OC2CC=C1,0.258
C1CC23NC2CC2C3N12,0.311
C[NH+](C)C(C#C)C([O-])=O,0.2608
CC1(O)CC2(CC2)C=C1,0.2445
C#CCOCCCO,0.2888
CC12C3CN4C(C13)C24,0.3002
O=CC(C1CC1)C1CN1,0.215
C1NC1C12CC=CC1O2,0.246
[NH3+]C(C1CCC1)C([O-])=O,0.2657
CNC1C2OC1C2=O,0.2137
COC1(CC(C)C1)C#N,0.2933
CCC(=O)CC1OC1C,0.2342
CC12CCC1(N2)C(N)=O,0.2566
CC1CC2(CO2)C1C#N,0.3048
CC1C(O)C1OCCO,0.2907
CC1CCOCCC1O,0.3166
c1c(nc(o1)NC=O)N,0.1841
NC1=NC(CO)C(=O)N1,0.2356
CC1(C)CC1OC1CC1,0.3198
CC1C2NC2C(=O)C1=O,0.1492
C#CCC12CC3OC1C23,0.2797
CC1C2N3CC3C12CO,0.28
CC1C2OC2(C)C1C=O,0.2126
CN1C2CNC(=O)CC12,0.2564
Cc1c(cc([nH]1)N)NC,0.2125
CC1C2C(C=O)C2C1C,0.2193
CC(C)C(CC#C)C#N,0.3052
OC1C2C=CC1C21CO1,0.2415
O=CNC1C2C3OC2C13,0.2622
C#CC12CC1N=CN2,0.2382
C#CC1CC2CC12C#C,0.2655
N=C1NC=NNC1=O,0.1935
CC1COC(=O)NC1=O,0.2491
CC1=NC(O)=CC(=N)O1,0.1766
CC1OC1C1OCC1C,0.3106
O=C1NC=CC2CC1O2,0.1962
C1C=CC2OCC=CC12,0.2477
C1CC11C2C3C=CC2C13,0.2264
OC1CC1C1C(O)C1O,0.2811
OC1C2OC1C2OC=N,0.2784
O=CCN1CC2CC12,0.199
CC1CC2(C)CN2C1=O,0.2385
C1C2OC3(CC4NC34)C12,0.2999
c1c(c(on1)OC=O)N,0.2003
OCC1C2CC1N2C=O,0.2489
N#CC1NC2CC1C2,0.2756
CC1C(O)CC1C=O,0.2232
CC(C)C12COC1C2O,0.2901
CCC#CCC(=O)C,0.2279
CC(CC(N)=O)OC=O,0.2753
CC(C#N)C12CC1OC2,0.2759
CCC(C=O)C1(C)CN1,0.2122
C#CC#CCO,0.2202
CCC(CCCO)OC,0.3238
CC(C)C(=O)NC=N,0.2379
CN=C1NN=C(C)C=C1,0.1539
O=C1OC2C3CC3C2O1,0.3317
CC1C2CC(=NO)C12,0.2439
C1C2CC34CN1C23CO4,0.254
Cc1c(oc(n1)O)C#C,0.1965
CCC1(CCO1)C(C)O,0.3044
CC1CC2C3CC3C12C,0.312
CCn1cc(oc1=O)N,0.2329
COCC(COC)C#C,0.3086
CCC1(CC1O)NC=O,0.2702
CCC1CN1CCCO,0.3009
Cn1ccc(=O)cc1,0.2014
c1cn(c(=O)[nH]1)C2CC2,0.231
CC12CC1C1OCCC21,0.3137
CC12CC1C1OCC21,0.3095
CCC1(O)CC2COC12,0.3049
CC1OCCC(=O)C1=O,0.1535
OCC1(COC=N1)C#C,0.2612
OC1=NOC=C1C1CN1,0.2256
CC1CC1OC(C)=O,0.2794
CN1CC2(CO)C(O)C12,0.2617
COCc1cc(oc1)N,0.2263
CC1CC2(COC2)O1,0.3118
CC(O)C(=O)CCO,0.2363
OC(C=O)C1=CN=NO1,0.2181
C1C2COC3CC=C1C23,0.2355
CC1=CC2C(C1)C2C#N,0.2414
O=C1CC23COC12CO3,0.1982
CCC1CC1(CO)C=O,0.2253
CC1OC2COCC12C,0.3246
CN1C2C3CC3(C)C12,0.3184
C1CC1c2c(nno2)N,0.214
OCC1=CCC2CC1C2,0.2515
OCC(O)CC(F)(F)F,0.3228
CCC1(C)CC=CC1C,0.2643
CC1COC2=NCCN12,0.2732
CC(=N)OCC#CC=O,0.2056
OC1=NC(=O)OC(F)=N1,0.2227
CC(C)OCC#CC#C,0.2214
CC12CN3C(CC1)C23,0.3027
CC1OC11CN(C1)C=O,0.2652
C#CC(=O)C(=O)C(=N)N,0.176
CC12CC(CC1O2)C#N,0.3093
CC12C3CC1(C)C(O)C23,0.3059
C(C1CC1)C12CCC1O2,0.3264
O=CNCC1CN2CC12,0.2563
OC1CC2CC(=N)OC12,0.282
C#CC1C2C3CC=C1C23,0.176
OC1C2OC3C1(O)C23O,0.2784
CC12CCC3(C)C1CC23,0.3675
CCC(C)(CC=O)OC,0.2238
c1c([nH]nc1O)N2CC2,0.24
C1C2C1N1CC21,0.2917
CN1CC2CC(C#N)C12,0.2516
CC12CC1C(C#C)C2=O,0.2206
COCC1OCC2NC12,0.3161
COC1(CC2CO2)CC1,0.3255
COC12C3C4C1N4C23,0.2772
C1CC2(O1)C1C3CC2N13,0.3085
O=C1OCC=C2CNC12,0.2217
CC1OCCC1(C)O,0.3155
CC1C2C3COC2C13,0.3336
CC(=O)C1C2OCOC12,0.2176
CC1OC1(C)C(C)=O,0.2219
c1cn2c(n[nH]c2n1)N,0.214
COc1c(cc[nH]1)N,0.2248
CC12C3C4N3C1C2C4=O,0.2081
CCCc1cnccn1,0.1966
OC1(C=CC2OC12)C#N,0.2347
CC1NC1(CO)C1CN1,0.3107
CC1CC2COC(C1)O2,0.3233
CC(C)C(O)C1(C)CC1,0.3249
CN1CC(C1)OCC#C,0.2471
OCC1CC2C3OC2C13,0.2972
c1cnc-2ncnoc12,0.136
CC1(C=O)C2N1CC2=O,0.2021
CC#CC1CC(=O)C1O,0.2074
CCC1CC11COCO1,0.3277
CC1OC11COC1(C)C,0.3281
C1OC11C2OC1C1OC21,0.3109
CN1CC1C(C)(C)CO,0.2829
CCc1[nH]nc(n1)OC,0.2468
CCC(C)C#CCCO,0.3027
Cc1c2c([nH]cn2)[nH]n1,0.229
C#Cc1c([nH]c(=O)o1)N,0.1906
CCC1CCCC1(C)O,0.3254
CC(=O)CC1OC1C#C,0.2349
OC1CC2C=CCC2=C1,0.2508
O=CC12CNC1CO2,0.1923
OC1C2C=CC1N1CC21,0.2171
O=C1NC2C1NC21CC1,0.2435
CCN1CC(C1)OCC,0.2942
CC1(CO)CC(O1)C#C,0.27
CC1=C(C(=NC)OC1)C,0.2108
CCc1cn[nH]c1C#N,0.2185
C1CC2(C1)C3(O2)CCC3,0.3221
CC12CC1C(=N)OCC2,0.2717
C#CC1CN1CC1CC1,0.2632
CC1CC(CCO)C1O,0.316
O=C1C2CC1C1NC21,0.2349
O=C1CC2C3NC12C=C3,0.1887
OC1CC2CCC1C2O,0.3226
CN1CC1C1(CN1)C#N,0.2514
CC1(C)CC(C#C)C1=O,0.2107
COC1(C)C2CC1(C)O2,0.3115
CC1C(C=O)N1C(N)=O,0.1969
CCCc1c[nH]nc1O,0.2454
OC1C2CC1OC(=O)C2,0.2693
O=COC12CC3C1CC23,0.2793
CC1=CC(=O)C(=NC)N1,0.1504
CC(=O)COC(=O)CO,0.2354
CC1CN1C1COC1=O,0.2359
CCCC(CO)OC,0.3233
NC1=NC(=N)C=CO1,0.2091
C1CN(C1)C(=O)CO,0.2681
CC1CCC23CC(C2)C13,0.3428
CN=C(C(=O)C#C)N,0.1675
CN1N=NC(C)=CC1=O,0.1815
CC1C2OC2(C)C1(C)O,0.3137
O=CN1CCOC2CC12,0.2529
CCOCCOC(=O)C,0.2779
CC1CC2C1CCC2O,0.3148
CC12CCN3C1C(O)C23,0.301
CCN=C(C)NC(=O)N,0.2463
CC1=C(C)C2CCC2C1,0.2518
C1C2CC34CC3(CC4)N12,0.2831
Cc1c(c(c[nH]1)N)C=O,0.1608
N=C1NC2=C(NC=N2)O1,0.2047
CCC(=O)C1C(C)C1C,0.2285
OC1C2C3C(C#C)C2C13,0.2938
CC1OC(=N)CN=C1N,0.2534
CCC1=CN=NNC1=N,0.166
C(#N)c1c([nH]nc1O)N,0.2294
Cc1[nH]c(=O)on1,0.2546
[O-]C(=O)C1CC([NH2+]1)C#C,0.2553
CCC1OC2CC(O)C12,0.3033
O=C1C=CNCC11CO1,0.1827
CC1(CC(C1)C#N)C=O,0.2227
CCC(N)(COC)C#N,0.2969
NC1=C(O)C(=N)ON=N1,0.1413
CC1=C(C(=O)CNC1)C,0.1682
CC12NC1C1COC21C,0.2924
COC1(C)C=CNC1=O,0.2075
COCC(O)C1(C)CO1,0.3387
OCC12CCC3C1CC23,0.3369
CCC(O)C(C)OC=O,0.2766
OC1C2OC(=N)C1C2O,0.2707
C1C2C3COC1C23,0.3293
CNC1(CN2CC12)C=O,0.1941
CCC1CC(=O)C=C1C,0.1933
CCOC(C)CCC=O,0.2301
C1OC23CCOC2CC13,0.3001
CC(OC=O)C(O)C=O,0.2309
CCC1C2C3CC3C12O,0.2835
OC1CC2NC12C=O,0.2098
NC(=O)C1OC2CNC12,0.2444
CC12CC1C1(COC1)C2,0.3126
ON=C1CC2(NC12)C#C,0.2233
OCC1C(O)C1CC=O,0.2178
CC#CC1OC1C(C)O,0.2641
c1c2c([nH]c1N)nco2,0.191
ON=C1CC2CN2C1=N,0.187
N=C1OC2COC1CO2,0.2784
[NH3+]CC1=C(O)N=C([O-])O1,0.1901
CC12CN1CCC2C#N,0.2787
C#CCC1NC2COC12,0.287
O=C1NC2C3N4CC13C24,0.2276
CC1=CC(=O)N(C1)C=N,0.1985
CC(CO)C1COC1,0.3133
c1nc(=O)c(no1)CO,0.1888
O=CNC1CC2CC2C1,0.2787
C(C=O)C#CC(=O)CO,0.2003
N=C1CN=C2NCC2O1,0.2473
O=CCC12C3CC1OC23,0.2123
OC1C2OC2C(=O)C1O,0.1968
O=C1NC23CC12OCC3,0.247
CC1=CCC2(O)CC1C2,0.2523
CCC#CC(=O)C(=N)N,0.1759
C(C#CC(=O)NC=N)O,0.2038
CC1(C(=O)CCC1=O)O,0.1879
c1[nH]nc(n1)N2CCC2,0.2186
CC12C3N1C1C=C2C=C31,0.1417
O=CN1C2CC3CC3C12,0.258
CN1C(=N)OCOC1=N,0.2541
OC1CCC11CC(=O)O1,0.2867
CC1=NCC2(CN12)C#N,0.2485
CC1CC2(CCC2)C=C1,0.2576
CCC(=O)C(=O)OCC,0.1819
c1cc(=O)nccc1N,0.1627
CC1C2NC1C2=O,0.25
C1C(CC12COC2)CO,0.3124
c1c(con1)C2COC2,0.2364
CC1(O)C2OC1C2O,0.2935
NC(=O)CCC1CC1O,0.2782
OC12CCC1N1CC1C2,0.2948
CCCC1CC2OCC12,0.3163
CC12CC3OC3C1(C)N2,0.3113
C#CC#Cc1cocn1,0.1855
CC(CO)C(C)(C)O,0.3281
OC12C3C4C(C13)N4C2=O,0.2236
OC(CC#C)C1(O)CC1,0.2977
CN1C2C=CC3C2C13C,0.2126
CCC1CC2(CC12)C#C,0.2702
OC1CC2(O)C(O)CC12,0.3001
CN1C2CC1(CC2)C#N,0.2428
C1CC23CC=CC2C1O3,0.2463
c1coc2c1CC(=O)O2,0.2003
C1C(=CNC1=O)CO,0.2087
CC12CC(C1)C21CC1,0.3563
CCC1(CO1)C(C)(C)O,0.3354
NC(=O)CC1C2CCC12,0.2737
C1CC12CC3(C2=O)CC3,0.2163
C#CC1CC2OCOC12,0.2922
CCC(O)C1(CO)CN1,0.2937
CC1C=CC(=O)N1C=O,0.1922
NC(CO)(CC#C)C#N,0.2901
C1CN1CCOCC=O,0.21
COC(=O)C12CC1CN2,0.2377
CC1CC2(CO2)C2NC12,0.3068
CC1=NC(O)=NOC1=N,0.1595
CC12CC1C(C#N)C2O,0.2941
CN=COCCCC=O,0.2254
CC(C)C1NC1C#C,0.2816
N#CC12C3CN=C1NC23,0.1674
CC#Cc1nccn1C,0.2014
CC#CCC#CCOC,0.2786
CC1CN2C=NC(O)=C12,0.2293
CC1=CC(=N)OC1,0.216
OC1CCOC1,0.314
CN1CC1C#CCCO,0.2601
c1nnn(n1)C2CC2,0.2504
C1COC(=O)NC(=N1)N,0.2509
OCC1OC(=N)CC=C1,0.2561
c1c(cc(cc1F)F)F,0.2472
CC1C2CC2CC=C1C,0.2583
COCCC1(O)CC1C,0.326
CN1C2COCC12CO,0.2973
CC(O)(CC1CO1)C#C,0.3054
CCC(C)C(O)C#CC,0.288
CN=C1CC2(CN12)C#N,0.2378
c1conc(c1=O)N,0.1823
CC1C2CC3N2C13C#C,0.2621
CN=C(C(=O)N)N1CC1,0.2022
OCC1CC(O1)C1CC1,0.318
CCc1c(cn[nH]1)N,0.2255
C#CC(=NO)C#CC=O,0.1559
CC12C(O)CC1CC2=O,0.2159
C1CC11C2CC2C2OC12,0.3282
OC1CC11C2OC2C1=O,0.213
ON=C1CC2NC12,0.2402
CC(C=O)C1OCC1C,0.2157
CC1=CCC2(CO)CC12,0.2472
CC12CCN3CC1(O)C23,0.2831
O=C1CC2(C1)C1CCN21,0.2134
CN1CC2(O)C=CCC12,0.2203
C1CCC2(C1)CC(=O)N2,0.2839
C1OC23CC4C2CN4C13,0.2811
CCC1=CC2(C)NC2C1,0.2431
CCCc1cnn(c1)C,0.2518
C1CC1CC#CCCO,0.2985
O=CC1C(NC1=O)C#C,0.2201
OC(C#C)C1COC1=O,0.2753
CN1C(CC1=O)C1CN1,0.2779
CC1(CCO)OCC1=O,0.2192
NC(=O)N1CCC1=N,0.2466
O=COC1C2C3CC1C23,0.2769
FC(F)(F)C#CC1CN1,0.2556
CCCC(C)(O)C#N,0.3164
OC12CC1N1C(C#N)C21,0.2421
CC1OC2CC3CN3C12,0.3149
COC(=O)NCC(=O)N,0.267
CC1=CC2CC2C(O)C1,0.242
CC1CN2CC2(C1)C=O,0.2169
CN=c1occ(o1)CO,0.2261
CCC1C2(O)CCC12O,0.288
O=CCC1=CC2CC2C1,0.2009
CN(C=O)C1(CC1)C#N,0.2645
N=COC(=O)C(=O)C#N,0.1633
CNc1cc(c[nH]1)CO,0.2327
CC1C2C3C1CCC23O,0.321
O=CC1C2CC3C2N13,0.2177
CC1CC2CC2C1C#C,0.3062
c1c(nn(n1)C=O)C#N,0.2084
[NH3+]C12CCC1C2C([O-])=O,0.2352
CN1C(CC#C)C1C#N,0.2591
CC1=Cc2cc[nH]c2C1,0.1884
O=CN1CC2(CO2)C=C1,0.2047
C1=C(C(=O)NC1=O)CO,0.1793
Cc1c(c[nH]c1C#C)N,0.1862
CN(C)C12CC1OC2=O,0.2244
CC#CC1=NC(C)CO1,0.2171
COc1[nH]c(c(n1)N)N,0.2309
CC(O)C1C2C3CN3C12,0.2823
CCC1C(C)CC1=O,0.2193
CC1(CC(=N)O1)C1CO1,0.2854
COC12CC3C1OC23C,0.3093
O=CC12OC1CNC2=O,0.196
CC(C)(c1cnn[nH]1)O,0.2548
CC1(C)OCC1C1CO1,0.3186
CNc1c[nH]c(=O)nc1,0.1544
CCCC1CN1CC#C,0.2655
O=C1COC2C3OC1C23,0.2016
CC12OCC1NC2=O,0.2502
CCC12OC1C(C)C2C,0.322
CC1(CC11COC1)C=O,0.2256
CCCCC1(CC1)CC,0.3413
CC1C=C2C=CC3C2N13,0.1726
CC1C2CC1C1CCC21,0.3651
O=C1CC2C3CC1N23,0.2185
CC1C2C3NC3C1C2=O,0.2389
Cc1coc(c1C)C,0.2347
OCC1(COC1)OC=N,0.2672
O=C1CCC(CN1)C#C,0.2659
O=COC1CCC11CO1,0.2738
C1OC1C12NC3C1NC23,0.2889
CC1(CC1)C1OC1CO,0.3383
OC1C2C3OC2C13O,0.2905
OC1C2OC2C2OCC12,0.3029
CC(C)(O)C1(C)CCO1,0.3203
O=CC1COC1C#C,0.2187
CN=C1ON=C(N)C=C1,0.1535
CCCCCC(C)C#N,0.3479
C1CC23CC(CC12)C=C3,0.2459
CC1CC(O)(C=O)C1C,0.2121
CC12CC(C1)CCC2O,0.3177
OC1CC2=CC(=O)NC12,0.2119
OCC1C2CCC=CC12,0.2482
C#CC1CC11COCO1,0.2772
O=C(C#C)C1(CO1)C#C,0.196
OC1CC(CC1=O)C#N,0.2105
CC(C)c1ccoc1N,0.22
CN=C(NC=O)C1CO1,0.2281
O=CC12CC1C1CCC21,0.2223
CCC(O)C1OC1C=O,0.2234
CC(C(O)C#N)C1CC1,0.2999
CC(C)C1OCC1C=O,0.2136
NC1(CC1NC=O)C#N,0.2613
c1c(cn[nH]c1=O)C=O,0.152
CC1(O)CC=CC2NC12,0.2383
OCC(CCC#N)C=O,0.223
Cn1c(c(oc1=O)N)N,0.2354
C1CC(C1)(C=O)OC=O,0.2214
Cc1cc(c([nH]1)O)CO,0.2273
CN1CCOC(CO)C1,0.301
C#CCNc1cn[nH]n1,0.2183
CC(C#N)C1(C)CN1C,0.2683
CN1C2C(O)C=CC12C,0.2184
COC1C(OC)C1(C)O,0.3043
O=C1OC2CC1C1OC21,0.2694
CC12COC(=O)CC1N2,0.2622
CNc1cc([nH]n1)O,0.2399
CC1(C)COC2CC2O1,0.3056
CCCC#CC#CCO,0.2143
CC1(O)C2OC2C1C#N,0.2928
OCCC(OC=N)C#C,0.2795
CC1C2C(=O)C1C2(C)C,0.2519
CCC1C2CN2CC1=O,0.2012
CN1CC1C(=O)C(N)=O,0.1576
CC1CC=CCCO1,0.2525
CC12NC1C1(CO)OC21,0.2785
C1NC11C=CC2NC12,0.2377
CC12CC1N=COCO2,0.2483
COCC(C)CC(C)=O,0.2345
NC(C#N)C1CN1,0.272
CC(CO)CN1CC1,0.308
CC1=CC(=O)NCC1O,0.2075
Cc1c(noc1OC)O,0.2432
CC1N(CC1=O)C1CC1,0.2097
O=CC12CC(CC=C1)O2,0.2035
CC12OC1CC(C=O)=C2,0.1857
c1cc(oc(=O)c1)O,0.1742
CC12CC1(O)C1CN1C2,0.2981
CC1N2CCC12CO,0.311
O=C1CC2NC1C1OC21,0.2044
OC1C2OC3C4C3C2C14,0.3109
CC(O)C1(CC1O)C#N,0.2935
CCCCC(=O)CO,0.2429
C1CC2CC1CCOC2,0.3137
CC1C(O)C1C1COC1,0.3023
COc1cc(oc1)C#C,0.1893
ON=C1C2C3OC1C23,0.2455
OC12CCOC1C1CC21,0.3139
CCC(=N)N(C=N)C=O,0.2159
C1C2OC3CC2C=CC13,0.2419
CNc1c(non1)C#C,0.1839
C1CN1C=O,0.2542
NC(CC#N)C#CC#C,0.2259
CC1OC1C(C)=NO,0.2383
CN(CCO)C(=N)C#N,0.1921
CC1OC2CC2C=C1,0.2464
CC1C2C1C1OCC21,0.3102
CC#CC(C)(C)CC#C,0.2869
CC1CC2(C1)C1CC2O1,0.3146
CCC(O)CC(N)C#N,0.2814
CC#CC1CC1C=O,0.219
CC12CN3C(C13)C2=O,0.2261
CC(C)N(C)C(=O)OC,0.2962
CC1OC11CCC=C1C,0.2492
OC1CC2C1C2N1CC1,0.3175
CCCC1(C)CCC=C1,0.2623
CCC12CC(CO1)CO2,0.3295
CC(C)(C)C#N,0.3594
CC1C=CC2(CC12)C=O,0.2225
CC1C(COC1=N)C#C,0.2834
CN1CC1(C)C(N)C#N,0.2737
C1c2c(n[nH]n2)OC=N1,0.2257
CC#Cc1c(n[nH]n1)N,0.1963
OC1CC(=O)C11CO1,0.2021
CN1C=NN(C=O)C1=N,0.1911
OC1CC2CCC12,0.3214
Cn1ccc(n1)CC#C,0.2559
O=C1C2CC3(CC3)C1N2,0.2337
CCC12CN(C1)C2C#C,0.254
CCC(=NO)CC(C)C,0.2492
OC12CN3C1C(C#N)C23,0.2913
ON=C1CN2CC3C2C13,0.2329
OCC1CC11COC1=N,0.2788
CC(C)C1=CCC2CC12,0.2468
C#CC1CCCOC1,0.2995
C1OCC2=CCCCC12,0.2512
CCC1(CC2NC12)C#N,0.2829
CC12OCC3(O)C1CC23,0.3019
O=CN1C2CN3CC1C23,0.234
CC(O)C(C)CC(C)=O,0.2347
CC12C(OC1=O)C2C#C,0.2516
Cc1c(nc(o1)CO)N,0.2079
CC(C)C1CC(C)C1,0.3636
OC1C2C3OC3C(O)C12,0.2728
C1COCOC(=O)C=C1,0.2124
COC1C2C(O)CC12O,0.3166
O=C1CC2C=CC3C2C13,0.2184
CNC(=N)C(=O)C(C)O,0.1678
CC1(O)CC2CCC12,0.3235
CC1C2C3CN3C1C2O,0.2995
O=CC12NC1C1OCC21,0.2095
NC1C(N)C1(CO)C#N,0.2541
C1C2NC22C=CCOC12,0.2382
CC(C)(CO)N=COC,0.2693
N=C1OCOCC1=O,0.1858
[NH3+]C1(CCCC1)C([O-])=O,0.2688
N#CC12NC3C4C(C14)C23,0.253
NC(=N)NC(=O)C1CN1,0.2128
OCC12CC1(O)CC2=O,0.2292
Cc1cc([nH]c1C)C=O,0.1753
O=C1C2CC1(NC2)C#N,0.2105
CC1C2COC(=N)CN12,0.2526
CC1COC=NCCO1,0.258
CC1(CO)C2CC1OC2,0.3086
CC(O)C1CC=CCO1,0.2666
Cn1cnc(c1CO)O,0.2201
C#CC#CC1CCCC1,0.2294
CC1(COC=N1)C=O,0.2151
CC(O)C1C2C3CC2N13,0.2994
CC#Cc1ncno1,0.2096
CC1=CC(COC1)C#C,0.2553
CC12C3C4C(N13)C(=O)C24,0.21
OCC1C2CC1(C2)C=O,0.203
CC12CC(O1)C(=C2)C#C,0.1904
CC12C3CC1(O)C(=O)C23,0.2466
C1CC12C(=O)NCCO2,0.2619
C1CC(C1)C1CCO1,0.328
CCC1(C)CC(C)(O)C1,0.3214
CN(C)C(CCO)C=O,0.179
CCC1(COC1)OCC,0.3204
CC1OC1C1CN=CO1,0.2728
CCc1c(onc1N)C,0.2365
CN1C(=N)OC(N)=C1O,0.2324
O=CC1OC1(C#C)C#C,0.2064
Cc1ncnn1C2CC2,0.2544
CC1CC(CCO)CO1,0.315
CC1OC2=NC3CC3C12,0.2478
c1cncnc1OC=O,0.2143
CC(N)(C#C)C#N,0.2797
C#CC1CC2OC2CO1,0.2906
COCC(C)C1(O)CC1,0.3201
CC1C(CC1(C)C)C=O,0.2226
N#CC1CCNC1C#N,0.2719
C1C2CCC3CCCC123,0.3361
C(COC=O)C(F)(F)F,0.2869
C1CC2C3OC3C=CC12,0.2372
CC1NC(=O)NCC1=O,0.2105
CC(=O)N1CC2NC2C1,0.2675
c1cc-2c[nH]nnc2c1,0.1545
CC12CC1(C=O)C(O)C2,0.2159
O=C1C2C3N1CC23C#N,0.2311
CC1OC11CC(C)(C)C1,0.3303
CC(C)C(C)C#CC#N,0.2455
C1CC1OC12CC(C1)C2,0.337
[NH3+]CCC1=COC=C1[O-],0.2222
N#CC12CC1OCCO2,0.2639
O=C(CC#N)C1CCO1,0.2137
CC1CCC2NC2C=C1,0.2501
COCC#CCN1CC1,0.2706
CN=C1NC(=N)C=CO1,0.1971
N#CC1OC2=NCCC12,0.252
CNC(C=O)C(=O)OC,0.1811
CC(O)CC#CCC#N,0.284
CCC12CC(=O)C1C2O,0.231
O=CC1C2C3C1N=CN23,0.2158
CC1(O)C2OC(=O)OC12,0.3027
CC(=O)CC#CC1CC1,0.218
CC1C2C3C(C2C#N)N13,0.286
COC1C2CC(=O)C12,0.2296
CC1CCCC1(C)C#C,0.3134
C#CCCC1OCCO1,0.314
O1CC1C12OC3C1NC23,0.2912
CN=COCC(C)C#N,0.2742
C1CC23OC4(CCC24)C13,0.2147
CN1CC1(C)C#CCO,0.2577
CC(O)C1C2OCC12O,0.2869
OCC12NCC1OC2=N,0.2507
OCCC1C2COCC12,0.3207
CC(C)(COC)C1CC1,0.3334
OC(C=O)C1=COC=C1,0.19
COCC(C)C(=O)OC,0.2691
C#CC1(CC2OC12)C#C,0.2752
CCC(C=O)C(C)C=O,0.2147
CC#CC1CC2OC12,0.2868
Cc1c(cnc(n1)N)F,0.1875
CCC12CN1C(=O)C2,0.2374
O=CC1COCC2CC12,0.2203
CC#CCCCCOC,0.3031
O=C(C#N)C1=NCCN1,0.1375
C1CC23OC2CCOC13,0.3154
CC1=CC23COC2C1C3,0.2286
Cn1nnnn1,0.2723
CC1OCC(C=O)=C1,0.1827
O=CC1CC2(CC2)CO1,0.2161
C1CC2C=CCC2O1,0.2608
C1CC(C1)CCC(=O)N,0.2785
CC1OC2C(C=O)C12C,0.2096
O=COC1CCCCO1,0.2735
CC1(C)C2CC(O2)C1=O,0.2097
CC(O)C1=CN(C)C=C1,0.243
COCC1(C)NCC1=O,0.2137
COC1OC=NC2CC12,0.2615
CCCC(=O)C(=O)CC,0.1575
CC1CCCC(C1)C#N,0.3424
C(C1CC1)C12CC(C1)C2,0.3604
CC1(C)C2CC1C2(C)C,0.3688
CC1=CC2CC2(C1)C#C,0.2403
OCC(OCC=O)C#C,0.2256
FC1=NC=CC(=N)N1,0.1888
OC1CCC11OC1C#C,0.2655
CC(CO)CCC1CC1,0.3411
CC1OCC2(CC2)CO1,0.343
O=COC1C2CC2C1=O,0.2194
CC1CC(=O)C1C1CO1,0.2206
O=C1CC2(CN12)C1CN1,0.2358
O=CC1(CC2CC2)CN1,0.223
O=C1C2CC11COC1C2,0.2284
OC12C3NC11COC2C31,0.2984
COC1CC1(O)C1CC1,0.2909
OC12CN3CC1C23C#N,0.2469
CC#CCC(C)C(N)=O,0.2671
C1CN2CCCOC2=N1,0.2523
CC12OC1C1CCOC21,0.3086
COC1CC(C)C2NC12,0.3067
COCC1OC1C(N)=O,0.2639
C1C(CO1)CC(=O)C=O,0.147
CC12CC3CC1N2C3,0.323
CCc1c[nH]nn1,0.2519
OCC12N=COC1C2O,0.2417
CC12CC(C1)C(C)(C)C2,0.3701
CC1C2CC2(C)C1C#N,0.2982
CCC1OCOC2CC12,0.3314
O=CC12CC(=O)CC1O2,0.2086
CC1CC11OCC11CC1,0.2944
CC1CN2C1=NOC2=N,0.2223
CC12CCC1(C)C2C#N,0.2981
OCCC(O)CC1CO1,0.3258
OC1CCC=CC2OC12,0.2379
CN1CC2OC3C2C13,0.2807
CC1COC(=O)C=C1N,0.208
CC1OCC11CC(O)C1,0.3122
CC12CC1(O)CN=CO2,0.2631
C(=O)C(=O)C(=O)NC=O,0.121
OCC1C2CCC1C=C2,0.2567
O=CCCC1CC1C=O,0.2233
CN(CC=O)C(=O)OC,0.2129
C1C2CCCC=CCC12,0.2547
CC1CC=C(C)CC=C1,0.2493
C#CC12CC1C1(CO1)C2,0.2718
CC#CC1(C)C(C)C1O,0.2788
CC1COCC(=O)N1C,0.2621
CC(C)C(NC=O)C=O,0.2148
CCC1CC(=O)C2CC12,0.2265
N#CC1OC2C3OC1C23,0.2577
CC1(C)C(O)CC2CN12,0.2913
ON=C1CC(O)CC1=O,0.1662
O=C1CC2CC1(C2)C#N,0.2291
OC1C=C(C=O)C2NC12,0.181
CC#Cc1nc([nH]n1)C,0.2211
CC1=CC2NC1C1OC21,0.2193
CNC(=N)C(=O)C1CC1,0.1719
CCCC1(O)CC1C=O,0.2259
CC1(CC1(O)C#C)C#C,0.2676
CC1C=CCC1(O)C#N,0.2652
OCC(O)C1CC1,0.3191
COC(C)C(CO)OC,0.3078
CC1CC2(CN2)C(C)=C1,0.2444
CC(C)C1(CCO1)C#N,0.2834
CC1NC1(C)COC=O,0.2601
OC1CN2CC3OC3C12,0.2939
C#Cc1nc(no1)O,0.2002
CCCc1cnc([nH]1)O,0.2462
Cc1cccn1C,0.2421
CCC1(CC1)CC=O,0.2242
COCC1OC(=N)C=C1,0.2082
CCC1OC(=NC)C1N,0.2649
CC(O)CC([NH3+])C([O-])=O,0.2697
CC(=NO)CC1CCC1,0.2537
ON=C1CCC1C#C,0.2482
OC1CC(O)C(O)C1O,0.3274
CC(O)C12CC(=O)C1O2,0.2169
OC(CCC#N)CC#C,0.3035
O=CC1C2CC1C21CC1,0.2172
CC#CC1C2CCCC12,0.2795
N=C1CC2OC2CCO1,0.2721
CC(N)(CO)C(O)C#N,0.261
CC1=CC2CC3C2C13,0.2366
c1cnc2c(n1)c[nH]n2,0.1707
CC12CC(CN1)OC2=N,0.2648
CC1OC(=O)C1OC=N,0.2515
O=CCC1COC11CC1,0.2068
O=C1OC2C(CC12)C#C,0.2736
CNC(=O)C(=O)NC,0.2134
Cn1c(ncn1)CCO,0.2592
COC12CC3C1C2N3C,0.2865
OCCCC1CC1C=O,0.2286
c1[nH]c(c(n1)O)C#N,0.2043
CC1C2C(C)OCC12C,0.3261
COC(C)C(C)=NO,0.2567
CCC1N(C)CCC1=O,0.192
CN1C2CC1COC2,0.2928
OCC1COC(=O)O1,0.3185
CC1C2NC=NC1C2=O,0.1942
C1C2OC3(CCCC3)C12,0.3063
CCCC1C2CC1C2O,0.3232
COC1=NC2CC2N1C,0.258
OC(CC#N)C#C,0.2949
OCCN1CC1C=O,0.2127
Cc1nc(cc(n1)O)N,0.2262
CC1OC11COC2CC12,0.3117
CC12CC3C1C(C#N)C23,0.3247
CCC1(O)CC=CC1=O,0.1878
CN=c1cc[nH]c(=O)o1,0.1946
CC1C2N1CC2=O,0.2179
N=C1OC2(CC2)C1C=O,0.2188
CC(O)C1C2CC3C2N13,0.323
CC12CC(CC1)C2O,0.3146
C#CC1(CC2CO2)CO1,0.2802
O=CCC1CCC(=O)C1,0.2157
CCC12CCC1=CCO2,0.2333
CC12OC3C4C(C14)C23,0.3315
CC1(O)C2C3NC3C12,0.2729
C1COc2c(n[nH]n2)N1,0.2129
O=CC(=O)C1CC2NC12,0.1437
CC1NC2=CC(=O)NC12,0.211
c1cnn(n1)CCC#N,0.2541
CC(=N)Nc1ncon1,0.2208
c1c([nH]c(n1)OC=O)N,0.2002
C1COC(=O)NCC=C1,0.2429
C1COCC1(C#N)C#N,0.2819
CC(C)C1CC1(O)C#N,0.2922
CC(O)C1(O)CCC=C1,0.2542
CC1(CO1)C1(CN1)C=O,0.2233
NC(=[NH2+])C1OC1C([O-])=O,0.2518
CCC1CC=CC11CN1,0.2461
NC(=O)OC1CN2CC12,0.2929
OCC1(COC=N)CO1,0.2738
N#CC12C3C=CC1CN23,0.225
N=C1OC2C3CC3CC12,0.2852
CC(C)(CC1CC1)CO,0.3348
COC1C2COC12C=O,0.2127
c1c2c([nH]n1)NCC=C2,0.1929
Cn1cc2c(n1)[nH]cn2,0.2103
C1Cc2c(onn2)OC1,0.2123
O=CC(=O)C1(CO1)C#N,0.15
CC1OC1(C#C)C1CN1,0.2628
CC1(C)COC(=N)O1,0.3086
NC1=COC(=N)C=C1,0.1504
OC1CC(C1)C1CO1,0.3306
CCC1=CCCC1C#C,0.2583
N=COC1=NNN=C1,0.2314
CC12NC1CC1CC2O1,0.3059
CC1(CO)CC2CC12,0.3255
CC1CC(CO)C1=NO,0.2441
OCC1OCCC1C#N,0.2933
CCC#CC1CCC1,0.2928
NC1=NOC(=N)C(=O)N1,0.1863
C1OCC2N=COC12,0.2736
CC(=O)C1=CCC2OC12,0.1886
c1c(c(no1)C#N)N,0.1832
CCCC12NC1CC2=O,0.2203
OC1C=CC2(O)CC1C2,0.246
O=C1OC2C3C=CC2C13,0.2092
CCC(C)OC(C)(C)C,0.3162
CC1(CO)C2C(O)CN12,0.2912
C1OCC2C3C4C3N2C14,0.3173
O=C1C2COC1COC2,0.2107
CC1(C)C2C(O)C(=N)N12,0.2406
OC12COC1CC=CC2,0.2517
CC1C(O)C11COC1=O,0.2726
CC1CC2OC(=O)C12C,0.2769
CCCOC1(COC1)C,0.317
OC1CCCOC1C#C,0.2742
CNc1cc(ncn1)O,0.2208
CC12CC(C1)C(=O)O2,0.2765
OC12CC=CC1C1CC21,0.2614
CC1NC(CC=O)C1=O,0.2071
CC1(O)CN2C3CC1C23,0.3016
CC(=O)CC(O)C(C)=O,0.2223
CC1(C)COCC1CO,0.3116
CCC12CC(C)C1C2O,0.306
OCC12CCC1OCO2,0.3325
OC(C#N)C1C(O)C1O,0.2752
CC1C(=N)OC2CC12O,0.2707
C1CC12C=CNC(=O)O2,0.2163
C#CC(CC#N)C1CO1,0.2944
OC12CC1C(CC2)C=O,0.224
O=CC1C2C3C2C2C3N12,0.2177
O=C1OCCC1C1CC1,0.2687
CC1C2NC2C1=NO,0.2394
COC1CC(O)C11CN1,0.3058
CN1C2CC2COC1=O,0.279
NC1=NOC(=N)C(=N)N1,0.1915
CC1(O)C(N)C1(N)C#N,0.2526
OC1C2CC1C1CC2C1,0.3182
O=COCC1OC1C#C,0.2733
CCC1OC1(C)C,0.3458
CN1CCC(CO)C1=O,0.2706
C1CC2C3OC3CCC12,0.3393
CCOC12CC1C=CC2,0.248
CC12NC1CNC2C#N,0.2657
CN(C)c1ncnnn1,0.1663
OCCC1(O)CCOC1,0.3012
CC1C=CC2(CO2)C1O,0.2499
CC1CN=C(N1)C#N,0.1996
CC1OCC2C(C#C)C12,0.2886
CCC(O)C(=O)C(C)C,0.2317
c1[nH]c(c(c(=O)n1)O)N,0.1849
Cc1[nH]cc(n1)N2CC2,0.2392
CC1(O)C2C3CC1(C)N23,0.3187
c1coc(n1)N2CC2,0.2319
NC(C(O)C#N)C(N)=O,0.2473
O=C1C(CC11CC1)C#C,0.2094
CCCC1C(C)NC1=O,0.2794
CCCC1(CC#N)CO1,0.3087
Cc1c(n[nH]c1CO)C,0.2503
OC1(CC1)C1CN=CO1,0.2676
O=CN1C=CCC1C#C,0.2108
CCC(C#C)C(C)O,0.3028
CNc1c(nno1)CN,0.2
CCC1CCC(O)C1C,0.3205
CC1=CC(C=O)C(=O)N1,0.1953
CCC(C=O)C#CC,0.2163
CC#Cc1nc(no1)C,0.2099
CC12CCCOCC1O2,0.3262
CN=C1CCN1C(=O)N,0.2423
CN=C1CN=COCO1,0.257
CCC1NC(=O)C11CC1,0.2748
CC1NCC=CC1=O,0.1632
FC1=NOC(=O)OC1=N,0.2153
CC1(CO1)C1CC(=O)C1,0.2257
N=C1OCC23CC12CC3,0.2618
CC1CN2C3C4C(C14)C23,0.2813
c1c([nH]c(=O)[nH]1)C2CC2,0.226
c1c(c(=O)onc1F)N,0.1748
CC1C2C3CC4C1C2N34,0.2772
CC(C)(C)C1C2CC1O2,0.3064
CC12CCOC3CN1C23,0.3132
CC1(O)C(O)C2OCC12,0.292
N#CC1CC=CC2CN12,0.2369
Cc1c(c(ncn1)N)N,0.2006
CN(C=O)C1COC1,0.2632
CC1CC2(O)CC1C=C2,0.2516
OC12CC3CC1C=CC23,0.2494
CN=C1OC2(CC12)C#C,0.2497
CNC=Nc1nc[nH]n1,0.2083
CC(C)(O)C(CO)C=O,0.2186
COCC(C)C(C)(C)C,0.3255
CC(=O)n1ncnn1,0.2129
N#CC1OCCC2NC12,0.2805
OC1C2OCC12CC#N,0.2722
OC12CC1CC(=O)C=C2,0.185
Cn1ccc(c1N)C#N,0.2133
CC1(CC1)N=C(C=O)N,0.1756
CC1OCC(N)C(=O)O1,0.259
N=C1ON=CC(=N1)C#N,0.1443
COC(C)C1C2CC1O2,0.3122
CN1CC1CC(N)=O,0.2683
O=CC1CNC=C1C=O,0.1749
CC1CC2NC(=O)C=C12,0.2136
Cc1cc(cn1C=O)O,0.1739
CC(=O)C1CC2(C1)CC2,0.2297
OCC1CC2(NC12)C#N,0.2565
CC1(O)CC11CNC1=O,0.2587
CC1(CC1)N=C(C#N)N,0.2069
CC1=CCC2C(C#C)C12,0.2411
N=C1OC2CC1C2,0.2868
C1CCC(C1)OC2CC2,0.3237
OC1CC(CC1=O)C=O,0.2181
CN1C(=O)OCOC1=O,0.2784
C1COC2C3NC3C2N1,0.2755
CC(=O)C1(CCC1)C=O,0.2125
CCC12CC1CC(=O)O2,0.2782
CC(C)C1(C)CC2OC12,0.3263
CC#CC1(CN1)C1CN1,0.2644
Cc1c(cn[nH]1)CO,0.2494
CC12OC3(CCC13)C=C2,0.2199
OCC1NCC=CC1=O,0.172
O=C1NC(C#C)C2OC12,0.2514
CC(=O)C1NC1C#C,0.2202
C1NC1C12CN1CC2,0.3027
CC12COC(C1)CCC2,0.314
COC1(C)C2COC12C,0.3052
NC1=CC(=N)N=NO1,0.2274
O=C1C2NC2C11COC1,0.2143
CC12OC3CC1N1C3C21,0.3248
C(C#N)C(C#N)(C#N)O,0.291
C1CN=COCCOC1,0.2542
CNC(=O)N1CC1C#C,0.2713
C1CC2N=COCC12,0.2675
C#Cc1nc(no1)C=O,0.1875
c1c2c([nH]c1O)COC2,0.2372
CC1C2CC1C(=O)C=C2,0.1868
CCC1CC2OCC12,0.3164
Cc1cc(=O)c(co1)N,0.179
OCC1CC1(O)CO,0.3081
C1CN=C2OC3C(C1)C23,0.2278
O=C1CC2C3N4CC13C24,0.2012
CC#CC#CC(C)C=O,0.1971
CC1CNC2=COC=C12,0.2176
CCOC(=O)NCC#C,0.2905
CCc1cc(c(o1)C)O,0.2152
OCC1CC2(CO2)CO1,0.3189
OC(C=O)C1(CN1)C#C,0.2054
CC12CCC1(CC2)C#N,0.2965
Cc1cn[nH]c1CO,0.249
C(C1CO1)C1=NOC=C1,0.2535
CN1CC2(C1)CN2C=O,0.2244
CC1CN=CN1C(N)=O,0.2284
CCNc1ncccn1,0.1894
CC(O)(C#C)C1COC1,0.2756
CC(O)C([NH3+])C([O-])=O,0.2565
N#CC12NC1C1CC21,0.2372
C#CC12CC3CC1OC23,0.2778
Cc1cc[nH]c1O,0.2353
C1C(N1)(CCO)CCO,0.2995
CC(=O)N1CC(O)C=C1,0.2087
CC1OC(C2CN2)C1=O,0.2085
CC(=N)OC1=CC=NO1,0.2469
CC1(COC1)CCC#C,0.2985
CC1(COC(=O)CN1)C,0.2386
CN1CC1C1OC1(C)C,0.3113
OCC1OC1(CO)C#C,0.2793
CN1CC11CCCOC1,0.3016
CC12CC1(O)C1(CO1)C2,0.3058
CC12CC3(COC13)OC2,0.282
CCC1=CCOC(=O)C1,0.2597
CNC(C#C)C(C)C#N,0.2718
c1c([nH]c2n1ncn2)N,0.2311
c1noc(=O)n1C2CC2,0.2467
N#CCC12CN1CC2,0.2757
CC1C(=O)CC=C1C#N,0.2065
CC(CC#CC=O)C#N,0.2041
C#CCNC=NCC#N,0.2563
OC1(CC1C#N)C1CN1,0.2695
OC1CC2C1N2C=O,0.2461
CC(O)CN1CC1C=O,0.2044
C1CN1C(=O)NCCO,0.2835
OC1C2OC(=O)CC12O,0.2686
OCCC1C2CC1C2O,0.3378
C#CCc1[nH]nc(n1)N,0.2324
CC12COCC(=O)C1O2,0.2059
COC1C(C)N2CC12C,0.3014
CC1(C)CC(O)CC1=O,0.2188
OC1(CC(C1)C#C)C=O,0.2284
CCOCC(OC)C=O,0.2129
CC1C(OC1(C)C)C#C,0.2746
O=CCN1CC1C1CO1,0.2219
CC1C2CC1(O)CCC2,0.3221
OC1(CC#C)C2COC12,0.2805
CC12OC(=O)C1(C)C2O,0.2623
CC1CC2(CO2)CC1C,0.3257
CCCC12C3CC1CN23,0.3183
CNC(=O)C(C)(N)C#N,0.2638
CC(=N)OC1=CON=C1,0.24
CC(CCC=O)CC#C,0.2283
CCNC(=O)C1CCO1,0.2655
CCC(C#C)C(C)C=O,0.2254
CC1C2OC1(C#C)C2O,0.2523
CCC1CC1C(=O)C#C,0.2029
OCC1C2CC1C2,0.3377
CC1C(OC1(C)C)C=O,0.2164
CCC12CC3(CC3)C1O2,0.3245
CC1CC(CO)(O1)C#N,0.2812
c1c(ncnc1F)C#N,0.2052
CC1(CC(C1)=NO)C#N,0.247
N=CN1C(=N)COC1=N,0.2274
c1c(c([nH]n1)N)OC=O,0.2167
C[NH2+]CC1=COC([O-])=N1,0.2352
Cc1c(onc1N)C#N,0.1954
O=C1CCN2CC2C1,0.2131
COc1c(c[nH]n1)C#N,0.2236
CN1CC(C#N)C(=O)C1,0.1836
CC1C(C=O)N1C,0.1952
O=C1CC2CCN2C1=O,0.1675
CC1(O)CC2C=CCC12,0.2592
O=CC1COCCO1,0.2129
CC1CC2CC1O2,0.3338
OC1C2C3N2CC13C#C,0.2615
COCCC(CO)C=O,0.228
CCCOC(C)CC#C,0.3066
C1OC11CC2=CCOC12,0.2296
C(C#CC#N)NCC#N,0.2178
O=C1OCCC(O1)C#N,0.2898
CC(CC1CN1)C#N,0.2904
CC1CC=CC2(O)CC12,0.2449
CCc1cn[nH]n1,0.2579
OCC1C2OC2C2CN12,0.2973
O=C1NC2=CCOC2O1,0.2381
OC1CC1C(=O)CC#N,0.2162
C1C=C(CO1)C=O,0.1827
CC1C2C(C1O)N2C,0.2882
CCOC12CC1C(=O)C2,0.2314
CC1C2C(O)CC12C=O,0.2252
CCC(C)(OC)C(C)O,0.3217
CC([NH3+])C1=CN=N[N-]1,0.254
CCC1(C)NC(=O)C1O,0.2696
CC(C)N1C=CCC1=O,0.2081
CCC(C)C(C)C#CC,0.3029
CC(=O)C1CC(CO)C1,0.2284
OC12COC3=NCC1C23,0.2175
COCCOC1CCC1,0.3244
O=CNC1CC11COC1,0.2589
OCC1OC(=N)C1C#N,0.276
CC1COC2CC(C2)C1,0.3157
CC12CC(O1)C(C2)C=O,0.2205
CC#Cc1c(non1)N,0.1948
OCC12CC1C1(CO1)C2,0.3311
CC1(NCC11CO1)C#N,0.274
COCC1(C)C(C)N1C,0.2879
CCN(C=O)C(=N)N,0.2246
CC1=CN(CC1)C=O,0.2063
CN1C2C(=O)C1C21CC1,0.2284
OC1CC2OC(=O)C2C1,0.2811
CC1=CC2(C)CC1CO2,0.2473
CC12CN1CC2(C)C#N,0.2778
CN1C2C=CCC12C#C,0.2286
CC12C3C4OCC(C14)N23,0.3188
OCC1OC1(C#C)C#C,0.2506
N=C1NC=NC(=N)C=N1,0.1721
CC1CCN(CC1)C=O,0.2701
CC#CCC(O)C(C)C,0.2933
C1CC23C4C5C(C12)C3N45,0.2933
C(C#CC(=O)N)NC=O,0.2292
C#CC(=O)CCC#N,0.21
CC1(O)CC1C(=O)C#N,0.1906
CC1C2CC1(C)C=C2,0.2401
Cc1cc(co1)OC=O,0.2267
CC12CC3C(CN3C1)O2,0.2916
CC(C)C#CC(O)CO,0.2777
COC(=O)C1OC2CC12,0.2459
CC1CCC2CC2C1=O,0.2187
O=C1OC=NC2CC2O1,0.2396
CC1CN1C(C#C)C#C,0.2595
CC(C#N)C1(C)CC1O,0.3125
c1coc(c1O)CCO,0.2195
O=CC1OC(C=C1)C#C,0.2075
CC(C)OC(=O)CC#C,0.2684
CN=C1NCC(=O)C1O,0.1896
N=C1OCC2OC1C2=O,0.2229
CNc1coc(n1)C#N,0.1645
N=COC1=NOC(=O)N1,0.2313
C1C2OC3C=CCOC123,0.2258
CCC1CC2COC12,0.3135
N#CC12CC3C1C1C2N31,0.2606
C1CC(C1)C1CCOC1,0.3253
O=C1OC2C3NC12C=C3,0.2016
CCN(CC)CC#N,0.2528
c1c(c(oc(=O)n1)F)F,0.1711
ON=C1C(O)COC1=O,0.1923
[NH3+]C(CCC#C)C([O-])=O,0.2648
c1ccn(c1)C(=O)CO,0.1934
CCCC(O)C1CC1C,0.3301
COCC1C(O)C1C=O,0.2226
OC1CN=C(C1)OC=O,0.2387
C(C1CC1)C1CC=CC1,0.2648
CC(CC#N)C(F)(F)F,0.3561
CC12COC3C4C1N4C23,0.3191
COC(C)CCC1CC1,0.3337
N#CC1C=CC2OC12,0.2469
OC1(CN2CC12)C=O,0.2115
c1c2c(co1)N=COC2,0.2087
N=COC(=O)CN1CC1,0.2235
C#CC#CC=O,0.1828
CC1OC(=N)C=CC1O,0.2062
CCC1COCC2CC12,0.3197
O=CC1CC2(COC2)O1,0.2174
CCN1CC2(CO2)C1=N,0.2448
CCN1CC1CN1CC1,0.3077
CC(O)C1C2COC12,0.307
CC1CC2(CC2(C)C)O1,0.307
CC1OC(=O)C=C1,0.2239
Cc1nc(nn1C)C#N,0.2349
CCC(CO)C(C)C#C,0.3092
COC=NCC1COC1,0.2535
CNc1nnn(n1)C=O,0.1622
CN1C=CC2NC2C1=O,0.2031
C1c2c(nn[nH]2)CC1=O,0.2148
CC1=CC=C(O1)C1CN1,0.2144
C1c2c(non2)N=C1N,0.2082
[NH3+]CCC#CCC([O-])=O,0.2727
NC1=NC(=N)OC=C1,0.1797
CC1C2CCC(C)OC12,0.3139
CC1=CC=CC2OC2C1,0.1854
CCC1(OCC1N)C#N,0.2653
CC12CCC1(O)CC2,0.3218
ON=C1C=CNC1=N,0.1453
CC(O)C1CC2OC12,0.3204
OC12CC1C1NC21C#N,0.2389
CCCCC1(CO1)C=O,0.2206
NC1=C(F)OC(=N)N=C1,0.1527
CC1OC=NC(C)C1=O,0.2003
O=C1CC2NC2C11CN1,0.2164
OC1C2[NH2+]CC12C([O-])=O,0.1671
CC1CC1(C)C(C)(C)C,0.3305
CC1CC11COC(C)C1,0.3349
CC12CC3CC1OC2C3,0.3167
CCC1OCC2OC12,0.3425
OC12CC(C1)NC2=O,0.2645
CCC1(CO)NC1(C)C,0.2943
CN1C2C3C1C=CC23C,0.2104
CC1=NNC(=N)N=C1,0.1451
CC1C=CC2C(O)C12C,0.2292
CCCC1CNC(=O)N1,0.3053
C1C2OC3CC1C=CC23,0.2499
CC12C3N1CC2C31CN1,0.3132
COC1(CC1)C1CC1C,0.3039
COC1CCC(C)CO1,0.3278
CC12CNC1=NCC2=O,0.2041
CCN1CC1(C)C#C,0.2754
COC1CC2C(C#C)C12,0.2911
CC12NC3C=CC1OC23,0.2229
CC(=N)OCCN1CC1,0.2667
CC1C2OC2CC=C1C,0.2615
CC1CC(=O)N1CCO,0.274
CC1=CNC(=O)C1(C)C,0.2126
CN(C)C1=CC(=O)NC1,0.2093
C(C1CN1)C1=NON=C1,0.2179
NC1=NC(=O)OC(=N)O1,0.2492
CC#CC12CCC1(C)O2,0.2561
C1C2C3OC4CC3C4N12,0.2966
N=C1NC2(CC2)CC1=O,0.1664
NC1C(OC1=N)C(N)=O,0.2488
CC(=O)C1(O)CC=CC1,0.2258
CC1(C)CCC(O)C=C1,0.2578
CNc1cncc(n1)F,0.1808
O=CC12CC(O1)C1NC21,0.2007
N#CC12CC=C3CN1C23,0.1746
CCC1COC2CC12O,0.2928
OC1C2OC(=O)C12O,0.246
OCC1OCC11CO1,0.3095
CCN1C2C=CC1C2O,0.2089
CC1C(O)C=CC11CN1,0.2419
NC1CN2C=C(O)N=C12,0.2214
OC1C23CCC12N=CO3,0.2289
OCC12C3C4C3N1CC24,0.2909
C1C2C3C4C5C2C(C13)N45,0.3114
OC12C3C4C1CC4C23O,0.2939
[O-]C(=O)CNC1C[NH2+]C1,0.2422
CC1CC2CC2CC1C,0.3305
O=C1NC2COC(C2)O1,0.3048
CC1C2N1C(=O)C21CC1,0.2328
CC1OCC2C1OC2=N,0.2845
CCOCCC(=NO)C,0.255
OCC12OC=NC1C2O,0.2537
CC1(C)OC1(C)C1CO1,0.3341
CC(=O)OCC1(C)CN1,0.2528
c1nc2c(o1)NCC=C2,0.1712
CC12CC1C(OC2)C#N,0.2962
CC(=O)C(CC=O)C#N,0.2188
CC1C2(O)CCCC12O,0.2939
CC1C(O)C1C(=O)C=O,0.1533
COC1OCC2CC12C,0.3447
CC1=C(CCCC1)CO,0.2503
OC1C2NC=NC12C=O,0.206
CCC(CC)O,0.3342
CC(C)C(C)C(C)C#C,0.3133
CCC12CC3C(CC1)C23,0.3338
CC1=C(C)C2OC1C2O,0.2381
CCC1(C)CCC1C#C,0.2988
O=C1CC2OC12C1CO1,0.2158
OCC12C3CC1OC2C3,0.2967
NC(C#N)C(=O)OC=N,0.2307
NC1C=CC(=N)OC1=O,0.204
CN1C2C3NC2(C)C13C,0.2902
CC1=NC2C(CO)C2O1,0.2547
CN=C1C(O)CN1C=O,0.2237
CC12CC1OC1CC21,0.3181
CCCCCN(C)C=O,0.2719
CCC1C2C3N1C2C3=O,0.2337
CC(O)CC1(CC1)C#C,0.2931
CC(O)C1CC(C)C1O,0.2988
C1CC1C1C2CCC1O2,0.3265
CC1=CNC(=O)C1C#C,0.21
CC1(COCCC=C1)C,0.2551
CC1CN=C(N)C1=NO,0.1874
O=C1CNC(=O)C11CN1,0.1978
OC12CC1C1(O)CCC21,0.2992
CC(CC=O)(C=O)C#C,0.2094
CC#Cc1cnc([nH]1)O,0.1992
O=C1CC2(CO2)C11CC1,0.2148
CC1OCOC(C)C1O,0.3313
N#CC1CC(O1)C1CO1,0.2718
CC#CC(C)CCC#C,0.2901
CC(O)C(C#N)N1CC1,0.2886
CC1CC2OC=NC12,0.2616
c1c(c2c(o1)nco2)N,0.1897
O=CCC1CC(=O)C=C1,0.1906
CC1C(O)CN1C(C)=O,0.2639
OC1C2C(C#C)C1C2=O,0.2355
CC1CC2CCOC12C,0.3151
CCC(CC)(C#C)C#C,0.2929
CC1C2OCC3C2N13,0.3159
CC(O)C(=O)CC1CC1,0.2352
CC1CC(=O)CC(=O)C1,0.2098
CC1CC2=C(O)N=NN12,0.2294
CC1=CCOC1(C)C=O,0.1962
CC1=C(CCC1)C#C,0.2063
CC1C(CC2CC2)N1C,0.2909
C1COCC2NC2CO1,0.3002
CCC1CCC1(O)CC,0.3188
COC1C(O)C1(C)C=O,0.2236
CCOC1C2NC1C2=O,0.243
CC(C)c1ncnn1C,0.2637
CCC1(C)NC1C(C)O,0.3115
c1c(c(n[nH]1)NC=N)N,0.1942
O=CC1CC2CCC2=C1,0.2129
CCC(=O)OCCC=O,0.2273
OC1=NOC(=C1)C1CN1,0.226
Cc1c(cncc1F)N,0.2013
N=C1CC2CCOC2O1,0.2866
C1C2C3COCOC2C13,0.3435
CC(N)(CCO)C#N,0.297
OC1C=CC2CC(=O)C12,0.2194
OC12CCC1NC2C=O,0.2067
Cn1c(c(cn1)OC)O,0.2298
ON=C1COCC2CC12,0.2418
OCC12CC1CN1CC21,0.285
CC1(C)C2C3CC3C12,0.2801
O=C1CC2CCCCN12,0.2726
N1C2C1C1OC2C2NC12,0.2956
N#CC1CC2CC2CO1,0.2884
CC12CC1(O)C(=O)O2,0.2618
N#CC12OC3COC1C23,0.2315
OCC#CC1(O)CC1O,0.265
CC1(CO)NC1CCO,0.3069
C(CC1CO1)C1CO1,0.3621
CN1CC(=O)C(=O)C1,0.1191
CCC1C2CN1C2C=O,0.2023
CC1C(=N)OCOC1=N,0.2713
C1CC23CCC12OCO3,0.327
OC1CCC2OCC2C1,0.3161
Cn1c(c(cn1)N)OC,0.2347
CC1=CC(=O)CC1=NO,0.1748
CC1CC1(O)C#CC=O,0.1971
CC1(C)CC2CCC=C12,0.2456
CC1CC(C)=C(C)C1=O,0.1972
CC1=NC(OC=N)=CO1,0.2213
O=CC12CN3CC1CC23,0.1922
OCC1=CC(=N)NN=C1,0.1616
CCN1C2CC3OC2C13,0.2898
OC1CC2COC12C#C,0.2644
OC1CC(=O)CNC1=O,0.2192
COCC1OCCC1=O,0.2162
CC(O)C1C2CC1C2,0.3375
CC1CC2OC(C#C)C12,0.2624
CC(C#C)(C#C)C1CC1,0.2925
OCCC1NC1C=O,0.221
c1(nc(=O)nc(o1)F)N,0.2345
CC1(C#C)C2C3OC2C13,0.2768
CC12OC(=N)C1CC=C2,0.2512
OC1C(C=O)C1(O)C#C,0.1923
CC1=CC=CC=CC1,0.1812
O=C1CC(CC2CO2)C1,0.2226
CCC1CC(=O)OC=N1,0.2491
CC1CC2(C)CC1C2,0.3732
C(=N)NC(=O)N,0.2484
O=CCN=C1OC2CC12,0.2238
CC(CO)C1CCC1C,0.3377
C1C2CC11CCCC21,0.3483
CC12NCC1(O)C2C#N,0.2542
N=C1NC(=O)C=CN=C1,0.1587
CCC1C2CC(=O)NC12,0.2655
Cc1cc(c(o1)C)CO,0.2273
CC1OC1C(C)(N)C#N,0.2912
CC1C2COCOCC12,0.3268
CC12OC3(C=O)C1NC23,0.1976
OC1CC23CN(C2)C13,0.2503
OC1C(O)C1C#CC#N,0.2143
N=C1OC=C(C=C1)C#N,0.1639
COC1CCOCC1O,0.3218
CCC(C#N)N(C)C,0.2667
CCC(CCC#C)OC,0.3056
CC1C(O)CN1C=O,0.2641
CC1=CC2CCN2C1=O,0.2127
CC1(CC2(O)CC12)C#N,0.3072
CCNC(C)(CN)C#N,0.2737
CCC1(C)CCC11CO1,0.3331
c1c(cn[nH]1)NC=N,0.2185
CC(C)C#CC(C)C#C,0.2863
Cc1ccoc(=O)c1,0.1824
OC1=CNC(=O)NC1=N,0.1898
OC1CCC11CCCO1,0.3048
O=C1C(OC11CC1)C#C,0.2114
CC1=CCC=CNC1=O,0.1951
CN=c1ccoc(c1)F,0.1876
OC12CCC1CC2,0.321
CC(O)C12CC3C(C1)C23,0.316
CN1CCNCC1C#N,0.256
OC1COC(=N)N2CC12,0.2704
CN1C=NCC(O)C1=N,0.2213
c1(c([nH]nn1)N)C(=N)N,0.2144
O=C1CC2OC1CC=C2,0.2135
CC12CC3C1CCOC23,0.3268
c1cc([nH]c1)CO,0.236
c1c([nH]cnc1=O)N,0.2085
N=C1C=NNN=NC1=N,0.1697
OCCC(CO)N1CC1,0.3149
CNC(C)(C=O)C#N,0.2039
CC1=CC2CC2C11CN1,0.2328
OC12CC1CC1(CN1)C2,0.3212
N=C1OCC2NC12C#C,0.2491
CC1C(O)C(=O)NC1=O,0.2351
N=C1OCC11COC=N1,0.2631
CC#Cc1[nH]c(=O)[nH]n1,0.1922
O=C1C2C3C4C(CN14)N23,0.2236
CC1NC2CC1OC2=N,0.2628
N=COC1CC11COC1,0.2635
CC(C#C)C1=NC=CN1,0.2509
C(CC(=O)CCO)C=O,0.2274
CC12CN1CC2(C)O,0.2911
CC12OC1C(=O)C1OC21,0.1909
Cc1cc(=O)occ1F,0.1725
COC1C=CCNC1=O,0.233
CCCOc1cnoc1,0.2247
CCC1(CC1)CC2CC2,0.3478
CC1(CO)CC2CC2C1,0.3319
OC12CC(C1)C1CC2C1,0.3287
CCOC1C(O)C1O,0.2891
CC1OCCCNC1=O,0.2543
CC1OC2CC1(C)C2=O,0.2087
CCc1cc(co1)C=O,0.1867
C1C2C3COCCC1N23,0.302
CCCC#CC(C)C=O,0.2166
CCC1C(O)C1CC=O,0.2253
OC1CC2OC12C=O,0.2134
CC1(CC2(CC2)OC1)C,0.3071
OC1CC1CNCC#N,0.2404
CC1(CC=CNC1=O)C,0.2141
CC1CC11C2CC1(O)C2,0.3282
CC12CC1OCC2=O,0.2156
CC12OC1C1(O)C(O)C21,0.2837
Cn1cc(nn1)C#C,0.226
CCc1c([nH]nn1)C,0.2439
OCC1COCC11CO1,0.3233
CC1C=CC2(O)COC12,0.2492
COc1cc([nH]c1)C#N,0.1944
CC1C2C3C4NC4C2N13,0.2827
CN1N=COC(=N)C1=O,0.1913
CCC1(O)C(O)C1O,0.2749
c1(nnon1)N,0.2038
Cc1c(ccnc1N)O,0.2147
NC1=NNC(=N1)C1CO1,0.2183
CC1C2OC2(C)C1(C)C,0.3228
C(C#N)c1c(nn[nH]1)N,0.2139
CC1C2OC3CCC2C13,0.3187
OCC1=NCC2CCN12,0.2438
CC1C2CCC(=O)CN12,0.1989
CC1CC1C#CCCO,0.2829
CC(=O)C1=CC(O)CC1,0.1907
OC12CC1CCCC=C2,0.2489
CN=C(N)C(=O)OC=N,0.1913
CC1CC(C#C)C2NC12,0.2944
OC1C2C3C=CC1C23,0.2336
c1c2n(cn1)CC(=O)N2,0.1998
OC1CCN2CC(=O)C12,0.2079
CC1CCCOC(=N)C1,0.2834
C1C2COC3C4OC23C14,0.1987
c1c(nno1)NC2CC2,0.1898
CC1NC(=O)NC1C=O,0.2021
CN1C2CC(C2)C1=O,0.2574
CC1C2CCC2C1(C)O,0.315
CC1CC(=O)C2(CC2)O1,0.2153
c1cc([nH]c1CCO)N,0.232
COC(COC=O)C=O,0.2133
CN=C1CC(=O)CO1,0.2084
CC1=CC(C)=NNC1=N,0.1618
CC1OC1(C)COC=O,0.2794
C#Cc1ccc(o1)C=O,0.1642
CC1NC11COCC1=O,0.2117
O=CC1CN2CC3C1C23,0.2015
c1cncc2c1cno2,0.1964
c1cc2cnnn2nc1,0.1694
CC1OC1COC=N,0.2827
Cc1c([nH]c(n1)C#C)N,0.1869
C1CC1COC2COC2,0.3182
OCC1=CC2CC1CO2,0.247
O=C1C2CCC1OC2,0.2065
c1cc(oc1)C#CCO,0.1909
C1CCOCCOCC1,0.3148
[O-]C1=C(NC=[NH2+])NN=C1,0.1085
C(C1CN1)C1=CC=NN1,0.2571
O=CCC1CC2CC1C2,0.2279
CC(=O)C12CC1CC2,0.2256
CC1NCC(=O)C1(C)O,0.2088
C1CC11C2C3OC2C13,0.3184
CC(C)C1(CC(=O)C1)C,0.2223
O=CC1C2C1C1CCC21,0.2262
COCC1CC2CC12C,0.3306
CCCOCC(O)C#C,0.2878
CN1CCN(C=N)C1=O,0.2378
OC1C2NC2C11CCC1,0.3104
CC12COC1C(=O)NC2,0.2437
C#CC1CNC1CC#N,0.2652
CC1C2CC2(O)C11CO1,0.3168
Cc1cn[nH]c1N,0.2396
CC12NC1CCOC2=N,0.2661
N#CCCC1NC1C#N,0.2946
OCC(O)(C=O)C1CC1,0.2077
CC1(CO)CN1C=O,0.2514
CC1=CCOCC1C#C,0.257
CC(C)(O)C1OC1C#N,0.2752
CN=C1OC2CC2C1=O,0.1848
OCC(O)C1OC1C#N,0.2659
COC1CCN2CC12,0.311
CC1=NOC(=N)C(N)=C1,0.1709
c1c(nc(o1)CO)C#N,0.2226
CCC12CN3C(CO1)C23,0.3117
OC1COC2=C1OC=C2,0.2118
c1c(nnc(n1)C=O)N,0.1633
C1C2CCCOCC1O2,0.3063
CC1=CC=C(OC=N)O1,0.2142
C1CC23OC4CC2NC134,0.2778
CC12CC1(C)C1CC2C1,0.323
CC#CCNC(=O)NC,0.2812
OC12C3CC1C(=O)C23,0.2407
NC(=O)C(CO)C#C,0.2652
CCC(C)(O)C(=O)C#N,0.1893
CC12COC1C1C(O)C21,0.2878
N=C1NC(CO1)C#C,0.2587
COC1C=CCC1CO,0.2624
CC12CNC1C(=O)CN2,0.2013
C#CC1=CCCC2NC12,0.206
CC1C2C3CN2C13C=O,0.2014
N=COC1=CN=CC=N1,0.1958
OC1CCC11COCO1,0.311
Cc1cc(c(o1)O)N,0.2129
CC1=NCCN1C=O,0.2241
c1ccc(c(c1)C=O)N,0.1627
Cc1cc(=O)ocn1,0.1981
C1CC11C2C3OC1OC23,0.3254
CC(O)C1(C)COC=N1,0.2687
OC1C2CC2C2CC1C2,0.3238
CN=C1COC(O1)C#N,0.2678
CCC1(CO)OC1C=O,0.2158
CC(O)C1=CN(C)C=N1,0.2475
C1CN1CC#CCC=O,0.209
COCC(=O)COC,0.2338
CCC(O)C1=CN=NO1,0.2335
C(#CC(F)(F)F)C(=O)N,0.2263
CC(=O)C1=C(N)ON=N1,0.1791
CC1(CC(=NO)CO1)C,0.2506
CC12C3C4C1CC4C23C,0.3222
NC12C3C4N=C1OC2C34,0.1454
CCC#CC(CO)C#N,0.2814
CC1=C(NC(=O)C1)C#C,0.1788
C1C2C3OCCOC1C23,0.322
OC1C=C(C=O)C2OC12,0.1829
C1CNC=CC(=O)C=C1,0.1716
CN1CC1CC#CC#C,0.2176
CC1(OC1C=O)C#C,0.2075
N=C1NC=C(O1)N1CC1,0.2178
CC(=O)C12NC1C1CC21,0.1938
CC1(CC1)NC(=O)C=O,0.1717
CCNc1cc(n[nH]1)N,0.2351
CC1CC1N1C=CC=C1,0.2438
COC1C2CC1(C)CC2,0.3325
CC1(CC1)CC(=O)CO,0.2343
OCC#CC1CN1C=O,0.247
CCC(C)(O)CCC#N,0.3212
c1c(c(=O)[nH]c(=O)o1)N,0.1802
C1C=CC23C=CCN2C13,0.212
C1OC1C12CC3CC1N23,0.3179
c1cncc(c1O)CO,0.2384
Cc1c(c([nH]n1)O)OC,0.2474
CC(O)C(CO)CCO,0.3277
CC(O)CCCCC#N,0.3133
OCC12CC=CC1O2,0.2449
CC12C3N1CC3(O)C2=O,0.223
Cn1c(cc(n1)O)C#N,0.1972
CCC1C2C3OC1(C)C23,0.3052
CC(OC=O)(C=O)C#N,0.2171
CCCc1ncnnn1,0.1622
c1cn(cn1)C(=O)C#N,0.164
CC(O)C1C2NC(=O)C12,0.2525
OC1CC11OC2CC1C2,0.3068
c1noc(=NCC=O)o1,0.2234
CCC1=CCC(O)C1O,0.2584
c1c(=O)c(c(on1)N)F,0.1748
CC(C)C(C)C(C)(C)O,0.3221
CN1C=NC(=N)OC1=O,0.208
CCOC1CCC11CO1,0.32
ON=C1CC2NC2C1O,0.2462
CNc1ccc(nc1)F,0.1814
O=CN1CC2CC2N=C1,0.2113
OCC1C(O)CC11CO1,0.2978
CCC1CC23CN(C2)C13,0.2587
COc1cnon1,0.2312
CN1CC2(O)C(O)C12,0.2595
CC1CC(C)=CC11CC1,0.2437
CC1OCC1(C#C)C#N,0.2723
CC(O)C1CC2CCC12,0.3185
C#Cc1cc(=O)ocn1,0.1739
CN=C1OCC11OC1C,0.2612
CCN=C1CC(C)O1,0.2778
Cc1cc[nH]c(=O)c1F,0.1821
CC1C2C=C(C)CC12C,0.2411
CCN(C)c1cnno1,0.2044
O=CC1C2C3CN1CC23,0.2209
O=C1CC2C3CC(C1)C23,0.226
OCC1C2CC1COC2,0.3181
OCC1CC1CC#C,0.3124
CC1C2N3CC3(C)C12O,0.3016
c1cocc1CC2CC2,0.242
COc1cnc(nc1)O,0.1853
OC1C2NC=C(C=O)C12,0.1773
C1CC(C1)C(=O)C#N,0.2057
OC1CC1CC=O,0.2274
CCOCc1nc[nH]n1,0.2564
NC(=O)C#CC1CN1,0.2229
CC12COC1(C#N)C2O,0.2392
CC1(C)COCCC1O,0.3201
CC1=CC2(C)OC2C1=O,0.1756
OCC12CC1C(=O)CC2,0.2257
OCC1CN=C(O1)C#C,0.2159
c1nc(nc(n1)O)C=O,0.1721
C#CC(=O)C1CC(=O)C1,0.1813
NC(C[NH3+])C([O-])=O,0.2654
OC1C2COC1C(=O)C2,0.2041
CC1C2N3CCC2(O)C13,0.2956
CC(C#CC#N)C(C)=O,0.2124
CC1OC1(CC#C)C=O,0.2176
CCCC1CCC(C)=C1,0.2576
CN1C2CCC12C1CN1,0.3122
CCCC12CC1CO2,0.3104
Cc1coc(=O)nc1C,0.1827
O=CC1OCCC1=O,0.1931
c1[nH]c2c(n1)C(=O)CC2,0.2094
O=CC1(NC2CC12)C#C,0.1981
OC1CC2(CC2)C2OC12,0.328
CC(C)C1C(O)C1(C)O,0.2925
N=C1C=CON=C1C#C,0.176
CC(=O)Cc1ccc[nH]1,0.1711
O=C1NCC11COC=N1,0.2464
COC1(C)CCC=C1,0.2585
CN1C2C=C(C)C1C2=O,0.2414
CCCC1(CC1)C=O,0.233
c1cnn(n1)C2CCC2,0.2523
CN=C1C=C(O)OC=N1,0.1858
CN1N=CC(=O)OC1=N,0.1728
CC1C(=O)NC=C1C=O,0.1811
CC1CC(C1)C=O,0.2238
CC1C(O)C1C1CC1,0.31
CN=C(C(=O)C(=N)N)N,0.1532
CC(O)C1=CNC(C)=N1,0.2446
CCOC1(CC1C)C#N,0.2914
COC=NC(C)C(C)=O,0.214
C#CC(C#C)C(=O)CO,0.2215
CC12CC1C(CO2)C#C,0.28
C1CC23OC(CC12)C=C3,0.2472
Cc1cn[nH]c1C(C)C,0.2512
c1[nH]c(c(n1)NC=O)O,0.1889
CC(O)CC1CN1C,0.2881
O=CC(C#C)C1CO1,0.2174
OCC12OCC1OC2=O,0.2462
OCC1(CC1C=O)C#C,0.2188
OC1=CC(=CN1)C1CO1,0.2338
CCCn1ccc(c1)N,0.2238
O=C1CC(C#N)C2CC12,0.2266
C#CC1=CC2C3CC1C23,0.1919
N=C1OC(=CN=C1)C#N,0.1508
OCC1(O)C2CN2C1=N,0.2352
OC1C2C3C4C2C1C34O,0.2936
CC1OC1C#CCCO,0.273
CC1C2C=C(C)CC12O,0.2406
CC1=NC(C)(CO1)C#N,0.269
CC1OC(=O)CC(C)=C1,0.2629
C1CC2OC1OCC=C2,0.2543
COCC12C3CC1OC23,0.3093
C#CC1CC11CC2OC12,0.285
CC1(O)CCC2(CC2)C1,0.3276
Cn1cncc1C#C,0.2057
c1c2n(nn1)CC(=O)O2,0.2149
CC(O)C(CO)C1CO1,0.3163
c1c(c[nH]c1N)O,0.2293
CC1C2N1CC21CCO1,0.3037
CC1=CC(=N)NN=N1,0.1662
ON=C1C2CC(C2)C1=O,0.178
Cc1c(ccn1C)CO,0.232
OC12C3OC(C13)C21CO1,0.2867
COCC(C)C(O)C=O,0.2158
CCC1COC(C)(C)O1,0.3294
OC1C2C3C1N=CN23,0.2292
OC(C=O)C#CCC#C,0.2164
OC1CC11OC2CCC12,0.2911
C#CC#CCCNC=O,0.228
CC1OCCC(O)CO1,0.317
ON=C1COC2CC12O,0.2304
N#CC12NCC3C1CC23,0.2616
CN1CC2OC=NC2C1,0.2419
CC1C2C1C(C)=CC2C,0.2435
CC#CC(C)OC=O,0.2699
C1CN(C1=O)C(=O)CN,0.2127
O=C1CN=C(N1)C1CO1,0.2263
CN=C1OC(C=O)C1C,0.2122
C1CC2C=CCCC12,0.2615
c1coc(c1N)OC=O,0.1999
OC1CCC2CC12C#C,0.288
CN1C(C=O)C(O)C1=O,0.2047
CC12OC(CC1=O)C=C2,0.1985
CN(C=O)C1CC1(C)O,0.2625
O=CCN1CC2CCC12,0.1978
CC(C)OC(C)C#C,0.2959
CCC(OC=O)C(N)=O,0.2501
FC1=NC(=N)NC=N1,0.1855
C#CCc1cc(on1)N,0.2292
O=CNC12CC1C=CC2,0.2454
CC1OCC(O)CO1,0.3303
CCC1OC1C=O,0.2193
CC(O)(CO)C(N)C#N,0.29
CC(O)(C=O)C1CCO1,0.2066
C#CCC1C2C3OC3C12,0.2802
CC1(COC1)C#CC#N,0.2255
C1C2(COC2)COC=N1,0.2697
COc1c(non1)C=O,0.1859
O=CN1CCN2CC1C2,0.2562
CC1OC(C#C)C1CO,0.2644
OC12CCC(C1)COC2,0.3136
COCC1CCC11CO1,0.3316
CCC1(CO1)C(N)C#N,0.2919
C1C2CC3N=COC2C13,0.267
CC1CC2C1C2(O)C#N,0.2887
CC1=CC2C(O)C1C2O,0.2443
C1C2(N1)CN(C2)CCO,0.2786
OC1C2C3CC(O3)C12O,0.2962
O=CC12NC3C(C=C1)C23,0.1851
CCC1CC(N)(C1)C#N,0.2936
C(=O)Oc1[nH]c(=O)on1,0.2227
CC1(CC1CC#N)C#N,0.3082
N#CC1CNC11CC1,0.2535
CN1C2CC2(O)C1C#C,0.2373
C1C2C3CCC1C23,0.3435
CC(CC#C)NCC#N,0.2722
C#CCOc1cc[nH]n1,0.2474
N=C1NN=CC=NC1=N,0.159
CC1CC2(CO2)C1=NO,0.2319
C#Cc1cn[nH]c(=O)n1,0.1619
CC12OC1C1C3OC1C23,0.3031
C1C(COCO1)(C=O)O,0.202
CC(O)C(N)C(N)C#N,0.2664
OCC12CCC1OC2=N,0.2784
OC1CC2(O)C3CC1C23,0.3152
CCc1cn[nH]c1OC,0.2541
c1cnc2c(n1)CCN2,0.1765
CNC(CN)(CN)C#N,0.2699
Cc1cc([nH]c(=O)c1)O,0.1828
CC(C)C1CC2(C)OC12,0.3231
N=C1NC2=C(CCN2)O1,0.2253
CC1C2OCCC2C1=O,0.2115
CC(=O)C12CCCC1N2,0.2226
CC1C(C)C2(CC2)C1C,0.3332
CNC(CN(C)C)C#N,0.2607
C1C2C=CC1C1OC21,0.2374
CCOc1coc(=O)[nH]1,0.2455
N=C1OCC=CNC1=O,0.184
CC1CC11CC(C)C1,0.3417
OCC1CC11C2CC1O2,0.2948
CC(C)(C)C#CC(=O)N,0.2338
CCOCC1CCC1=O,0.2218
C#CC(=O)NCCO,0.2336
CC12C(O)C3CN1C23C,0.3001
c1cn(cn1)CCC=O,0.1887
OC12CC1CC1(CC1)C2,0.3331
C#CC1C2CC3C2CC13,0.3059
O=C1CC2CC3CC1N23,0.1973
C1OC11CN=C2NCC12,0.2508
CC(C)CC(O)CO,0.3159
CCC1OC(C#N)C1C,0.2777
CC(C#N)C(=O)NC=O,0.2177
COC1C2C(O)C1N2C,0.2911
CC(C)NC(=O)N,0.301
CC12CC(O)C1=CCC2,0.231
CC12C3C4CC(N14)C23O,0.2819
C1C(CO1)OCCC#N,0.2857
O=C1C2CCC1COC2,0.221
Cc1cn[nH]c1C(=O)N,0.2127
COC1=NC(=N)ON=N1,0.1652
CC1CC1CC(F)(F)F,0.3665
OCC12COC(CO1)C2,0.3248
CN=C1COC(O1)C#C,0.2705
CC1OC2COC12C=O,0.2046
Cc1cc(oc1)CO,0.2332
CCC1CC(=O)NC1=N,0.2492
CNC1CN2N=CN=C12,0.2591
CCCC(=O)N,0.2789
CCCNC(C#C)C#N,0.2564
CC1OC23CCC2C1C3,0.3008
CN1C2C3OCC1C23,0.2867
CCc1c([nH]cn1)C,0.2437
C1C2C1C1NC21,0.2857
COC1C2OCC12C,0.2929
CCCNc1cn[nH]n1,0.2132
CC1(C)NC1CC#C,0.2981
CC1(O)C(O)C1C1CO1,0.3063
COC12CC1OCOC2,0.3318
CC1(C#N)C2CN1CC2,0.2594
CC12CN1C(=O)CC2=O,0.2079
CC12CCN1C2C(N)=O,0.2481
CC12OC3C1CC(=O)C23,0.2096
CC1CCCCC11CC1,0.3427
CC(OC=N)C(O)C#C,0.2726
CNc1nc(on1)C#C,0.1797
CC1C2C3C4C(CN13)N24,0.2745
Cc1cc([nH]n1)C#C,0.2126
COCCC1COCO1,0.3407
CC1CCC11CC(=N)O1,0.2865
COCC12CCC1(C)O2,0.3197
CC12CC1C=CN2C=O,0.2028
CCC(=NO)C1CN1C,0.2212
Cn1c(c(nn1)N)C#N,0.1867
CC#CC1CC1(N)C#N,0.2487
CC1(O)C2CN=COC12,0.2654
CC1C2CCC2C11CC1,0.3345
CC1=CC(=O)C2OCC12,0.1788
CCc1cn[nH]c1CC,0.2497
CN=c1oc(no1)C#C,0.1846
CCCC#CCO,0.2785
CC1C(C#C)C1C1CO1,0.2883
O=CC12CCC=C1CN2,0.1886
Cc1c(nc[nH]1)C,0.2443
OC1(CC2OC12)C1CC1,0.3221
CC(C)(O)C1OC1C=O,0.223
CC1OC(CO)C1CO,0.3065
CC1(C)OC1CCC#C,0.3147
N=C1C=C(NC=N1)C#C,0.1625
COCC12CC(C1)C2C,0.3416
CC1(CC1)C1CCO1,0.3302
CC1(O)CCOC1,0.3141
CC1(C)OC=NC1C#C,0.2704
CCC1OCC1(O)C#C,0.2723
CCN(C=O)C(C)C,0.2706
C#CCC1C2CC1C=C2,0.2401
CCC(C)(OC=N)C=O,0.2143
NC1(CC1N1CC1)C#N,0.2645
CNC(=O)C(O)CCO,0.2722
N#CC1CCCC=C1,0.264
C1C2C3OC4C=CC2C134,0.1774
CC(C)C(=NC)NC=O,0.2275
CC(O)C12CC3CC1C23,0.3188
C1CC23C=CC4C2C1C34,0.2227
OC1C(O)C1C(=O)C#N,0.1702
CCCn1c(cnn1)N,0.2352
CC(C)CC(C)(C)O,0.3234
CCC(O)C(=NO)C#C,0.2075
CC1CCC1(O)C(N)=O,0.2755
CC1(CO)CC1OC=N,0.2705
C1CC1C12C3C4C3N1C24,0.2764
CC1C2OC3C2N1C3=N,0.2156
O=C1CC2COC=NC12,0.2101
C1OC1C12CC1OC=N2,0.2587
N#CC1C2C3C1CCN23,0.2857
OC12CCC3C(CC1)C23,0.3291
CC(C)(C)c1ccc[nH]1,0.2444
OC1(CC#N)CN2CC12,0.2654
c1c2c(co1)NCCN2,0.214
O=CC1CC11CCC1=O,0.2037
COCCc1ccc[nH]1,0.2431
CC1(COCC1O)C=O,0.2297
COC12CC(CO1)C=C2,0.2472
CN1CCOC(C1)C=O,0.1948
CC1C=CC2C(O)CC12,0.2472
CNC1=NC2CC2(C)O1,0.2681
CCC1OCC2C1N2C,0.3057
CCC1(CCC1)CCO,0.338
c1(c(=O)nc(on1)F)N,0.1966
CC12CC3C(OC=N1)C23,0.2641
CC(CO)C1OC1C#C,0.2763
CC(=O)COCC=O,0.221
CC(O)C1NC1(C)CO,0.2979
COC1(C)CNC1=NC,0.2522
CCCC1CC2(CO2)C1,0.3334
O=CCC1NC1CC=O,0.2175
CC1=CCC2CC12,0.2483
C1C2CC3OC1C2C=C3,0.2459
CCCC1(CN1)C(C)O,0.3121
CN(C)C(=[NH2+])C([O-])=O,0.1931
OC1CN(CC#N)C1=O,0.2569
OCC1CCC(CO)C1,0.3382
CC1(C(=NO)CN1C)C,0.2223
OCC1(CO)CC(=N)O1,0.282
O=CCC1CC2CC2C1,0.2275
CC1=CNC(OC=N)=C1,0.2112
C1CCCC=CCCC1,0.2608
Cn1c(c(nn1)O)C#C,0.1941
CC12CCC(C1)COC2,0.3224
CC1CCOC(C)O1,0.3484
C1CC2=CC=CC=CC12,0.1686
CC12CCN1C21COC1,0.2997
O=CC(CC1CN1)C#N,0.1976
CC12CC1(C#C)C(=O)O2,0.2501
ON=C1CC(O)C1,0.2488
CCC1NC1(C)C=O,0.2221
c1cnoc(=O)c1F,0.1857
CCNc1cc(c[nH]1)O,0.2224
CC(C1CC1[NH3+])C([O-])=O,0.276
CC1(C)C(O)C1(C)C#C,0.28
Cc1c(nco1)N,0.2099
N=C1CC2(CC2)CCO1,0.2792
O=C1C2CC3OC1OC23,0.2087
CC1N2CC2C2CC12O,0.2915
CC(C)(C#N)C1(C)CN1,0.282
Cc1c(cn(n1)C=O)N,0.1806
C#Cc1ncc(o1)C=O,0.1736
CC(CC#N)C1(O)CC1,0.2955
CC(O)CCCCO,0.334
CC(C)(C)C(O)CO,0.3125
CC(=O)OC1CNC1=O,0.2597
CCC12CC(C1)C2(C)C,0.3576
N#CC12CC3CC1C3N2,0.2696
CCN=c1cnocn1,0.1942
OC12C3OC3C1OC2=N,0.2657
CC1(CC1)NC(=O)C#C,0.228
CC1(CC2OC12)OC=O,0.2718
C#CC1OC11CC2CC12,0.2693
c1c(nc(o1)N)CO,0.238
N=COC1=CN=NC=N1,0.1731
C1OC2C3C=CCC23O1,0.2365
ON=C1CC=CC2NC12,0.2319
CC1=C2CN3C4C(C14)C23,0.1807
CC1OC(C#N)C11CO1,0.2768
CCC1OCC1(C)C#N,0.2886
CC12CC1COC(=O)C2,0.276
CN1CC(=O)CC1=O,0.2094
CC12C3C1C1=CCC3C21,0.1618
CCc1coc(=O)[nH]1,0.2398
C1C2C3OCCN2C13,0.3046
C1OC1C1=CN=CC=N1,0.1969
CC1C2C3OC3(C)C12C,0.324
OC1CC2CC2C(O)C1,0.3194
N=C1C=NC=NNC1=O,0.1583
CC1C(O)C(=O)OC1=N,0.2586
O=C1CCCC1C1CC1,0.2167
CN1N=NC=C(N)C1=N,0.1644
CC#CC(C#C)C1CN1,0.2731
Cc1cc2c(o1)cno2,0.1994
N=C1C=CC=CNC1=O,0.1567
CC12C3C4C(CC13O)N24,0.2825
N=C1NC(=O)C=C1C=O,0.1503
OC1CC11COC11CC1,0.293
CC(COCC#C)C#N,0.2878
CC1CC2(CCC2)O1,0.3164
CCOC(=N)CO,0.297
CCC1C2C3N2CC13O,0.2936
CC1COC2CCC2C1,0.3163
CNC(C#N)C(C)C#C,0.277
CC1CC2OCCC12,0.3135
Cc1c(nn(n1)C=O)C,0.2124
CCC(O)COCC#N,0.2709
CC(C)(C)C(O)C1CC1,0.3409
N=C1CC2=C(O1)N=NN2,0.2125
NC(C[NH3+])[C-](C#N)C#N,0.186
C1CC23C=CC4C2N1C34,0.2237
CCC1(CN1)C1CO1,0.311
CC1CC1C1=NON=N1,0.2153
C1NC1C1OC2CC12,0.3043
COC(=O)C12CC1CO2,0.2439
CC1C2CC3CC2(O)C13,0.3183
Cc1cc(nc(n1)F)N,0.2197
N=COC(=O)C(=O)C=O,0.1293
O=C1CCOC(C1)C#C,0.2223
N=C1C=NON=CC1=O,0.1688
FC(F)(F)C1C2CCN12,0.3211
CCC12CCC(N1)C2=O,0.2277
CC1CN1C1CC1,0.3135
C(C=O)NCC(=O)N,0.2171
O=C1CCC2NC12C#N,0.2151
CC1=CCOC1OC=O,0.2581
OCC(=O)C1NC1C#N,0.2186
CC1C2OC(=N)C12C,0.2776
OC1CC23CC(N2)C13O,0.3032
N#CC1CC(N1)C#N,0.2621
O=CC1=NC2CC3C2N13,0.1809
c1(c(oc(=O)[nH]1)O)N,0.2423
COCCOC(=N)C#C,0.2308
CC12C3CN1C3C2C#C,0.275
O=CC1NC1CCC#N,0.2214
OC1CNC=NC1C#N,0.2514
CCc1cc(n[nH]1)N,0.2315
C#CCCOC1CC1,0.3038
O=CC1OCC=C1C#C,0.1876
CCC1CC2OC2C1C,0.331
CN=C1NC=C2COC12,0.1839
CCc1cn(cc1N)C,0.2253
O=C1OC2CC(C#C)C12,0.2695
CNc1nc(cn1C)O,0.2222
CC1C(O)CC2CC12C,0.3217
COC1C(C)C1O,0.2949
CC1CCCC=C1,0.2651
CC1OCC(=O)C2OC12,0.2045
CCC1CC2(CC)CC12,0.3274
CC1CN1C1(C)CC1,0.3012
OC(CCC=O)C1CO1,0.2284
CC1(CC=O)C2CC1O2,0.2272
CCC(C(C)O)C1CC1,0.3289
CC1CNCC(O1)C#N,0.247
N=C1OCCCN2CC12,0.2352
CC(CO)C1CC1,0.3416
CC1(C(C1(C)C)O)C,0.3099
CC(OC=N)C#CC#C,0.2239
CC1CC2=C(N1)C=CO2,0.2045
CCC(NCC#C)C#N,0.2749
O=C1C2C3C4C(CN23)N14,0.214
ON=C1CC(O)C(=O)C1,0.2189
CC1C2NC(=O)C12C#C,0.2434
c1coc2c1onn2,0.1911
CC1=CC(C)(C)CC1O,0.2599
N#CC12OC1CCC=C2,0.2329
CC(=O)C(=O)C,0.1582
CC12CCC1CCC2O,0.3172
CC12CC1(CO2)OC=N,0.2543
OCC(=N)OC(=O)CO,0.2308
CCCC#C,0.3169
C1C2C3C4C5C(C1N35)N24,0.2613
Cc1cc(co1)CCO,0.2344
CC(C)CN=COC=O,0.2415
C1C2NC22CN=COC12,0.2726
CC(C)(CN=COC)O,0.2535
CC#CC#CC(O)CO,0.2159
CC1C(O)C2OC12C=O,0.2176
O=CN1C2CCCCC12,0.2568
c1c(n(cn1)C=O)N,0.179
CC(C)C#CCNC=O,0.271
CC(O)(C#N)C(=O)C#C,0.1926
c1nc2c(o1)CN=C2N,0.2128
CC12CC(CC3NC13)O2,0.3068
O=CNCC1CN=CO1,0.2667
c1c(n[nH]c1N)C(=O)N,0.2113
OC12CCC1=CC1CC21,0.2377
CCC(=O)C1(CC1)O,0.226
c1c(cn[nH]1)CC#N,0.2626
OCCC12CC(C1)O2,0.3126
N=COC1(CC1)C=O,0.2214
CN=CNC(=O)NC=O,0.2254
CCC1N=COC1(C)C,0.2688
CC(C)CC(O)C=O,0.2364
CC1CCOC=N1,0.2714
OC1C2OC2C=CC1=O,0.1868
CC1COC23CC12OC3,0.2753
CC1C=C(C)CC1=O,0.2226
OC1C(CC#C)C1C=O,0.2207
O=C1C2NC2C2OCC12,0.2053
c1c(nc(o1)N(=O)=O)O,0.155
CC(O)CN1C=CC=N1,0.2593
CC1(O)C(O)C1CC#N,0.29
CC12OC3C1C(CO)C23,0.2972
OCCC1CC1CO,0.3347
O=C1CCCC2OC2C1,0.2213
O=C1C2CC3(COC13)N2,0.197
CC1(C)C2C3CC2(C)N13,0.3153
CC1COC(C)C(C)O1,0.3154
C1C2OC11CC3OC3C21,0.3046
COC1CC2(C)CC2O1,0.3275
CNC(=O)C1=NCCO1,0.2152
NC(CC#N)CC(N)=O,0.2567
CC(=O)N(C)C(=O)CO,0.2212
CN1CCC=CCC1=O,0.2338
CC(O)C(=O)C1CC1,0.2374
CC12C3CC4C(OC14)C23,0.3256
CC1(CCC2OC12)C=O,0.2224
C#CCCCCC#N,0.3027
O=CC12CC(C#N)C1N2,0.22
CC1(CCO)NCC1=O,0.2107
O=CC1C2CC2C11CO1,0.2196
C1OCC11C2OC=NC12,0.2505
COCC1=COC(=N)N1,0.2151
COC1CCC1C#C,0.2953
CC(COC(C)=N)C=O,0.2252
CCC1C2CC2C1CO,0.3246
C(C#N)N=C(C=O)N,0.1913
CC1(CCOC1=O)C#C,0.2583
CCC1(CC1O)C1CO1,0.3329
N#CC12NC3=NCC1C23,0.1711
C1C2C3C4C5C4C(C35)N12,0.3035
CC1CC2=C(N1)C=NO2,0.1961
NC1=C(F)ON=NC1=O,0.1992
CN=C1NCC1OC=N,0.248
COCCC(O)C#CC,0.2876
COC1CC2C(O)CC12,0.3101
O=CNC12C3C4C3C1C24,0.2516
CC1CC(C1)OC1CC1,0.3298
CC12CC1C=CC(=N)O2,0.199
Cn1ncc(n1)CC#C,0.2465
CC#CC(=O)COC,0.2091
CN(C=O)C(=N)OC,0.2456
Cn1ccc2c1C=CC2,0.1777
OCC1CCC1(O)CO,0.3064
N#CC1CC2(CC2)CO1,0.2943
O=C1OC2CC3CC1C23,0.2692
CC1(O)CCC=CC=C1,0.2026
CC(C)(O)C1CC(=N)O1,0.2894
OC12CC3OC1OCC23,0.3113
CC1CC(C1)C(=O)C=O,0.155
C#CC#CC#CCCO,0.1853
O=C1C=CC2C3NC3C12,0.1807
CC1C2C(O)C1N2C,0.2846
C(=O)c1[nH]c(c(n1)O)N,0.1533
N=COCC(=O)C1CN1,0.217
OC(C#N)C1CC1,0.3095
CC1(C=O)C2OC2C1=O,0.1949
COC(C#N)C(N)C#N,0.2694
O=C1CCC2C(C#N)C12,0.2221
OC1=C(O)C=CC(=N)O1,0.1499
FC1=CC(F)=CC(=N)N1,0.1777
c1c(c2c([nH]1)OCO2)N,0.2144
CC(C#N)C(N)=O,0.2773
c1c(c(c(nn1)F)N)O,0.2041
O=C1CN2CCOCC12,0.1976
CCOC(=O)COC,0.2806
CCCC1(C)OCC1C,0.3199
O=C1CCNC2COC12,0.2029
OCC1CC2(CC12)C#C,0.2694
O=C(C#N)C12CN1CC2,0.1797
CC1CC2=C(N)N=CN12,0.2235
CC#Cc1c[nH]c(n1)O,0.2094
CCC1C2CC(C2)C1O,0.3183
C(CCC(=O)N)CC=O,0.2283
OC1C=CCCN2CC12,0.2366
C#Cc1ccc(=O)[nH]n1,0.1633
C1Cc2c(oc(=O)o2)C1,0.2541
CCC1(C)CC1C=O,0.2263
ON=C1C2CC1(O2)C=O,0.2064
CCC(C)C1CCC1O,0.3259
CNC(=[NH2+])CC([O-])=O,0.2372
CCCN=CNC(=O)N,0.2496
COC1CC2CN3C2C13,0.3021
N=C1N=CNC=N1,0.1937
CC12CC(COC1)C2O,0.3063
C#CCC1OC1C1CO1,0.3078
COCC(CO)C#CC,0.2978
CCC1(O)C2OC(=N)C12,0.2661
CC(C)(C#N)C1CCC1,0.3421
CC(C)CCOCC=O,0.2292
CC(=O)NC=NCC#C,0.2346
OCC1=CCCC11CN1,0.2422
COc1c(onn1)CO,0.1991
O=CCOC1CNC1=O,0.2171
O=COC1OC2CC1C2,0.2727
CN=C1CCC(=O)CO1,0.2155
CC1CC(C)(O1)C1CO1,0.3259
C#CC12CCC(C1)OC2,0.2916
CC1(CCOC12CC2)C,0.3024
CC(C)C1CCC2CC12,0.3416
CCC1CCC(C)=C1C,0.2533
C1C2CC3COC3CN12,0.2923
CN1C=C(C=N1)C1CO1,0.2469
C1CC12C(=O)C3(O2)CC3,0.21
O=C1C=CNC2CNC12,0.1822
CC1=C(CC(=O)C1=O)N,0.1546
CC1(O)CC(=O)NC1=N,0.246
CCNC(=O)NC(=O)C,0.2441
CC1(O)CC1C(=O)C#C,0.2012
CC(O)C(=O)N(C)C,0.2684
Cc1cc(oc1)CC#C,0.2343
CC12CCC1CC(=O)N2,0.2752
c1cc-2cc[nH]cc2c1,0.1477
CC(=O)CCC#CC#N,0.2258
COC(=O)C(C)O,0.2695
CC(=O)CCCCC#C,0.2342
C#CC12CCCCC1N2,0.278
CC1=CC2(C)NC2CC1,0.2495
N=C1OC2(CC2)C2CC12,0.2662
CC(C)OCC1CCO1,0.3188
CC12CN(C1)C2CO,0.3031
CC12CCC3N1C2C3=O,0.2246
OC12CC3N=COC1C23,0.2571
CC12NC1CC1CC21O,0.3036
NC1(C#N)C2CN2C1=N,0.2236
O=CCOC1CC=CC1,0.2198
COCC1NC1C(N)=O,0.2577
O=C1NCC23CC(O2)C13,0.2611
CCN=C1C=NON=N1,0.1629
CCC1(CC(O)C1)C#N,0.3082
OC1COC=NC1,0.2733
CC#CC1C(C)C1(C)C,0.2785
CNc1c[nH]ccc1=O,0.1754
c1coc(c1CCO)N,0.2165
OCC(=O)C1C2COC12,0.2196
NC12C3CC1(C3)OC2=N,0.1845
O=C(CC#N)C1CN1,0.2268
CC#CC1C2CC(=O)N12,0.2282
c1c(onn1)CNC=O,0.2267
CC1OC2C3NC1C23O,0.2848
CC1CC2=C(C1)C=NO2,0.2332
CC(C)c1cnoc1N,0.224
c1c(c(ncn1)N)N,0.2013
C1C2C3OCCCN2C13,0.2941
CCc1coccc1=O,0.2007
CCOC1C(C)C1CO,0.3153
CN=C(C)OC1CC1C,0.2697
CCC12CC(C1)C2(C)O,0.3263
CC1C2OC3OCC2C13,0.3304
CCC12CC(C1)C2OC,0.3409
Cc1c(=O)n(ncn1)C,0.1726
O=CC1C2C3C4C1C2N34,0.2007
CC(O)C1C=CCC1O,0.2626
OC12CC1C1(O)CC2C1,0.3202
OCC(O)C#CC1CO1,0.2652
c1cc(oc(=O)c1)CO,0.1766
CC12C3N1CC2CC3=O,0.2135
O=C1CC(C#C)C(=O)N1,0.236
CC1=CC2C=CCC2C1,0.2474
C1CCC2(C1)CN2C=O,0.2487
CCC(C#N)C#N,0.3284
OC1CCC=C2CCC12,0.2549
CC1NC1C12CC1CO2,0.3008
OC1C(CC#C)C1C#N,0.2872
CCOC1CC(C)CO1,0.3419
CC(O)C(O)C(=O)C=O,0.1535
CC1=CCn2c1ncn2,0.2003
c1conc1C2CC2,0.2512
N#CC1C=CC2COC12,0.2558
CC1N2C3CC2C1(O)C3,0.2935
CN1CC1C(=N)NC=O,0.1996
CC1C2C3N1C2C3=NO,0.2384
O=CC(NCC#N)C#N,0.2128
COC1OCC=C1CO,0.2596
Cc1cnc([nH]1)C(=O)C,0.1834
CCCc1[nH]c(=O)on1,0.2561
CC12CCC1N2CC=O,0.2229
CC1C2CC2(O)C1C,0.3051
COC(C)CN1CC1C,0.3123
CCc1c(nn[nH]1)N,0.2152
CC(C)C1C(C=O)N1C,0.194
CC1(O)C=CCC11CN1,0.2483
CC1(CO)CCOC=N1,0.2676
OC12CC1C1CC(C1)C2,0.3316
CC(O)C1(CC=O)CO1,0.2223
OC1C=CC2C(C#N)C12,0.2371
CC1(C=CCCCO1)C,0.2644
COC1C2C(C)CC12O,0.2988
OCC1=NC(CN1)C#C,0.2526
O=CC1CC1OCC#N,0.2259
CCCN(C=O)C(=N)N,0.2243
c1coc(c1N)N2CC2,0.2091
C1C2OC2C11OCC=C1,0.234
CC1CCC2C(O)C12C,0.3115
C1OC2CC11NC1CO2,0.3181
O=CC1OCC1CC#C,0.2095
O=CCC12NC1C1CC21,0.1872
O=C1CC(CC2CC2)N1,0.2836
CC1(CC(O)C=C1)C=O,0.214
Cc1cccnc1CO,0.2254
C1CC1C1(CO1)C1CO1,0.3373
CC1C(=O)N(C)C11CC1,0.2652
CC1C2CCOC1C2O,0.3021
CC1=CCC2(CC1)CC2,0.2625
CN=C1OC=C(C)C=N1,0.1601
Cc1cc(c([nH]1)C=O)N,0.1691
CC1(CC1)n2cccn2,0.2611
CC1C2CC1(C2)C(C)=O,0.2203
CC(CC1(O)CC1)C=O,0.226
CC1C(CO)N1CC#N,0.2606
c1cc(ccc1O)O,0.1961
O=CC(CC#N)C1CO1,0.2232
NC(=O)C1C2C3OC1C23,0.2546
CC1(COCCO)CO1,0.334
CC1=CC2C3C1CC23C,0.2321
O=C1CN2CC(C#N)C12,0.207
CC1OCCC=CC1C,0.255
C1CC1COC(=O)CO,0.2736
CC1(CO)C2CC(=O)C12,0.2286
CC1OC2(CC#C)CC12,0.2824
COCCC(C)(O)C=O,0.2239
C1CC=C(C1)CCC=O,0.2126
N=C1COC=NCCO1,0.2496
OCC12CN(C1)CCO2,0.2859
CC1CC2(C1)CCCO2,0.3133
c1c(nnc(n1)CO)N,0.1663
CC12OC1C1C(O)CC21,0.3103
C1C=Cc2c(nno2)O1,0.1561
CCNc1cnnnn1,0.171
CC1CCC(CC#N)=C1,0.2539
C#CC1(CCO1)C1CO1,0.2734
FC(F)(F)C1NCC=C1,0.237
CC(O)CC(=O)C(N)=N,0.1845
C#CC#CC(=O)CC#N,0.1835
CC1OC2CC(C)C=C12,0.2431
CC1(COC1)C(C)(C)C,0.3074
C1OCC11C2CC=CC12,0.2437
CC1OC2C3OC3CC12,0.3089
OCC(O)C1=CN=NO1,0.2204
CC(=O)c1[nH]cc(n1)O,0.1653
OCC(=O)C(O)C1CC1,0.2326
CN1C=C(N)C(=N)C=N1,0.1614
c1c([nH]c(=O)o1)C(=O)N,0.1884
C1C2OCCC3C2N13,0.3147
CC12NC1COC2=O,0.2539
C#CC1C=CCC2CN12,0.2403
CC1C2OCC1C(=O)O2,0.2744
O=CC1CC(O1)C1CC1,0.2119
c1c(=O)occ(n1)O,0.1425
N=C1OC(C=O)C2CC12,0.219
OC1C2OC1C2C1CC1,0.3176
OCC1(O)C2CC1C2,0.3177
CC1C2C(O)C=CCN12,0.2282
COC1CC(C)(O)C1O,0.3051
CC1CC2CCC2C1C,0.3455
c1([nH]c(=O)nc(n1)F)N,0.2272
CC(C)C1CC2(O)CC12,0.3264
CC1(CN1CCO)C,0.3096
CC12C3CC1COC23,0.3169
O=CC1C2CN3CC1C23,0.1829
N=C1C(CN1C=O)C=O,0.2152
[O-]C(=O)CCC1C[NH2+]1,0.2766
OC1CN2CC2C1C=O,0.1941
CC1C2N3C=NC1C23C,0.2363
NC1=NC(=O)N=NO1,0.2669
OCC1CCCC(=N)O1,0.2775
C1C=CC(=O)N1C(=N)N,0.174
CC1OC(=N)C1CC#N,0.2844
CC(=O)C1(O)CCOC1,0.2281
OCC1CC=C(C1)C#C,0.2097
OCCC12CC1C(O)C2,0.3216
CCN=C(COC)OC,0.2551
CCCCOC1(CC1)C,0.3318
Cn1cccc1CO,0.2415
CC1COC(=N)CC=C1,0.2528
CC1C(=O)C(C)C11CN1,0.2136
OC1(CC1)C1C2CCN12,0.2866
CC1C(=O)C2CC12O,0.2246
OCC1CC(=O)C11CO1,0.2048
CC1(O)C2CC3C2CC13,0.3308
CC1(CO1)C(C#C)C#N,0.2914
CCC1C2CC1C2CO,0.3296
O=C1C2NC2CC2OC12,0.2054
CN(C)CC=O,0.2016
CC1(COC(=N1)N)C,0.2815
NC1C2CC2C1(O)C#N,0.257
OC1C=CCOC1C#C,0.2516
CC(O)C1CC2CC2O1,0.324
OC12COC3C4C1N4C23,0.3068
COC(CC(N)=O)C#N,0.2761
O=C1CC2C3CC(O3)C12,0.2179
Cc1c(ocn1)NC=N,0.2413
CC12CC(C)(C=C1)C=C2,0.2142
c1cnc2cnnn2c1,0.1697
C1C2C3OC1OC23,0.3341
OC1C2C3CC1(C=O)N23,0.2147
CC#Cc1ccccn1,0.1961
CC1CCC(=O)N1,0.2737
CCC1C2CC3(C)C2N13,0.3238
CCC(C)(C)C(=O)N,0.2749
CN(CC=O)C(=O)C#N,0.2052
CC1CC2CC3C2CC13,0.3439
CC1C(C)N2C1CC2=O,0.2353
CNc1c(cno1)N,0.217
c1(nc(=O)onn1)F,0.1662
OCC12NC3=NCC1C23,0.1699
CCC(C)C(O)C(C)=O,0.237
CCC(CC)(CO)OC,0.3135
CC12CC1(O)CC2C=O,0.2164
O=C1COC1CC1CO1,0.2242
CN1C=NC(=N)C(O)=C1,0.1873
OCC1N=C2NC3C1C23,0.1724
CC(O)C1C2CC1CC2,0.3363
CNC1(COC1C)C#N,0.2669
CC1CC1OC(C)(C)C,0.3125
CC(=O)CC1CCC1O,0.2341
OCC(O)C12CC1CO2,0.2881
CC(=O)C(=O)C(=O)C#N,0.1319
CC1CC2CC(C2)C1=O,0.2263
CN=C1OC2C(C)C12N,0.2447
c1c(nc(n1C=O)O)O,0.1607
CC1(CC1)C1OC1C#N,0.2723
C1N2C3C4OC4C=C1C23,0.2093
CC(C=O)C1=CNN=N1,0.2212
CN1CC11CNCC1=O,0.1915
OC1C2CC1(C2)C#N,0.3085
CC(=O)C1CC(C)(O)C1,0.2308
N=C1ON=CN=C1C#C,0.1494
CC1(C=O)C(O)C1CO,0.228
ON=C1CN=C2OCC12,0.239
C#CCCNC(=O)CO,0.2701
CCCCc1cc[nH]n1,0.2665
CC1C(=O)CC11CO1,0.2149
C1N=CN2C3C4OC3C124,0.2325
O=CC12C3CN1CC23,0.2172
OC1=CC=CC(=N)N=C1,0.1441
CCC(C)CC,0.3874
CC(C)(C)C1(CC1)C=O,0.2255
Cc1c2c(co1)CCO2,0.2182
CC12C3OC(CC1O)C23,0.3095
CCC12CN1C(=O)OC2,0.2871
CC1CC2(C)C1C2(C)C,0.325
CC1(CC#N)OC2CC12,0.2814
NC1=NOC(=N)N=C1N,0.1642
CC1CC=CC2CC12O,0.2432
CC1(O)C2CC2CC1=O,0.2113
[O-]C(=O)CCCNC=[NH2+],0.042
CN=C1OC(C#C)C1C,0.2626
COCC1OC1C1CN1,0.319
N=C1N=NOC(=N1)C#N,0.2041
CN1CC1C1=CN=NO1,0.1987
OC1CCN2CC12C#C,0.2717
OC1CCC2C3CC12O3,0.2978
[NH3+]CC1=NON=C1[O-],0.2245
COC1CC2(C)COC12,0.3039
CC1(CO)COC(N)=N1,0.2759
CC1C(O)CC1=O,0.2218
CCC1OCC2(CC2)O1,0.335
C(CO)C(=O)NC=O,0.2214
CC(C)C(=O)OC,0.2823
CC1(C)C2OC(=O)C12C,0.2722
CCCC1OCCC1O,0.3028
COc1c(oc(=O)o1)N,0.2525
COc1cccc(n1)O,0.2062
C1C2CC1C1=C2OC=N1,0.2148
c1c(c(c[nH]1)N)C(=O)N,0.1798
C1OC2C3COC12CO3,0.2868
CC12C3C4CC=C1C4N23,0.16
COC(C)C1OCC1O,0.3149
CC1C2C3C1=CCC23C,0.1772
CC(CCNC=O)C#N,0.2802
CCN1CC2(O)CC12,0.2814
OCC(=O)OC1CC1O,0.2542
CN=C1NC=COC1=N,0.1648
CCN1C(C)C1CCO,0.2875
OC1CC11CC2CC2O1,0.2946
CC1CC2OC2C(O)C1,0.3364
CC12C3OC3C1C2C#N,0.2712
CCCc1ccc([nH]1)N,0.2316
CNc1nc(no1)C#C,0.2075
CC12CC(O1)C(C2)=NO,0.2551
CC1(O)CC2CC(O)C12,0.3108
CC(=O)C12CCC1CO2,0.2115
NC12C(O)CC1NC2=O,0.2466
O=COCC(=O)C1CO1,0.2195
CC1=CC2C3C1C(=O)N23,0.2098
c1nc([nH]c(=O)n1)C=O,0.1547
CC12C3C1C1C3C3C2N13,0.2849
CC1COC(=O)N(C)C1,0.2937
COCCC#CCO,0.2804
CCC1(OC1C)C(C)C,0.3312
CCC1CC=C(CC)C1,0.2578
CC(C)C12CN(C1)C2,0.2933
CC1C2C3CN3C2C1=O,0.1972
CCC1C=C(C)C2OC12,0.2419
O=CC12CCC1OC2=O,0.2197
CC1C2C3C(C=O)C2N13,0.2077
CN=C1ON=C(N)C=N1,0.1443
CCn1c(cnn1)C#N,0.2238
O=C1NC2C1CCC2=O,0.2064
COCC1OCC11CO1,0.3163
CCCC(C)(C)CC,0.3692
CC1CC=CC11CCC1,0.2592
C1c2c(n[nH]n2)N=CO1,0.2094
O=C1CC2COCCC12,0.2207
CC(O)C12CCC1CC2,0.3162
CCOC1C2NC2C1=O,0.1977
CC1=CC2CC2CC1O,0.2465
Cc1ccc(cc1)N,0.2021
COC(C)C(C)(O)CO,0.3143
O=C1OCC2C3OC1C23,0.2484
C1NC1C12C3CN1CC23,0.2918
CC1CN(C)C1C=O,0.1961
O=CCC1CCOC1=O,0.2244
CC12CC1C(CO)C2O,0.2984
CN1CC(O)(C1)C1CO1,0.2983
COCc1cc[nH]c1O,0.2366
C1C2CC3=C(NN=N3)N12,0.2303
CC(C)(CCO)CC#N,0.3034
CC12C3C4OC1C4CN23,0.3
C1OC2=NC3CN(C3)C12,0.2186
CCC1(CC1)C(C)O,0.3325
CC12C3OC1CC=CC23,0.2374
CCOC1=NC2CC2N1,0.2706
Cn1nc(c(n1)O)O,0.2142
CCC1COC11CCC1,0.311
CCC1(O)CCC1C#N,0.3035
N=C(C=O)N1CC(=O)C1,0.178
CCOC(C=O)C#CC,0.2041
CC12C3CN1CC23O,0.2883
C1CC11C2NC2C11CO1,0.3
NC(=O)C1C2NC1C2O,0.2612
CN=C1OCC1(N)C#C,0.2531
OCC1C2OC1C2=NO,0.2557
NC1C(C#N)C1(O)CO,0.271
CC(C)C(C)C(=O)C#C,0.2028
C1OC2C3OC2C1C=C3,0.2374
CCC(CO)OC(N)=O,0.3114
C1COCC(=C1)C#N,0.2251
CCC1CC2(CN12)C=O,0.2133
OC1CC(=O)NCC1=O,0.2085
CC1NC(=O)C1C1CC1,0.2752
CCN1C2C3NC3(C)C12,0.2985
CC1CC(CC1=O)C#C,0.2212
CN(CCC(=O)N)C=O,0.2602
CC1C2CC(=O)NC12C,0.2643
C1CC23COCC2C1O3,0.3201
N=C1OC2OC1C=C2,0.2374
CC12CC1C(=O)C(=O)O2,0.1743
OC12C3CN(C13)C21CC1,0.2849
CCCC1(CO)CC1O,0.3128
COCC1=CC2NC2C1,0.2433
C1CC1(C#CCO)O,0.2674
O=C(C#C)C1CC(=O)N1,0.1836
CCC1CCOC1C#N,0.2946
O=CC1(CNC=N1)C#C,0.1992
CC(CC(C)C#N)C#C,0.2976
CCOC(C)C(C)C#N,0.3042
CC1C(C)C2N=COC12,0.2593
CC1OCC1CO,0.3107
CC1C2C3COC1OC23,0.3126
OCC12CC3CC1OC23,0.3065
C#CCn1c(=O)[nH]cn1,0.2362
CC12C3CC4C(C1O3)N24,0.2959
C1CCC(=CC1)C#N,0.225
CC(CO)C1=NC=CN1,0.2505
CCNC(=O)C1CCC1,0.2705
CCC1(C)N=CNC1=N,0.2299
CC1CC2(CN2C)C1=O,0.2011
N=COCCC1COC1,0.2699
CC12CN=CN1C2C#C,0.2293
C1OCC2=CC3NC3C12,0.2321
CCc1cncnc1C,0.2132
CC1CC2CC1C(=O)C2,0.2212
CCCC(=NO)CCO,0.2548
CCC12CC1C(=O)OC2,0.2713
CC1OC(=O)NC11CC1,0.2962
O=C1C2C3CC1(C#C)C23,0.2346
c1nnnn1C2CC2,0.2659
CC(=O)C1C2CCOC12,0.2189
C#CCC1(CO1)C#C,0.282
CC1CNC(=O)N1C=O,0.2368
CC12C3NC3C1C2C=O,0.2263
O=C1CC2CC1CCC2,0.2197
CC1CC2(C)COC1C2,0.3144
c1nc(c(o1)N)NC=N,0.1934
CC#CC(CCO)C#C,0.2874
CCC1NC1(C)C#C,0.2746
CCC1C(O)CC1C=O,0.2234
C1CC23CC4OC(C12)C34,0.3066
CC1C2CC1O2,0.3232
CC1C2OC(=N)C1C2=O,0.2106
C#CC1C2CC1(N2)C#N,0.2638
CC1C2C3CC1C1C3N21,0.307
OCC1CC(O)C2CN12,0.2811
COCC1NC1C#N,0.2785
OCC1=CC(O)C(=O)C1,0.2221
CC#CC(=O)CC(=O)C,0.1838
CNC1(CC1N)C#N,0.2566
CN1CCC1C(N)=O,0.2571
OCC(=O)C12CCC1O2,0.2238
OC1CC2(CC12O)C=O,0.2222
C1C2C1N1CC3(CN3)C21,0.2801
CCCC(CCC)C#C,0.3119
CC#CC(C#C)N1CC1,0.267
COC1CC(C=O)C=C1,0.2101
O=CC12CC3C(C13)C2=O,0.2114
N=C1OC2C(C3CC3)C12,0.2719
CCC1(CC)OC1C#N,0.2887
C1CC23CCC(CC12)C3,0.3408
OC1C2C3N4C=NC13C24,0.2085
OC12C3CCCC1OC23,0.2891
C#CC1C2CC1C=CC2,0.2447
COCC1(CN1C)C#N,0.2715
CC(OC=O)C(C)=NO,0.2528
CC#CC1=CCCC1C,0.2058
CC(COC=O)N1CC1,0.2665
N=C1NC(=O)NC11CC1,0.2419
CC(CO)N=C(N)C#N,0.2104
CN1CC1C1=CC=NN1,0.2452
CC1C(CC1=O)N1CC1,0.2208
CC1(OCCCO1)C#N,0.3061
O=CC1=CC2CC2C1,0.1901
CCC(=O)CC(=O)N,0.2125
CC1C2CC2C=C1C=O,0.19
CC12OC3C1CCC23,0.3031
C1CCC2(C1)C(=O)CO2,0.2238
OC12CC3C4NC4C1C23,0.3016
COC12CC3C1C(C)C23,0.3388
OCC1(CCCO1)C#N,0.2956
CC12CN1CCCC2=O,0.2127
OC1C2CN2C(=N)C1O,0.245
CN1Cc2cocc2C1,0.2303
CC(C)C12CC3C1N3C2,0.2998
CC1CC(O1)C1(C)CC1,0.3239
CNC(C#N)C1CN1C,0.2624
OCC1(O)C2CCOC12,0.2828
C1CC23CC(CO2)OC13,0.3153
Cn1cc(nc1)NC=O,0.216
c1c(nc[nH]1)C#CC=O,0.1742
CC1COC(C)(CO)O1,0.3242
CC1=NCC2(CC2)CO1,0.2721
C(CO)c1c(n[nH]n1)O,0.2339
CC12COC3=NCC1C23,0.2211
C1OC11C2CN3C2CC13,0.3096
CC1=CN(C(=O)C1)C=O,0.2
CC1(C)CC11CC(=O)O1,0.2774
C1C2C3OC4OCC13C24,0.3293
CC(C)C1CC(=O)N1C,0.2765
CCCc1cn[nH]c1N,0.2395
CC(=NO)C1CC1C=O,0.2313
CC#CC1(O)CCC=C1,0.253
OCCC1CC(O)C1=O,0.2207
CC1(CCCCC1)C#C,0.3173
C1OC11COC2CCC12,0.3122
CC(O)CC1=CCOC1,0.2424
CC1CC=C(C)C1C#C,0.2573
c1nc(n(n1)C=O)CN,0.2084
C1CC1(CO)C(=O)CO,0.2349
CC1CC(C)C1(O)C=O,0.2219
CC(O)C(=O)C(C)O,0.2344
CNC(=O)N,0.3034
OC1C2CC1C(=O)CO2,0.2252
C1OC1C1=CCOCC1,0.246
CN(C)C1(CNC1)C#N,0.2568
CC(=NO)C(=N)OC=O,0.2079
CCOCC(C)C(N)=O,0.2742
CC1NC1C1=CNC=N1,0.2457
CCC1CC1(CC)CO,0.3228
CCNC(=O)N1CC1,0.2821
CC1CCCN1C(N)=O,0.2893
OC1C2COC2C1=O,0.1912
CC1(C)COC2CC1C2,0.3121
COC1CN2CC(=O)C12,0.2047
CC(C)(C(=NO)C#C)O,0.2038
CC1(C2CC1O2)C(N)=O,0.2606
c1c(ncoc1=O)F,0.1984
CC12COC1C(=O)O2,0.2466
OC1CC2(COC12)C#N,0.2742
CC1(C=O)C2C3CC2N13,0.21
CCC12CC3C(C13)C2C,0.3208
C1CC2OC3C1C3C=C2,0.2303
CCC(CO)COC=O,0.2597
c1c(c(=O)[nH]cn1)F,0.1946
N#CC12C3C1N1C3CC21,0.2555
O=CN1CC1C(=O)C#C,0.1742
CCC(O)C(C)CC#N,0.3199
NC12CC1CCOC2=O,0.2343
CC(C)C#CC1CCO1,0.2708
O=C1CC2(CN2)C=CN1,0.2058
CC1OCC2CC2(C)O1,0.3283
C1CC2(C1=NO)COC2,0.2401
OCC1CN2CC12,0.3024
CC1C2CN3CC3C12O,0.2946
COC(C)COC=N,0.287
CC1(C)CC2CC12C#C,0.2695
CC1CC11COC(N)=N1,0.2623
CCC1CC(C)C1C#C,0.3023
CCOC(=N)C(O)CO,0.2841
CN1CC1(C=O)C#C,0.1964
O=C1NC2COC(=O)C12,0.2572
OCC1C=C2CC3C1C23,0.1789
OCCC1NC1CO,0.3175
CCC1CC=C(C1)C=O,0.194
OC1C2CC1(CC=O)C2,0.2224
CC#CC1OCC(=N)O1,0.2796
[O-]C(=O)C1C2CCC1[NH2+]2,0.1713
CC1NC(=O)C2NC12,0.2542
C1CC2(C1)CC1NC21,0.3102
CC(C#C)C1=CCOC1,0.2415
O=CC12OCC1NC2=O,0.1987
c1cocc1C2COC2,0.235
CC1(O)CC2(O)CC1C2,0.3196
CC1=C(C)C(=O)C2OC12,0.1792
COCC1=CCCOC1,0.2621
C1CN1C1CCC11CC1,0.3118
c1c(c2c(o1)CCO2)N,0.2145
CC12CN3CC(=CC1)C23,0.2037
O=CC1C2NCC12C#N,0.1997
C1CC1C1CC2(CC2)O1,0.3059
CCC1CC2C(C#C)C12,0.2904
OCC12CN3CC3C1N2,0.2795
C1C2N1C1CC22COC12,0.2909
c1cncc(c1F)O,0.2193
CC1CC2(O)C3OC3C12,0.3101
CC1CN=COC2CC12,0.2575
C#CC1CC(O1)C1CN1,0.259
CN1CC1CC1(C)CO1,0.3032
CN1CCC2C(C#N)C12,0.2456
CC(CC([O-])=O)C(N)=[NH2+],0.2424
CC1NC1C(O)C1CO1,0.3225
N#CCC1C2OCOC12,0.3043
C1CN1C12CC1CC=C2,0.2408
N=C1C2C3OC(=N)N1C23,0.2496
CC(C)C1=CCC(O)C1,0.2618
CCN1CC1C=O,0.2103
C1CNCC(=NO)C1=O,0.1848
CC1NC1C1(C)OC1C,0.3129
OCC(O)C1(O)CC1O,0.3026
CC1CC(OC=O)C=C1,0.259
C1C2OC3C2OC=NC13,0.2571
CCC(CO)NC(C)=O,0.2776
C1OC2CCOCOC12,0.3157
C1CC23OCC12C1OC31,0.2894
C1C2OC3CC2N1C3,0.3054
Cc1cnc(cn1)C#C,0.1882
OCC12CC1OCC2,0.3069
CN1CC(=O)C(C)(O)C1,0.1923
COC1(COC1)C2CC2,0.3235
C(#N)c1c(n[nH]n1)O,0.2169
C#CC1C2CC3OC3C12,0.2807
CNc1nc(c(o1)O)N,0.215
C1CC2OC1CCO2,0.3268
OC1(CNC(=O)C1)C=O,0.2027
C1C2OC34CN(C3)C1C24,0.2552
CCN1C(=N)OCC1=O,0.25
CCOC1=NCC2CC12,0.2721
c1nn(c(=O)o1)C(=O)N,0.2403
OC1CC(=N)OC1C#C,0.2797
C1CC(=NO)C=C1CO,0.1914
CC(O)(CO)C#CC=O,0.2015
NC(=[NH2+])C1=CC(=O)O[CH-]1,0.149
CNC1=CC(=O)OCC1,0.206
CC#CC1CCC2OC12,0.2981
NC1(CCOC1)C#N,0.2859
CCC1(C)CC1(C)C=O,0.2232
CN1CC1(CO)CCO,0.2798
CNc1cc(c[nH]1)C#C,0.2101
C1C2OC3COC1OC23,0.3329
CCC(=O)NCCO,0.278
NC(=O)C(O)C1CC1O,0.2757
c1c(c(=O)nc(o1)F)F,0.2157
OCC1C2CC1(O2)C#C,0.2534
FC(F)(F)C1CCOC1,0.3341
O=CNC1COC=NC1,0.2633
C#CC12NC1CC21CN1,0.2485
CC(C)CCOCCO,0.3378
C1COC2C3NC2C3O1,0.323
CC1(CC1)n2cnnc2,0.2641
COCC1CN1C=O,0.2541
C1CC2=CCCOCC12,0.2548
C1CC1c2nc([nH]n2)N,0.2428
C1OC2CC=CCC2O1,0.265
C1NC2C3CC12N=CO3,0.2264
CC1(CC2COC12)C#N,0.2875
COCC(O)C(C)C,0.325
C(COC=NCC=O)O,0.2215
CCOCC1OCCO1,0.3296
CC1OCC(N)C1C#N,0.277
O=C1CC2(CN2)CN1,0.2757
COc1c(nco1)N,0.2055
CC1CCOC(C)C1O,0.3224
OC1CC2C1=CNC2=O,0.1996
C1C2C3C4COC2C1N34,0.3155
OC1C2CCC1OCC2,0.3078
CC1COC2CCC12,0.3167
COCC1=CCC2OC12,0.2449
OC(CC#C)C#CC=O,0.2005
CC(O)CC(=O)CC#C,0.2282
CC1=CC(=O)C(C1)(C)C,0.1917
CC1(C#N)C2OCC12N,0.2663
N=C(C=O)N1CCC1=O,0.1917
CC1=COC(=N)C(F)=N1,0.1664
CC12OC3C(C13)C21CO1,0.3071
c1c(c(nc(n1)O)N)O,0.1947
CCCc1ccccc1,0.2405
CC1(CCC=C1C=O)C,0.193
CN=C(C=O)N1CC1C,0.1625
COC1(C)CC2CC12,0.3288
OCC12CC3C(C1)OC23,0.3067
COC1C2CC(=O)NC12,0.2623
OC1CC2C(NC=O)C12,0.2735
CC1(C)OC1C=O,0.2157
CC1CCC2CC1(C)C2,0.3481
CN1C(CO)CNC1=O,0.2871
OCCC1COCCO1,0.3139
CC12CC3=CC(O)C1C23,0.1779
CC12CC1(O)C(CO)O2,0.2957
CC(O)CC1(CN1)C#C,0.2854
C#CCC1CC(N1)C#N,0.2642
CCCc1cc[nH]c1,0.2502
CC1C2C3C(C)C1C23O,0.3022
CC1=CN=CC(=N)O1,0.1589
CCC1(CO)CC2CC12,0.322
CC12NC1CCOC2=O,0.2527
CNc1c([nH]c(=O)[nH]1)O,0.2224
CC1C=CC(=O)C1C,0.1919
O=CC(=O)C#CC1CO1,0.1536
CC12CC3(COC13)CC2,0.2982
CC1CC2(O)CC1(O)C2,0.3203
C1C=CC2C3C=CC2C13,0.2214
Cc1cc2n(c1)CCC2,0.2429
CCCc1nccnn1,0.1634
O=C1OCC23CCC12O3,0.2516
c1c(c(no1)O)CC#N,0.2537
CC(=O)CC1CC1(C)C,0.2275
N#CC1NC1CC1CC1,0.2857
CC(=N)N(C=N)C(=N)C,0.2187
C1NC11CC2COC12,0.2969
CCC12CC(C#N)C1O2,0.2941
CCC(N)=[NH+]CC([O-])=O,0.252
OC(C#C)C(O)C#N,0.292
CCC(CC(C)O)=NO,0.2499
CCCN1C2CC2C1=O,0.2481
COC1C2OCC12OC,0.2907
OCC1CNC(=O)N1,0.3014
CC1C2C=CC1C2C,0.2389
CN1C2C1C1CC2C1,0.3104
CC(N1CC1)C(N)=O,0.2425
CCC1(COC1=O)NC,0.2391
NC1=C(F)C(=N)NC=N1,0.1714
CCC1OCOC1C#C,0.2871
CCc1cc([nH]c1)N,0.2374
CC(C)C1(COC1)O,0.3076
CC(O)C12COC1C2C,0.292
CC#CC(O)C1OC1C,0.28
CN1CC1C12CN(C1)C2,0.2959
CC(C)C1C2CC1(C)C2,0.3678
CC1(C)C2C3CC2C13O,0.3195
CCC#CC(=O)C(=O)N,0.1632
OCC1(OC1C#N)C=O,0.2042
OC1C2OC2CC11CN1,0.3083
c1c(=O)nn[nH]c(=O)n1,0.1565
N=CN1C2CC2CC1=O,0.2238
OC1=CNC(=O)OC1=N,0.1806
O=C1C(NC1C#C)C#C,0.2032
O=C1CC(CN1)C#N,0.2717
OC12CCC(C1)CC=C2,0.2613
OC1=CC=CC(=N)O1,0.1675
CC1(O)C(C#C)C1C#C,0.2621
c1cc2cncnn2c1,0.165
C1OC(=O)C(=O)O1,0.2104
CC12CC(C1)N=CO2,0.2662
CN=CNc1ccco1,0.2343
CC(C)C1(CC1)C#N,0.3196
C(=N)Nc1c(n[nH]n1)O,0.2057
NC1(CCC11CN1)C#N,0.2713
CC12CC1(O)CC=CC2,0.2655
CC1(CN1)C(O)C1CO1,0.3184
OC1CC2OCOCC12,0.32
CCC1CC2OC1C2=O,0.2339
OC12C3CC1NC(=O)C23,0.2566
CCc1cn(c(=O)o1)C,0.2322
OCCC12CCC1C2O,0.306
CN1C(C)=CC(O)C1=O,0.204
CCNc1nc(no1)C,0.2441
O=CC12CC1OCO2,0.2217
CC(C)Cc1cc[nH]n1,0.2621
OC(C#N)C1C2CCC12,0.2842
CC1CCC(=O)C(=N)O1,0.1903
C#CC1CCN=COC1,0.257
C1NC1C1=CON=N1,0.2207
CC1C2C(C)NC12C#N,0.2441
CC1(CC#C)COC1=O,0.2713
COC1(C)CC1C(C)C,0.3304
CC12COC(C1)C=CC2,0.2481
CC1CC(=O)OC=N1,0.2503
C1CC2OC(CC=C2)O1,0.2576
NC12C(OC1=N)C2C#N,0.2548
OC(CC1CO1)C#N,0.2879
CC1(C)CC(=N)OCO1,0.2767
N#CC1COCOC=N1,0.2619
N=C1OCC2NC1C=C2,0.2237
Cc1c(nc[nH]1)CC#N,0.2448
Cn1c(c(cn1)C#N)O,0.2404
CCOCC(C#C)C#C,0.2936
CN1CC2OCC12CO,0.2595
CCC1(CC(=O)C1)CO,0.2224
C1C2CC3CC1C2C3,0.3551
OCC12CC(C1)C21CC1,0.3345
CC(=N)OC(C)(C)C#C,0.2849
COC(C#N)C1CN1,0.2639
CC12CC(CC11CO1)O2,0.3251
OC1CC2OCC1C=C2,0.2462
C1CC2OCOCC2O1,0.3337
C#CCCCC#CCO,0.2771
CC1CC2C1CC2(C)O,0.3216
CN(CC(O)C=O)C=O,0.1905
CC1C2CC1C(=O)NC2,0.2723
COCCC1OC1C,0.3465
O=CC12CC1NC(=O)O2,0.2169
O=CCC12CC1OC2,0.2087
CC1(N)CC(=O)NC1=O,0.2289
N=C1NN=NC=CC1=N,0.1606
CCC#CC(=O)C#C,0.1882
CCOC(=O)C(C)C#N,0.2791
CNC(=O)CCC1CC1,0.2794
Cc1ncc(o1)N2CC2,0.229
COC12CC(C1)CC2,0.3281
CC(O)(CC#C)C1CN1,0.2753
CC1OC2CC12C1CO1,0.3037
CC1C2C3C(=O)N1C23C,0.2441
c1c(cc(cc1O)F)N,0.2232
CC1CC2(C)OCC2=C1,0.2402
CC12CCC1=CC(=O)O2,0.2188
CC1(CC1CCO)C#C,0.2936
CC1=CC(=O)CC2CN12,0.1871
CC(O)C1CC(CO)C1,0.3287
NC(=[NH2+])N1N=NC=C1[O-],0.1518
CC1CN1C(=O)C1CN1,0.2505
OC1CC23CN4C2C1C34,0.2905
CC1(CN1)C(O)C1CC1,0.3185
CC12C3CC(OC13)C2O,0.325
CC12OCC(CC=C1)O2,0.2505
CC12CC1C1=CC=CN21,0.2204
CCC1CC2=CC=CN12,0.2484
O=CC12CC(O1)C=C2,0.2148
COCC(=O)C(=O)CO,0.1573
CC1(CN(C1)C(=O)N)C,0.2879
CC1OC2C3CC1(O)C23,0.292
C1C=CCC2NC2C=C1,0.2428
c1c[nH]c(c1O)O,0.232
CC1OC=NCC(C)=C1,0.2545
CC(C)C1(C)OC1CO,0.3339
c1cncc2c1n[nH]c2,0.1766
CC#CC1C(O)C1O,0.2676
CNc1ccn(c1)C=O,0.1628
N=C1COC(O1)C=O,0.209
CCCC(C)(CO)C=O,0.2237
CC12OC1CC2NC=O,0.2743
C1C2CC1C1CC(C1)C2,0.3513
C1C(CO1)(C#CCO)N,0.2646
CC12OCC3OC1CC23,0.3173
CC1C2CC(O2)C1=O,0.2113
N=C1NCCC(=O)N1,0.2304
CCCNCC(=O)C#N,0.1536
OCC1CCC2(O)CC12,0.326
CC1NC1(CN)C#N,0.2691
CC1C=CCC=CC1O,0.2408
N#CCCN1CC1C#N,0.2739
CCOc1ccoc1N,0.2155
CC12N3C4C3C1(O)C24O,0.2362
C1CC2CCCOC2=N1,0.2685
OC1C=CC2NC2C1O,0.2324
C1C2N1CC1C3CC21O3,0.3076
c1conc1CO,0.2526
CC1(C(=O)C(=O)CN1)C,0.142
OC1C2CC11CCCC21,0.3206
CC12OC1C1(C)CC2C1,0.3338
COC(CC=O)C=O,0.2027
OC1CC2(O)CC1C2=O,0.2274
COC1(C)C(C)OC1=N,0.2723
CC1C(O)CC1OC=N,0.269
CC1CC(C)CC(=O)C1,0.2248
CCC(O)C1=NON=N1,0.2183
CC1=COC=NC1=N,0.2072
N=C1C=NC(=O)NC=N1,0.1913
NC1C(O)CC1(N)C#N,0.2718
CC#Cc1ccn[nH]1,0.2102
CC1CC1(C#N)C1CN1,0.2721
OC1CC1(O)C1COC1,0.2993
CC1C(O)C2COCC12,0.3114
CC12CC3C1N3C2CO,0.3132
CC12OC3C(NC1=O)C23,0.2371
CCCOCCC(C)C,0.3312
CC1COCC2(CC2)C1,0.3243
N#CC1(OC2CC12)C#N,0.2446
CC1(CC1)C#CCC#C,0.2714
CCC(=O)C1(CO)CO1,0.2156
CC12CC1(C)C(C)(C)O2,0.3001
OC1C=CC(=O)N2CC12,0.1966
CCCOCC,0.3409
C#CC12COCCC1N2,0.2778
NC(CC#N)C(O)CO,0.2914
C(CO)C(=O)OCC=O,0.2288
CC(=O)C12CC3CC1C23,0.2265
CCC(CO)OC(C)C,0.3152
CC1C2CC3(CC3)C1O2,0.3273
CC#CC1NC1(C)C#C,0.2519
C(C#N)C(CC#N)C#N,0.3248
CC1C2CC1C(=O)CC2,0.2278
C1CC2(C1=O)CC2,0.2191
CCOc1cc(n[nH]1)O,0.2553
OC1C(OC=N)C1C#C,0.269
CC12CC3C4C(C1)N4C23,0.3036
CC1CC=C(C)C2NC12,0.2428
OC1C2CCCCC12O,0.306
C[NH2+]CCC(=N[O-])C#N,0.079
CC1OC1C1NC1C#C,0.2825
CN1C2C3CC1CC2O3,0.2988
O=C1NC2C=CC3C2N13,0.2242
CC1C2OC1(C=O)C2O,0.2137
CCC(=N)OC(=O)NC,0.2682
CC1CN2C=CC=C12,0.2493
OCC12OC3C1C(O)C23,0.2732
CC1(CO)C2OC2C1O,0.313
COC(C)(C)C(C)CO,0.3228
C(C#CCO)NCC#N,0.2679
c1c2n(cn1)CC(=O)C2,0.1839
CC(O)(CC1CC1)C=O,0.2238
C1C(=C(C(=O)O1)C=O)N,0.1898
O=CN1CC1C1COC1,0.2576
CC1(CC1(O)C#N)C#N,0.2927
O=CC1CC2OC12C#C,0.2114
O=C(C#C)C1OC2CC12,0.1859
CCCNC1(CC1)C#N,0.2669
CC1(CN1)C(C=O)C=O,0.2096
CN1C2CNC2C1C#N,0.2488
CC#CCC(=O)CC#C,0.2255
NC(=O)OC1CC=CC1,0.2685
CNc1nc(nn1C)O,0.2389
Cc1cnccn1,0.1969
CC1=CC2(CO)CC1C2,0.2378
CN1N=NC(F)=CC1=O,0.1832
CCC1(CCC1O)OC,0.3112
O=C1CC23OC4C2OC134,0.1774
OC1CC23CCC2OC13,0.2875
CC1CC2=NC(O)=NN12,0.2414
Cc1cc(c(o1)NC)N,0.2123
CC#CC(C)(O)C=O,0.213
OC1CN2CC(O)C12,0.2595
CC1OCC(O)C1C=O,0.2224
CC(=O)C[NH2+]CC([O-])=O,0.2144
C1OC23CCCC2CC13,0.2973
c1nc(no1)OC(=O)N,0.2556
CC(=O)Nc1ccon1,0.2311
OC1COCC2CN2C1,0.2944
CC(NC(=N)C=O)C=O,0.1612
CN1CC2(CC2)CC1=O,0.272
CC(=O)Nc1c[nH]nc1,0.225
NC1=NCC2=C1N=NO2,0.1545
CC12COCCC1CO2,0.3127
OC1CC2(C1)CC=CC2,0.2641
CCC1C2CC2(C)C1O,0.3139
CC1CC(=O)C1(O)C#C,0.2023
CC1(CC1)CCC=O,0.2286
CC12NC(=O)N3CC1C23,0.2534
CC1CC1C1C(C)N1C,0.2861
CN(CC(=O)CO)C=O,0.2084
C1OC11C2C=CC1C=C2,0.224
OCC1C2OCC12C#C,0.2619
CCC1NC(=O)C(C)=C1,0.2217
NC1=CN(C=O)C(=N)O1,0.1862
C1CC2=CCCC3C1C23,0.242
CCC12CCC1(N2)C#C,0.2702
CC(=O)c1cnco1,0.1978
C1C(=O)OC(=N1)C(=O)N,0.207
COC1CCC1C(C)=O,0.2319
C#CCN(CC#C)C=O,0.2718
CCCC1CC1C(C)O,0.3332
CCn1c(ncn1)O,0.2652
OC1COC(=N)C11CO1,0.2617
C[NH+](CC([O-])=O)C1CC1,0.2667
CC1(C)OCC(O)C1O,0.2946
CC1=CCCC=CC1,0.2514
OCC1NC=CC1=NO,0.1745
CC12CC(=O)N3CC1C23,0.2308
CC(C)C1C2OC1C2=O,0.2458
OC1CCC11C2COC12,0.2961
CC1NC2(C)C1OC2=O,0.2461
CC1CC2OCC1C=C2,0.2477
C1CC23C4CC2OC13C4,0.2904
C1OC11C2C3C1CCN23,0.3238
COC1C2C3C1C(C)N23,0.3156
CC(CO)COC=O,0.2866
CC(C)C1=CCCCC1,0.26
CC1=CCCC1(O)CO,0.2619
O=C(C#C)C12CC1OC2,0.1895
CC#CC(C)CC1CO1,0.3024
OCC12CC1CC1OC21,0.3332
O=C1OC=NCC2CN12,0.2566
CC(C)C1(O)CCC1C,0.3176
COC12CCC1(O)C2O,0.2851
COC(CO)(CO)CO,0.2941
CC1CC11OC(=N)C1O,0.2684
O=C1CCC2(CCO2)C1,0.2204
CN1CC1C(O)C#C,0.2562
CC1C2C3C1OC23C=O,0.2176
C1C2C1C1CCC2O1,0.3277
CC1(CCC1O)C#N,0.3062
CC(C)(C=O)OC=NC,0.2175
CCC1COCC1(C)O,0.3076
CCC(O)C(CC)CC,0.3301
CC1COC(C)C(=N)O1,0.2716
O=CC1C2CC=CC12,0.2114
CC12CC3C(CC3O1)O2,0.3338
CC(=O)NCC1CN1,0.2752
CC1=NCC2CC2(C)O1,0.2714
C1C2OC1C21C2CC1O2,0.312
CC(NCC#N)C(C)=O,0.2147
CCC(C)(CC)C#C,0.3174
OCC1C2C3COC2C13,0.3084
CC12CC3C4C3C1(C)N24,0.2979
O=C(C#C)C1C2CC1O2,0.1762
NCC(OCCO)C#N,0.2681
CCC12CC1C(C)C2O,0.313
CN1C2C1C(C#N)C2N,0.2641
CC(C)OC1C(C)C1C,0.3056
C(CCOC=O)CC=O,0.2286
N#CC#CC1C2CC1O2,0.2139
COC1C2C3NC3C12O,0.2685
OC12C3C1C1C=C2CC31,0.1215
COCC1=CCCC1C,0.2595
COC1C(C)CC=C1C,0.2601
CC(C)c1ccccn1,0.2288
CC(=NO)C1CC1O,0.2292
O=C1NC(=NO1)C1CN1,0.2384
CCC1(O)COC(=O)C1,0.2718
CN=C(NC=O)C1CN1,0.2146
N#CC1=NC2CC2N1,0.1978
c1c2c(no1)CC=CC2,0.2384
c1c2c(ncn1)nco2,0.1988
CC(C)(C)C1CN1C=O,0.2553
CCOCC#CC(=O)N,0.2365
OC1CC=CC1OC=O,0.2569
CC1OC2(C)C3CC1C23,0.3123
CC1C=CC2(CO)CN12,0.2325
COC1C(=O)CC11CC1,0.1993
CCCCC1(C)CC1C,0.3399
N=C1ON=C(O1)C=O,0.1659
CCC1CC1(C)CO,0.3345
Cc1c(nccn1)C#N,0.1892
CC1(CC1)CC#CC=O,0.2054
CC1(O)C2C(O)C2C1=O,0.2169
O=C1NCC11CCOC1,0.2788
C#CCC12NC1C1NC21,0.2454
OC1C2COC(=N)CC12,0.262
CCC12NC1CCC=C2,0.25
OC12CC(C1)CCCC2,0.3289
CC12CC1C(O)CCC2,0.3211
CC(=O)C1(O)COC1=O,0.2152
C(c1c([nH]nc1N)N)O,0.2334
CNc1cn[nH]c1O,0.2507
CC1(C)OC2CCC12O,0.299
CCc1cocc1C,0.2414
c1coc2c1CCN2,0.2126
C1OCC2C=CC3C1C23,0.2432
O=C1CCC2N3CC12C3,0.1884
C1CC23CC=CC2(C1)O3,0.2431
c1nc(no1)C(=O)N,0.2109
COC1CNC1C#N,0.261
C(C=O)OC(=O)C(=O)N,0.2039
CN1CC23CCN2CC13,0.2843
CC1CN2N=NC(N)=C12,0.2194
CC1OCCC2OCC12,0.313
CC#CC(=NO)C(C)C,0.2058
O=C1NC2CC3CCC123,0.2625
CC12C=CC3CC1OC23,0.2407
CC12CC3(CN1C23)C=O,0.2029
CC(O)(CCCO)C=O,0.2256
COc1ccc(=O)oc1,0.1633
O=CC12CN3C(CC13)C2,0.2041
C1CNC(=O)NC=C1,0.229
c1coc(=O)nc1F,0.1986
O=C(C#N)C1COC=N1,0.1796
c1noc(=O)n1C(=O)N,0.236
CC1C=C(CC1O)C=O,0.1923
CCC1NC11CN2CC12,0.2941
CC(=O)C1=CC(=N)OC1,0.1737
O=C1CC2CC1C21CO1,0.2268
OCC1(CCC=O)CN1,0.2303
Cc1c([nH]c(=O)o1)NC,0.2316
O=CC12CC1C(=O)O2,0.2207
CC1(O)CC=CC2CC12,0.2435
CNC(=NC)C#N,0.2037
c1cc2c(nc1)NCC2,0.1887
[NH3+]C1=CC(=O)O[C-]1C=O,0.1384
CC(NC(C)=O)C#N,0.2724
O=CC12CC3=CCN1C23,0.1654
CC1CC1COCC=O,0.2289
CC#CC12CC3CN1C23,0.2656
CC#CCOCC1CO1,0.2826
CC1(C#C)C2CN2C1=O,0.222
CC(O)CC1CCC=C1,0.262
OC1C2NC(=N)C12O,0.2495
CCC1(C)CC=CC1,0.2656
CN1CC2(OCC12)C=O,0.1806
CC1COCC=C1C#C,0.2108
CCCC1CC(CC)C1,0.364
OC1C2C3C2N2C3C12,0.2979
C1C(=NO)C(=CN1)C=O,0.1596
CC1OC1C(C=O)C#N,0.2246
CCC1CNC(=O)C=C1,0.2067
CCCC(C)(C)C(=O)C,0.2284
CC1CN1C(CN)C#N,0.2747
CC(C)C1(CN1C)C#C,0.2726
COCC(COC)C#N,0.306
CC1CCC(C1)NC=O,0.2818
CNC(C#C)(C#C)C#C,0.2469
CC(=N)OC1=CC=NN1,0.2466
CC1(O)CCOC1=O,0.2721
C1C2CC3OC3C1C=C2,0.2517
C1CC(C1)C(=O)CC=O,0.209
c1c(c(c(o1)O)N)C=O,0.1587
CCC(C)C(CC)CO,0.3401
CC1NC1C1=CC=NN1,0.2497
C1CC2(C1)C1C3CC1N23,0.3153
CC1=COC(=N1)C1CO1,0.2259
OC12COC3C1CC23,0.3019
CC1(C)COC2CC12,0.3105
C1C2OC11C=CCC21,0.2292
OCC(O)C(=O)CO,0.233
C1C2CC3=C(ON=N3)N12,0.1689
NC1C2NC(=NC12)C#N,0.1841
CCCCOCCC=O,0.2283
N=C1OCC2C3OC3C12,0.2744
CC1CC(O)(C#N)C1=O,0.2011
N=C1OC(=NC=C1)C#C,0.1595
c1c2c(on1)C=CCC2,0.179
CC1(OCCO1)C,0.3329
N#CCC12CCC1O2,0.2941
CC1COC(=N)C(=O)C1,0.1905
OC1C=CC=CC2CC12,0.1859
NC1COC1C#N,0.258
CCNc1c(con1)N,0.2249
OC1C2C3NC3C12,0.2792
O=CC1NC1(C=O)C=O,0.1897
O=C1NCC1OCC#N,0.2506
COC1COCC1CO,0.3171
N=C1OC2C3N4CC13C24,0.253
OCC#CC1(CN1)C#N,0.2513
CC12CCC1(O)C1NC21,0.3131
CCC(=O)C(C)(C)CO,0.2297
C(C=O)NC(=N)C#N,0.199
N=C1COC(=N)C(=N)N1,0.1973
CC(=NO)C(C=O)C#C,0.2229
N#CC12CC(O1)C21CN1,0.2524
N=C1ON=CC=C1C=O,0.1419
CCCOC=NCC#N,0.2711
C1CC11C2CC1C2,0.3706
CC12CN3C4C3C1CC24,0.3233
COC1C(OC)C1C#C,0.2692
CN1C=CC(=N)C(O)=N1,0.1725
CCC1C2N(C)CC12O,0.2685
c1nc2c(o1)NCCN2,0.2041
c1cnnnc1,0.186
C#CC12CC3CC1C2O3,0.2756
CC1CC2(COC2)CO1,0.3067
CCC1CCC1CC#C,0.3141
CC12C3C=CC(C13)C2O,0.2303
O=C1NCC1C1COC1,0.2744
ON=C1C2NC2C1C#C,0.2361
C(=O)C(=N)N(C=O)C=O,0.1635
CC(=O)c1cc[nH]c1,0.2037
C1CNc2c1[nH]nc2O,0.2134
CC1C2CC1CC2,0.3723
CC12CC(O)C(C1)C=C2,0.2529
CC(O)(CC=O)CC#N,0.2217
C1CCC(C1)C#N,0.3479
CCc1c(c[nH]c1C)C,0.2391
CC1=CCC(=O)C2CC12,0.2134
CC12NC1CC(O)C=C2,0.2454
OC1C2CC2C=C1C#C,0.1974
OC12C=CC3C4C(C14)C23,0.2389
CC1OCC=CC1O,0.2519
OC1(CC2OC2C1)C#N,0.2902
Cc1c(c([nH]n1)O)C#C,0.2298
O=C1N2C3CC1(C#N)C23,0.2451
CC1(N)C(CO)OC1=N,0.2685
O=C1C2C3C4OC2C1C34,0.2316
OC12CC3C(CC13)CC2,0.3262
CC1(O)C2OC2CC1O,0.3235
CC(=O)CC(C)(O)CO,0.217
C1C=CC=CC=C1,0.185
CC(O)C1OC(=O)C1C,0.2812
CC(C)C1C2OCC12C,0.3045
CC(O)C(C)C1CN1C,0.2919
C#CC1=CC2C3CN2C13,0.1772
CN1CC(=N)OC1=O,0.2588
COC1CC2(CN2)C1=O,0.1874
Cn1cc(oc1=O)C=O,0.1739
C1CC11CC2C3CC2C13,0.3585
CCOC(=O)CCCO,0.2855
CC12CC3C1C2C3(C)O,0.315
CCOC1C2OC1C2=O,0.2372
C1C2C1C1C2CC11CC1,0.3134
O=CC12CCC(CC1)O2,0.2255
N=C1NC(=O)NC=C1,0.2022
CC12CCC1(O)C2C#N,0.29
CC1(C)C2C3N1CC23O,0.2878
OCC12CN1C(=N)C2O,0.2479
CC1=C2CN3C2C3(C)C1,0.1672
COC12CN(C1)C2C#N,0.2716
CCC(O)C12CC1CO2,0.3038
ON=C1C2COC1C=C2,0.2334
Cn1cc(cc1O)O,0.2333
CN1CCOCC(=O)C1,0.2016
OC1(C#C)C2NC=NC12,0.2227
CCNc1c[nH]cc1N,0.2311
CC1(C)C=CC2CC12,0.249
OC1COC1CC#C,0.2966
CC1C2CC1(C)C2(C)O,0.3247
CC1C(C)(N)C1(N)C#N,0.2573
CC(COC)(C#N)C#N,0.273
CC1OCC11CCC=C1,0.2564
CC(=O)c1cc(oc1)N,0.1679
OCCC1OCC11CO1,0.3248
OCC1=CC=CC(=N)O1,0.1663
CC#CC1COC(=N)O1,0.2697
c1c(cnc(n1)C#N)F,0.2077
CC1CC(=O)C1(C)CO,0.2167
O=CC1=NC2(CC2)CN1,0.1523
C1C2NC1C1=NNC=C21,0.2374
CC1(CCC11CC1)C=O,0.2249
CC1(O)CC(C1)C1CO1,0.3245
CN(C)C1(CC1N)C#N,0.2608
CC12OC1CC(=O)C2=O,0.1482
CC(C)C1CC=CC1O,0.255
CC(C)CC#CC(=O)C,0.2084
CC1CC=CC1(O)CO,0.2644
O=CC1(CC1)C1NC1,0.2221
C1C2CC11OC1CCC2,0.3266
CC12CNC(=O)C1C2O,0.256
CN=C1CC(O1)C(N)=O,0.2646
CCC1C2C3CC1C23O,0.3046
O=C1CC23CC12N=CO3,0.2171
CC12COC3C(O1)C23,0.2931
c1cn2c(n1)COC2=O,0.2202
N=C1OC(=NC=N1)C#N,0.1618
CC12CC1C=CC2C#N,0.2455
CC12NC1C1(CC21)C=O,0.2015
CC(=O)COCC(=O)N,0.2201
CCOC1COC(C)C1,0.3194
CC1(CO1)C1CCC=C1,0.2597
N=C1ON=CC(=N)N=C1,0.1751
CC1OC(=N)C2CC1C2,0.2855
CN1C2C(=O)CCC12C,0.2066
O=C1C2CCCC1N2,0.2283
c1nc(c(o1)CC#N)N,0.2069
CC12C(O)C1C1CC2O1,0.3082
CCC1C(OC)C1(C)O,0.2951
OC1CC11C2OC1C=C2,0.2274
CC(C=O)C1=CN=CO1,0.2038
NC(=O)OC1COC1=N,0.2818
CC1=CC2C3NC1C23O,0.2287
OCCC(=O)C(O)C=O,0.2038
OC1CC(=O)C2NC12,0.2184
C1C2CC3(CN4CC34)C12,0.3075
CN1CC1C1(CO)CO1,0.3043
OC1CC(CC#C)C=C1,0.2573
COCc1nc(co1)N,0.2062
CC1=NC(=N)N=C(F)N1,0.2067
OCC1C2CC3(CN3)C12,0.3082
C1CNc2c1oc(=O)o2,0.2313
c1cnn2c1C3(C2)CC3,0.2587
[NH3+]CC(O)(C#C)C([O-])=O,0.2542
CC1C2OC1C2(O)C#N,0.2769
N=C1OC=NC(C=O)=N1,0.1579
CC1CN1C(=O)C=O,0.17
CC1=CC2(CCO2)CC1,0.2498
CC1CCC2(CO2)C1O,0.3122
CC1OC2CC1C(=O)O2,0.2737
CC1=COC(=N)C(N)=C1,0.1606
O=C1C2COC1OCC2,0.2071
NC1=NC(=N)N=C(O)O1,0.2296
Cc1c(nc(o1)N)OC,0.216
c1c[nH]c(c1CC=O)N,0.1684
CN1C2C3C1COC23C,0.2901
CCOC(CC)C(C)C,0.3243
OC12C(NC1=[NH2+])[C-]2C=O,0.1589
CC1CCC2=C1N=CO2,0.2309
CCc1cccnc1F,0.224
CCOC(=O)C1(CC1)N,0.2432
CC1(C)C2CC2C2OC12,0.3353
Cc1cn(ncc1=O)C,0.1859
CNC1C(C)OC1=O,0.245
CC1COC(=N1)C(N)=O,0.2206
O=C1OC23CCC2OC13,0.2407
CC(C)C1(CO1)C(N)=O,0.2639
c1c(=O)c(con1)CO,0.1853
CCNC1=NOC(=N)O1,0.2587
CC12CC1CC2=O,0.2322
OC12CNC1CC2=O,0.1988
CCC1(CO)C2CC1C2,0.3341
CC1OCC11NCC1O,0.291
[NH3+]C1(CN2CC12)C([O-])=O,0.255
CC1CC2(CC2)C=C1C,0.243
c1cc(c(cc1O)F)F,0.2108
CCC#CC(=O)CC#N,0.2112
COCC12CN1C(C)C2,0.3045
OC12CC(C1)C2CC=O,0.2267
CCC1CC2(C)COC12,0.3104
CC1C2C3C(O)C2C13,0.3237
O=C1[CH-]NC2=C1C[NH2+]C2,0.096
CC(=O)NCC1CO1,0.278
C1C(=NO)CN1CCO,0.2271
CC1C2OC(C)(C)C12,0.3173
CC(=NO)C1C2CCC12,0.2492
CCC12CC1CC2C=O,0.2135
CC(CC#CCO)C#N,0.2831
O=C1OC2CCCC12,0.2798
C1COC1(C#N)C#N,0.2618
C1C2OCC3COCC123,0.3165
CN1C(C=O)C1C1CC1,0.1936
OC1C2CC1(O2)C=O,0.2076
CC1(C#C)C2NC1C2=O,0.2482
CC1=CC2C(C1)C2C#C,0.2375
C1CC11CC2CC2O1,0.3078
CN=C(C=O)NCC#N,0.166
CC1(C=O)C2CC1C2=O,0.2181
C1C2OC1C1=C2NN=N1,0.2286
CC1(C(=O)C=CCN1)C,0.1626
CC12OC(C1O)C2C#C,0.2847
C#CC12CCCC1N2,0.2838
OC1C2OC(=N)C(=O)C12,0.189
OCC1N2CC3C2C13O,0.2687
OC1C2C(=N)OC12C=O,0.2097
CN1CC(C1)(C#C)O,0.2459
CN(C)c1coc(n1)N,0.218
CC1OC1C1(CO1)C#C,0.2823
CC(C)C1CC=CC1=O,0.1895
COc1coc(n1)OC,0.2285
CC#CC(C=O)C1CO1,0.2157
C#Cc1c(onc1O)N,0.217
C1CC12CC(C2)(C=O)O,0.2287
CC1(COC1)C1CC1O,0.3055
CC(=O)Cn1nnnn1,0.2369
OCC12OC1C=CC2O,0.2404
CN1C2C3CC2C13,0.2987
CC1OCCC2C(O)C12,0.3008
CCC(=O)NC=O,0.2218
OC1C2C3C(O)C2C13,0.3212
COC1CC=C(C)C1,0.2597
N=CN(CC1CO1)C=O,0.2301
Cn1c(noc1=O)OC,0.2666
CC(=O)N1C=COC1=N,0.1961
NC1=C(F)ON=CC1=N,0.1523
OC12CC(=O)C1COC2,0.2138
NC1C2C3NC1(C#N)C23,0.2462
CCOC(C)C(=O)CC,0.2294
CCCC1=CC(=O)OC1,0.226
C#CC1CCC11COC1,0.2826
COCC1C2C3CC1N23,0.3226
CC1(OC1CO)C#C,0.281
CCCc1c(onn1)C,0.2247
CC12CC3(O)C(O1)C23O,0.2749
CCC(C)(CO)COC,0.3223
ON=C1C2COCC1O2,0.2497
OC1C2CC3CCC13O2,0.2967
C#CC1OC2CCC12,0.2653
CC12OC3C(C13)C2O,0.3162
C1C2CCCC3COC123,0.2939
CCC(O)CC(C)C=O,0.2283
OC1C2C(C#C)N2C1=O,0.2198
CC12CC(CC3OC13)O2,0.3132
CC1CC23CN(C2)C13,0.2603
Cn1cnc(n1)C=O,0.1998
CC1CC(NC1=O)C#C,0.2655
c1c(nn(n1)CCO)O,0.2309
O=CC12CC3(CC3)C1N2,0.2195
CCC1(CC1OC)OC,0.3283
CC1C2C3NC3C12C#N,0.2403
OC1CC1NC=O,0.2706
CCC(C#N)C1CC1C,0.3203
OCC1CC2(CN2)C1=O,0.2053
COC12CN(C1)C2C,0.3209
N=C1OCC2=C1C=CO2,0.2213
CC(O)C1OC(C)C1=O,0.2158
c1c2n(nn1)CC(=N2)N,0.1886
C#CC1OCC2(CC2)O1,0.2802
CC1CC2C3CC1(O)C23,0.3087
CC1OC(C=O)C11CC1,0.2101
CC1(C)C2NC2C1O,0.3136
c1c(cnc(n1)N)C#N,0.1929
COCC(O)C1CCC1,0.3232
CC1NC(=O)CN2CC12,0.2492
COC1CC1C1(O)CC1,0.3067
O=CC12OCC1C1NC21,0.1948
OC1COC(=O)C11CC1,0.2772
OC1C(C#N)C11CCN1,0.2573
CC12OC1C(=O)NC2=N,0.2275
C1C2COC3=C2N1N=N3,0.1634
CNc1c(nco1)C#C,0.2017
OC1CC=C(C=O)C1O,0.1871
OC1=C2C3CC3N2C=N1,0.2073
OC1C2N=COC12C#C,0.2352
N=C1NC=NC=C1C#C,0.1581
CC(NC=[NH2+])C([O-])=O,0.2435
N=C1NC(CC1=O)C#N,0.183
C(c1nc(on1)CO)O,0.2526
CC1=CC(O)CC1C#C,0.2556
C1C2CC11N3CC1(C3)O2,0.305
CC1=CCC(=O)OC1=N,0.2185
CCC(C)C(O)CC,0.3339
CCc1cc[nH]c1C=O,0.1836
Cc1cc([nH]c1)N,0.2383
CC#CCC1CC1C#C,0.2808
Cc1nc(=O)[nH]nn1,0.1618
C(=O)c1nnc(o1)C=O,0.171
CCC(C)C1COC1=O,0.28
COC(=O)CC(O)C=O,0.2339
CN1CC2(C1)NC2C#N,0.2412
O=C1C=CC2OC12C#C,0.1698
CCOCCC(=O)C=O,0.1574
O=C1NC2CC12CC#N,0.2519
CC1C(=O)OC1(C)C=O,0.2215
CC(C)(C)C1CC1C#C,0.2865
CC1CC1C12CC1CO2,0.3072
C1CC2OCOCC2=C1,0.2444
CC(C)C1OCCC=C1,0.2632
Cn1c2c(nn[nH]2)nn1,0.2173
CC(=O)CCC(C)(C)O,0.2353
CCC(C)C1(C)CC1,0.3443
N#CC1C2NC2C2CN12,0.273
CC12C=CCC1C1OC21,0.2627
O=CN1C2CC3NC3C12,0.2638
COC1(CC(O)C1)C#N,0.2887
OC1(C=O)C2C3OC1C23,0.2055
CC1OCC(=O)NC1=N,0.2388
CC1(CC2(C1)CC2)C#C,0.3062
Cc1c(nc[nH]c1=O)N,0.1861
CC(C)(C)C1OCC1O,0.2984
c1conc1C2COC2,0.2437
COC1=CC(=N)OC=C1,0.1752
OC12CN3C4C(CC13)C24,0.2882
NC1=NNC2=C1N=NO2,0.1295
COC12CC1C(C2)C=O,0.222
O=CC12CCOC1CN2,0.2075
CC(C#N)C(C)(O)CO,0.3111
OC12C3NC1COC23,0.2751
N#CCC1COCCN1,0.2608
CC1(CCCC=C1)C=O,0.2122
CN1C2CC2(C#C)C1=O,0.2405
c1c2c(co1)nc([nH]2)N,0.203
CCCC1C2CC1OC2,0.3194
O=C1C2C3C4C1CC2N34,0.2211
c1c(c(on1)CC=O)N,0.1682
C1C2OC3COCC2C13,0.321
N=C1NN=CC=C1,0.1576
N=C1CC2=C(O1)C=CN2,0.2068
CC1=NCC=CCCO1,0.2341
Cc1[nH]c2nccn2n1,0.2171
CC(=O)CNC(=O)N,0.2249
C1C2C3CN4C1C2C34,0.2832
CC1CC(O)C2CC1C2,0.3263
CC(C)C12CC1(C)CO2,0.3027
ON=C1C2NC3C2C13O,0.2434
C#Cc1ccncc1,0.2067
C1C(CN1CC(=O)N)O,0.2657
FC1=CC(=N)C=C(F)O1,0.2101
COC1C2C(C1O)N2C,0.2943
Cc1cnoc1N=CN,0.1812
C#CC1C2CC2C11CC1,0.2935
OC1C2CC=CCC12,0.2479
CC1CNC(C=O)=N1,0.1638
OC1C2C3OC1(C=O)C23,0.2071
N=COC1CNCCO1,0.2465
c1c(c(=O)[nH]nc1O)N,0.1752
CN1C2CC1(C#N)C2=O,0.2466
CC(O)C(C)=NO,0.255
NC(=O)C12CC1C(=N)O2,0.2494
C#Cc1cc(c[nH]1)C#N,0.2035
C1C(=O)COCOC=N1,0.212
CCC1(C)COCCO1,0.3133
CC(O)CC1OC1(C)C,0.3149
CC#CC1CCCC1=O,0.2089
CC1(O)C2C3OC2C13,0.2925
ON=C1CC(O)C1C#N,0.2436
N=COC1C2OC2C1=O,0.198
CC1=CCC(C#N)C1O,0.2589
CC1C(O)C2(O)CC12O,0.2884
N#CC12NC1C1COC21,0.2526
N=COC12CC1CCC2,0.2806
CC1CCNC1=O,0.2736
c1ccc(cc1)F,0.2343
CC1=CNC(=O)NC1,0.2218
C(=O)N(C=O)C(=O)N,0.2141
CCn1cc[nH]c1=O,0.2302
CCC1(CC1)C(O)C=O,0.2257
CCC(COC=O)C=O,0.2269
Cc1noc2n1nnn2,0.2308
O=C1OCC(CC#N)O1,0.3187
CC1CCOCC11CC1,0.3281
CCC1CCC(O1)C#C,0.2878
CC1(C)C(C#N)C1(C)O,0.2915
O=C1CN2CC(C2)CO1,0.235
CC(C=O)C1=CNN=C1,0.2157
OC12CC1(NC2)C#C,0.2361
Cc1ccoc1C#C,0.1963
OC1(C#C)C2CCCC12,0.2704
CC1(OC1C#N)C#N,0.2862
C(=N)Nc1c([nH]nn1)N,0.2033
N=C1OC2CCCC2=C1,0.2125
C1CC2=C(C1)C1NC1C2,0.2404
CCc1c(non1)N,0.2198
NC1=C(OC=N)N=NN1,0.2142
OC12CCC1C1(CN1)C2,0.3051
CCC12C3COC1CN23,0.3122
CC1COC11CCC=C1,0.2497
CCC12CC(C1)CC2,0.3666
CC12CCC3C1COC23,0.3173
CC1CC2CC1C(=N)O2,0.2852
OC12CCC3OCC1C23,0.3173
C1CC2C3OC2(C1)C=C3,0.2277
Cc1coc(c1N)CO,0.2117
Cc1c(ccc(=O)o1)N,0.153
COC1C2C3CCN2C13,0.3213
CC1(C)COC1C1CO1,0.3167
C1COC(=O)NC1=O,0.2512
CC1(C)CC1(O)CCO,0.3148
COC12C3OC4C(C14)C23,0.3056
CCC(C)(O)CC#N,0.3092
C(=O)C(=O)C(=O)C(=O)N,0.1216
c1coc(cc1=NO)F,0.1772
CC(C)C12CC(O1)C2O,0.328
CC1(O)CC1COC=O,0.2612
CC12CC3C(OC13)C2O,0.3091
OC12CC1(COC2)C=O,0.2099
OC1C(NC1C#N)C=O,0.2124
CCC1(CCCC1)C#C,0.3122
OC12C3C4C3C1=CCC24,0.1585
CC1C2C3OC1C23C,0.3083
CCC#CC(=O)OC=N,0.2216
CC(CO)CNC=O,0.2833
CCC1C(=O)CC=C1C,0.2195
OC1CCCC11CCO1,0.2995
O=C1CC=C2CC=CC12,0.2196
OCC1C2CN1C2C#N,0.2588
CC(O)(CO)C(=O)C=O,0.1615
CC(O)C1OCC(C)O1,0.331
CC1CC1C1(CC1)C#N,0.2953
Cc1c2c(n[nH]1)OCO2,0.2231
CC1C2C1C(=O)C=C2N,0.1979
O=C1NC23CC4C2CC134,0.2475
CC(C)(NC=[NH2+])C([O-])=O,0.2442
CC#CCC(=O)CC#N,0.2219
C#CC1C=CC2COC12,0.2518
OCC12CC3OCC1C23,0.3024
CC(COC=N)=NO,0.2519
C#CCn1cc(nc1)N,0.2088
OCC#CCC1CN1,0.2784
C1OC1C12CC1OCC2,0.3171
CC(C)(C)N1CCC1=O,0.2732
CCc1cc(c([nH]1)O)C,0.2297
CC(O)C#CC1CC1,0.275
OCCC1C2C3CC1N23,0.3137
CC1NC2COC1OC2,0.2889
CC12OCC3C1CC23,0.3346
Cc1c2c(no1)CNC2,0.2315
NCC(O)(CC#N)C#N,0.2964
C1OC2CC3C1C3CO2,0.3193
CC12CC1N1CC21C,0.2904
N#CC1OC2C3NC3C12,0.2524
CN1C(C#N)C1C#N,0.2537
COCC(C=O)N1CC1,0.218
C#CC1CCC(N1)C#N,0.2713
CN1CC1CC#CC#N,0.2031
CC(C)(C)n1ccnn1,0.2606
CC1C2CC2CCC1=O,0.2242
CNc1c(cn[nH]1)OC,0.2225
COC1C(C)C1CO,0.3156
C1CC=CC2OC2CO1,0.2347
CN1C(C)(C)C1(C)C#C,0.2669
COC(C)CC1(C)CC1,0.3266
c1c(nn(n1)C2CC2)N,0.2127
CCOCc1conn1,0.2292
CCC12CCN1C2C#C,0.2586
C1N2CC11OC1C=CC2,0.2217
CC1CC2(O)CC1(C)C2,0.328
CC1C2C3CC3(CO)C12,0.3196
CC1=CC2(C)COC1O2,0.2467
CCN1C2C3CC2C13C,0.2997
OC(CC(=O)C=O)C#C,0.154
OC(C#N)C1C2CN1C2,0.2535
CC1OCCC(O1)C#N,0.2913
CC(C)CCC=O,0.2294
CC12COCCCC1O2,0.3265
CC12OC=NC1C2O,0.2531
O=CC1=CC2CC3C2C13,0.1873
O=CC1C2C3C1CN23,0.2261
CCC1(CC1)NC(=O)C,0.2715
C1CC(=O)COCC1=O,0.2037
N=C1NC=NC(=N1)C#C,0.1617
OCCC1CCN2CC12,0.3044
C#CC12C3CC=C1CN23,0.1734
N=CN1C=CCC1=O,0.2057
CC1C2C(O)C(CO)N12,0.2835
COC1C(C=O)C1C#N,0.2224
CCC(=O)C1=CCCC1,0.1952
NC(=O)C1COC1CO,0.2588
C#Cc1c(cno1)C=O,0.1839
C1CC(=C(C1)CO)CO,0.2364
Cc1ccc(cc1F)O,0.2176
c1cnc(cc1F)N,0.21
c1([nH]c(=O)on1)N,0.2605
CC1(CNCC1=O)C=O,0.1731
OC1C2CC2C1N1CC1,0.3153
OC(C=O)C1=CN=CO1,0.1938
CC12CCC1CC21CC1,0.3401
CCC1C2CC1C21CO1,0.3438
CCC1CC(C)(CO)C1,0.3218
C1OC2C1CC1CC2O1,0.3062
C1CC1CCOCC#N,0.2924
c1c(nc(cn1)F)N,0.1884
CC1CC1C1OC1(C)C,0.3358
CC1OC(=N)C1(C)O,0.286
C1C2CC34COC3C2N14,0.2917
CC12C3CC1(O)CC23O,0.3031
FC(F)(F)C1OCC1=O,0.2284
CC12CC1(OC2)C(N)=O,0.2575
c1c(con1)N,0.2138
CC1C2C1C(C)=CC2O,0.238
OCCC12CC(O1)C2=O,0.244
COC1C2CC(C)CC12,0.3157
CC12C=CC3C1C=CC23,0.1964
O=COC(CC#N)C=O,0.2211
C1C2OCC12C1CCO1,0.2952
OCC1C2OC3(CC3)C12,0.3003
c1c([nH]c(n1)C=O)N,0.1669
CCOC(=O)CCOC,0.2715
CC(O)C1(C)NC1CO,0.3066
COc1c(nc(o1)N)O,0.2197
COC1CC(C)(C1)C#N,0.298
CC1(C)CC2OC=NC12,0.2606
Cc1c(c(oc1N)O)C,0.2254
CNC(=N)N1CCC1=O,0.2159
OC12CC=CC1NC2=O,0.2499
CCC1OC1C#N,0.2941
CC#CC1CC1N1CC1,0.2554
C1NC11C2CN3CC2C13,0.2966
N#CC12CN1C=NC2,0.245
CCC(CC)C(C)(C)C,0.368
OC1=C(NC=C1)OC=N,0.1732
C#CC1=NCC2CN12,0.2062
C1CC1CCNCC#N,0.2699
CN(C)C(=O)C(N)C#N,0.2588
CC1C2OC2C11CC1,0.3402
Cc1cc([nH]c1C#C)N,0.1878
CCCC(=O)C1NC1C,0.2229
COC1C2CC1C(=O)O2,0.2693
OC12C3CC1OC23C#N,0.2443
O=CCC12C3CN1CC23,0.2092
c1cc([nH]c1)C(F)(F)F,0.2412
C#CC12CCC3C(O1)C23,0.2542
CC1(C)CC2CC1C2=O,0.2311
CC1COC(=N)CC1C,0.2764
OC1C2C3OC2(C#N)C13,0.2463
CC(O)C1=C(O)N=CN1,0.2249
CC(C=O)C(C)=NO,0.2064
N#CC1C2CC3OC2C13,0.2834
c1cc-2ccnoc2c1,0.1195
C#CC1C2CC3CC1N23,0.2652
CCOC1(CC1)C(=O)N,0.2661
OC12CC3OC(CC1)C23,0.3072
CC1C2CC2C(C)=C1C,0.2413
OC12CN3CC1C2(O)C3,0.2934
OCC1(OC2CC12)C#N,0.2753
OC1C2C1C(C=O)C2O,0.2041
CCC1(O)C=CC2CC12,0.2472
CCc1coc(c1C)C,0.233
CC1C2CCC1C(=O)O2,0.2752
CC1(CO1)C1COCO1,0.3402
CC(=O)C1(CN1)C1CC1,0.227
CCC1=NOC(=N)N1C,0.2296
C1NC11CC2CCC=C12,0.2282
CC#CCC(C)NC=O,0.2758
CC1C2CC2(C)C11CO1,0.3423
C1CN1CC#CCCO,0.2791
O=CC12CC(O1)C21CN1,0.2024
OC1C2C3CN3C12C=O,0.1988
O=CC1C2CC(C#C)N12,0.2071
c1c(n(nn1)CC=O)N,0.1679
C1C=CCOC1=O,0.2659
CC1OC2CC(O1)C2=O,0.2063
CC1NC1(C)C#CC#C,0.2104
CC1=CC2OC3C(C1)C23,0.2265
COC12COC1C2O,0.2841
CC12CC1OC2=O,0.2767
CN1N=NC(=N)C=C1F,0.1638
OCC12CCC(CO1)O2,0.3339
CN(C)C(CO)C(C)=O,0.1873
[O-]C(=O)CC1CNC=[NH+]1,0.24
C1OC11CCC2OC2C1,0.3511
OCC1=NC2CCC2O1,0.2675
C#CCOc1ncon1,0.2483
CCC1(CN1)C(O)CO,0.3038
CN1C2CC(O)C12,0.2947
O=C1CC2(CC2C#N)O1,0.2852
CCC1CCC2CC12O,0.3252
CC(CCOC=N)C#N,0.2842
CC#CC(=O)OC(C)=N,0.2283
C1CC2=CC3CC(O3)C12,0.2321
c1c(con1)CO,0.2442
OCC1C2OC2C1O,0.3109
c1c(n[nH]n1)CN2CC2,0.2394
CC12C3CC1C(C=O)N23,0.2155
c1nc(on1)N(=O)=O,0.1969
Cc1cc(n[nH]1)NC=O,0.2258
O=C1CC2C3NC3C2N1,0.2749
C1Cc2c(oc(=O)[nH]2)C1,0.2402
CC12C3CN4C1C4(C)C23,0.3012
CC1CC2NC2C=C1,0.2482
CN1C2C(O)C2C1C#C,0.2375
CC(O)C#CC(N)C#N,0.2655
CCOC1C(C)CC1O,0.3086
COC(C)C1=NC=NO1,0.2468
O=C1CC2NC1CC2=O,0.1985
CC12CC(C3NC13)C2=O,0.2366
c1c2c(c([nH]1)N)C=CC2,0.1936
CCCC12OC1CC2=O,0.216
CCC1(CCCO1)OC,0.3377
CC12C3C4CC1C4CN23,0.3328
c1cc(nc(c1N)F)F,0.1897
CCCN(C)C(=O)C#N,0.2183
O=C1CC(C=CN1)C#N,0.2142
CC#CC1(CC1)CC#N,0.272
CC1(C)C2OC1C1OC21,0.3056
OCC1CC11CCO1,0.2898
C1CC1(C#CCO)C#N,0.2674
NC1=C(F)N=COC1=N,0.1619
CC1=C(COC1=O)CO,0.2305
CC12C3C4C3N3C1C2C43,0.295
CC(=O)COC=O,0.2312
C#CC1C2CN1C2,0.2571
c1c(con1)OC(=O)N,0.2338
O=C1NCCC2CN12,0.2858
O=C(C#C)C1CCC=C1,0.1829
CC1COC1CCC=O,0.2289
COC1COC2C(O)C12,0.2904
c1[nH]c2c(onc2n1)N,0.1825
c1c(c(on1)N=CN)N,0.163
C(#N)c1nc(c(o1)N)N,0.1712
OCC12C3C4OC1C4N23,0.3044
O=CC12OCC1C1OC21,0.2025
CN(C)CC(C)(N)C#N,0.2656
CNCC(=O)OCC#N,0.2226
Cc1c(n[nH]n1)O,0.2347
CC12CC(=O)C1(C)C2O,0.2301
N#CC1C2NC3C2OC13,0.2791
CC1(C)C2C3C4C3C1C24,0.3208
COC(C)=NCC1CN1,0.2655
CC1(COC1)C(O)C#C,0.2704
C1NC11CC2OC1C=C2,0.2403
OC1CC(=O)C1N1CC1,0.2175
CC(CO)C1CCC1,0.3409
CCC1COCC2CN12,0.2947
CC12N=C3NC4C1C2C34,0.1657
O=C1NC2C=CCC2O1,0.2582
CCn1ccc(=O)cn1,0.1853
CC#CC(=O)C1CN1C,0.1724
CC12CC3(C)OCC1C23,0.3258
CCOCC#CCC#N,0.2754
COC1(C)CN(C)C1=O,0.2592
CC12CC1(O)C1(C)NC21,0.2994
OC1C2C3OCC1C23,0.2924
C#Cc1c2n(nn1)CC2,0.2302
O=CC#CC1CCC=C1,0.2004
CN1N=C(C)N=CC1=N,0.1464
CC1CC2CCC2=C1,0.2455
CC1(C)OCC11CO1,0.3299
C#CC1CC=CC=CC1,0.1898
CCC1(NC1C)C1CN1,0.3081
CC#CC1C2OC1C2O,0.2832
CC1(C)CC2(CO)CC12,0.3215
CC1C2CC(O)C1(C)O2,0.3066
CCC1C2CC1C=CC2,0.2525
c1nc(c(o1)C=O)N,0.1773
ON=C1C2C3C=CC1C23,0.2212
O=C1NCC2COCC12,0.2731
OC1C2OC(=NC12)C#N,0.2086
O=CC1C2CC1C21CN1,0.2188
CNc1nc([nH]n1)N,0.2349
C1C2OC3C4C=CC12C34,0.1973
CC1(CC1)CC#C,0.3123
NC1C(C#C)C1(O)C#N,0.2436
Cc1cc([nH]c1O)C#N,0.1947
NC1=NCC23CCC12O3,0.2442
CN=C1OC(C)(C)C1O,0.2732
O=CN1C2CC=CC12,0.2394
c1cnnc(n1)C(=O)N,0.167
N#CC12COC3C(N1)C23,0.244
N=CN1CC2OC2C1=O,0.2156
CC1C2CC1(O2)C#N,0.2558
OC(CC(O)C#N)C#C,0.2853
N=C1COCO1,0.2907
CCC12CC(C1)CCO2,0.3133
Cc1ncon1,0.2687
CC1C(CO)N(C)C1=O,0.2756
CC1N=C(N)OC1(C)C,0.2798
C1OC23COC4C2C1C34,0.332
C1CC1CC2(COC2)O,0.3123
CCC1CCCC1,0.3842
C1CC23C4CC(C2O4)N13,0.2916
O=C1OC23CNC2C1C3,0.2472
CCOC1C2COC12,0.2965
CC1(C)CCC2(O)CC12,0.3307
CC1OC2OCCC2=C1,0.2508
C1OC1C1=CNC=N1,0.2469
CCC1C=CC2OC12C,0.244
O=C1NC2C3CC(=C1)C23,0.1746
CCOc1cc[nH]c1,0.2402
COCCC1CN1C,0.3084
OC12CC1(CCC2)C=O,0.2077
CC1OCC11CC1C=O,0.2242
c1(c([nH]c(n1)O)O)N,0.2267
O=C1OC2C3CCC12O3,0.252
CCN1C=NC(=N)N=N1,0.1742
FC1=NNC=CC1=N,0.1803
Cn1nc2c(n1)nc[nH]2,0.2099
CCC1(CCOC)CO1,0.3418
CC12COC1C2(C)C#C,0.2673
CC(CCO)(C=O)C#C,0.2192
N=C1C=C(OC=N1)C=O,0.1644
OC12C3CC1C3C2C=O,0.2175
OCC(O)C#C,0.2813
C1CC=C(C1)CCC#N,0.2553
COCC1(C)CC(=O)O1,0.2721
CC1CC1CC1(O)CC1,0.3244
CCC(=O)C1C2CC1O2,0.2115
COCc1[nH]cc(n1)N,0.2204
CCN=C(C(=O)NC)N,0.2137
CC(O)(C=O)C1(O)CC1,0.2066
CC1=C(CCOC1)C#C,0.2086
COC(C)CCO,0.3278
Cc1cnc([nH]1)C=O,0.1815
O=C1C2C3C1OC23C#N,0.2131
NC1CN2C1=COC2=N,0.2055
OCC(O)C(=N)NC=O,0.2284
c1([nH]c(nn1)N)N,0.2458
CC(C)(CC#N)N1CC1,0.278
CC1=CC2CC2(C)C1,0.2431
CN1CC23CC(C2O)C13,0.2824
CC1OC2CC3OCC123,0.3093
N#CC1C2OC1C21OC1,0.2905
CC1=CC2CC1C2(C)O,0.2373
C1CC1NC(=O)C=O,0.1714
OCC1CC2(CO)CN12,0.2977
OCCC1OC1C#C,0.281
O=COC1C2C3C1CN23,0.255
CC1CCN=CO1,0.2735
CC1CC2NC12C=O,0.2045
C1COCC(=C1)CCO,0.2591
CN=C1NC(C#C)C1O,0.251
CC(C)C1COC1C=O,0.2098
CC1(CO)C2OCOC12,0.3114
ON=C1CC2CC12O,0.2439
C1OC1C12CN1CCC2,0.3155
OC(CC#N)C(F)(F)F,0.3321
Cc1c(c[nH]n1)CC#N,0.2631
CC(O)COC(=O)CO,0.2668
CC1NC(C#N)C1(C)C,0.2682
C1Cc2noc(=O)n2C1,0.246
C(=O)Oc1[nH]nc(n1)N,0.198
OC12C(CC1=O)C2C#N,0.232
CC1NC(=O)CCC1O,0.2687
c1c(nc(o1)N)C#N,0.2043
OCC1(CC(O)C1)C#N,0.2991
Cc1cccc(=O)n1C,0.1744
C1CC23COCC2OC13,0.3084
OC1C2CC1C1CC21,0.3212
C1C=CNC(=O)C(=N1)N,0.1881
CCC(=O)CC#CC=O,0.2012
CC1C2CN3C2C13C#N,0.2758
CC12CC(C1)CCC2,0.3509
O=C1CC2CC3C(O2)C13,0.2234
CC1CCCCOC1=O,0.2609
C[NH+]1C=CC(=O)[C-]1C=O,0.1497
c1ncncn1,0.2214
c1ncn(n1)C(=O)CO,0.2283
CCCc1ncco1,0.2443
CCCN1CCCC1=O,0.2694
CC1C(C)C1OC1CC1,0.3111
CCC12C(O)C1N1CC21,0.2771
CC#CCC(C)C(C)=O,0.224
CCC(O)C1(CO)CO1,0.333
OCC12C3CC1CC2C3,0.3181
N=C1OCC2=NC=NN12,0.2378
CC1CC=CCN1C=O,0.2533
CC1CC2C1CC21CC1,0.3414
O=CC1C2COC(=O)N12,0.2128
C1CC2OC2CO1,0.3333
CC(=NO)CC(F)(F)F,0.2542
CC1=CC=C(O)OC1=N,0.1675
O=CC12CC1COCC2,0.2305
CC#CC1C(C)N1C,0.256
CCC12CCC(C1)OC2,0.3109
CC1(C)C=CCC2CC12,0.2646
CC1C=CC(=NO)C1C,0.1927
CC1CC(=O)C1C1CN1,0.2138
c1c(c(n[nH]1)N)N,0.2248
CC12CC(CC=C1)C=C2,0.2315
CC(=O)N1CCC=CC1,0.2492
CCC(O)CC(O)C#N,0.305
CC1CC1C(C)(C)C#N,0.318
COc1ccn[nH]1,0.2531
CC(=O)C(=NC)N1CC1,0.1777
CC1OCCC(=O)C1C,0.2223
OC(CC#N)C#CC#C,0.2244
CC(CO)CC(=O)C#C,0.2078
C#CC12CC3C1CC23,0.292
CCC1CC1CC1CO1,0.3504
CC1CC2C(O)CC12C,0.3209
CC(O)C1(C)C2CCC12,0.3144
C1CC1OCC#CC#N,0.2176
CC12CCC(CO1)C2=O,0.206
C1C2C1C1C=CC2C=C1,0.2281
O=C1C2COC1C21CO1,0.1915
[O-]C(=O)C12C[NH+](C1)CC2,0.1729
OCC1(CCC1)C1CO1,0.3316
CC#CCOCC(C)C,0.2842
CC(=O)C(O)CCCO,0.2382
OCC1[NH2+]CC1C([O-])=O,0.2732
COC(C=O)C(N)=O,0.2094
CCCC1COC1CC,0.3212
CNc1ccccc1,0.2013
CC12OC1C(C=C2)C#C,0.2423
C#CC12CC3C1N3C2,0.2646
CCCOc1ccno1,0.2367
CCC1C2C3C1CC23O,0.3191
COC1C(C)C1(O)C=O,0.2017
ON=C1CC2OC=NC12,0.2402
CNC1CC1(O)C#N,0.2393
CC1CNC(C)C(=O)N1,0.2455
NC(=O)C1COCC1=O,0.2123
CC1C(C2CC2)N1C,0.29
C1CC12CC=CCO2,0.266
CCC1C2C(CN12)C#N,0.2716
CC1C2NC2C=CC1=O,0.1851
OC1=NC=C(N1)OC=N,0.2139
CC1CC2=CC=C(O)N12,0.2316
CC1C2OC3C=CC2C13,0.2458
CN=C1CNCC(C)O1,0.2448
CCCC1C=CNC1=O,0.2141
C1C=CC2OC1CC=C2,0.2367
CC(CO)OC1(C)CC1,0.3212
CCN1C2CC1(C)C2O,0.27
CCC(=O)N1CCC=C1,0.2078
CC1=CC2(C)CC1(C)O2,0.2337
CN1C2C3OC3CC12C,0.2794
NC1C(O)CNC1C#N,0.2587
CC1(CO)OC1CO,0.3377
OC1CN(CC2CO2)C1,0.3027
CCC1OC(=O)CC1C,0.2784
N=C1NC(=O)CC=C1,0.2143
CC1C2C(C#N)C(=N)N12,0.2457
CC1(O)CC=CC11CN1,0.2451
CC(=O)OC1C2CC1C2,0.2828
COCC1CC1C#N,0.2912
CCNc1nc([nH]n1)O,0.2457
O=C1CC23CC12CCO3,0.2242
O=CC12CC(C1)CC=C2,0.2164
C#CC1(CN(C1)C=O)O,0.2551
CC12CCC1OC2=O,0.2787
CC1CCC1(O)CC#C,0.2933
c1c(nn[nH]1)OCCO,0.2255
OC12CN(C1)CC1NC21,0.2811
C1C(CC1=O)COC=O,0.2227
CC(O)C(N)=O,0.2786
CCC1OC2C1OC2=N,0.2641
Cc1nc(on1)NC,0.2447
c1cnc2c(n1)n[nH]n2,0.1682
CC1=CC2C3N2C1C3=O,0.1903
CC12CC3(CCC13)C=C2,0.2276
Cn1c(cc(n1)C#N)N,0.2133
c1coc(=O)nc1O,0.2027
CCOC(=O)C(N)CO,0.258
CC(=O)C1=CCC2CC12,0.191
c1ccn(c1)C2CCC2,0.2458
CC1=NC(=N)N=C(O)O1,0.2177
CC12C3OC3C1C2C#C,0.2626
CC12OCC3(C)CC1C23,0.3111
c1cnn(c1)C(=O)CO,0.2188
CC12OCCN3C1CC23,0.3054
N#CC1=CC2CCN2C1,0.1876
Cn1ccnc(c1=O)N,0.1673
O1C2C1C1N=COC21,0.2704
C#CC12CC3CCN1C23,0.2708
COC12CC1CCC=C2,0.2476
O=C1C2CN3CC1C23,0.2036
CC1C2C3CC1CC2O3,0.3127
CC(C=O)C1(O)CC1C,0.2179
CC12COCC1OC2=N,0.2888
CC1(O)CC11CC2OC12,0.3148
CC1(CN1)C1OC1C#N,0.2567
CC1(CC1)n2ccnn2,0.2563
OCCC1N=CNC1=O,0.2268
Cc1ncn(n1)C(=O)C,0.2192
CC1OCC2CC2CO1,0.3317
C1OC2C3C4CCC12N34,0.3085
CC(O)C1C2CC1C2C,0.3369
CC(O)C(C)CC1CC1,0.3288
N#CC1(CN1)C1CC1,0.2842
CCCC1(NC1C)C#N,0.2848
NC1=NNC(=C1)C1CO1,0.2193
CC(C#C)N(C=O)C=O,0.2143
C1CC11C2OC1C1NC21,0.3062
CC1C2COCC2C1=O,0.2128
Cc1nc(on1)NC=N,0.2221
CC1(C)CN2CC2C=C1,0.2308
OC1CC1C1=NC=NN1,0.2534
CCC(CC)C(=O)NC,0.2745
c1c(nco1)C(F)(F)F,0.2533
CC1(O)C2(C)CCC12O,0.2867
OC1(CCC1)C1CCO1,0.3151
N=C1OC2(COC12)C#C,0.2556
OCC12C(O)C1C1OC21,0.2813
CC1OCC2CC2C=C1,0.2461
CC(C)C(C)CC=O,0.2289
CCC(C)C12CC(C1)C2,0.3646
N=C1CC2(CCC2)O1,0.2877
[NH3+]CC(O)C(O)C([O-])=O,0.2807
CC(=O)COC=N,0.221
CC12CCC1(O)CCO2,0.312
CC#CC1N(C)CC1=O,0.1997
CC12CC(C1)C(O2)C#C,0.2785
OC12CC3CC1(O)C23O,0.2601
C#CCC1OCC1C#N,0.2714
CC1CCN2CC12C#C,0.2717
CC1C(C)C1NC(C)=O,0.2688
CN1CC11C2NC1C2O,0.2907
CC1CC=C(C1)C(C)=O,0.1939
CC1C2C1C1(CO1)C2O,0.3289
N=C(C#N)N1CC1C#N,0.2221
O=CC12CC(C1)C1NC21,0.2145
CC1C(O)C(=O)C=C1C,0.1957
OC1C2CC3C4C2C1N34,0.2832
CN1C2C3NC3C12CO,0.2593
CN=C(c1cn[nH]n1)N,0.2069
O=CC1NC11CCCC1,0.2197
CC1(CO)C2CCOC12,0.2948
C1CC(C1)(CC(=O)N)O,0.269
N=C1CN=C2CCCN12,0.2177
C#Cc1cc[nH]c1C#C,0.183
CC1CC23CC12CCO3,0.2914
C1CC2=CCCCCC12,0.2535
CC1(NCC2OC12)C#N,0.2674
CCC1OCC=C1C#C,0.2042
CCC1(C)C2CCCC12,0.3286
CC1(O)CN2CCC12,0.2756
COCCC#CCCO,0.3052
NC1=CN=COC1=N,0.1673
CC1(CO1)C(=O)OC=N,0.2387
CC(=N)OCC(F)(F)F,0.2989
OCC(=O)C1CC1C#N,0.2307
CC(O)CC(C=O)C#C,0.2251
O=C1CC2COC2C1=O,0.1362
c1nc(c(o1)N)N,0.2186
COC1(CC1(C)C)C#N,0.2898
N#CC1OCOC11CC1,0.2749
CC1C2N=CNC12C=O,0.2038
OC1C2CC2OC11CC1,0.2971
CC1C2C1C(O)CC2C,0.335
O=C1C2C3C4C3N2C14,0.2115
CCCC(O)C1(C)CN1,0.293
OC12CC1COC21CC1,0.3003
CC1C2C3C2C1C3C=O,0.2232
CCc1ccc(=O)[nH]c1,0.1743
CNC12CCC1OC2=N,0.2508
C1C2CN1C1=C2N=NO1,0.165
CC1CC11OCC11CO1,0.3007
CC12CC(C1)(CO2)C#C,0.2842
OC1CNC2=NON=C12,0.2024
O=CC1OCCN2CC12,0.2066
CC(O)C1=CCCC1O,0.2545
NC1=NC2COC2C1=O,0.1703
CCC1C=CC2(C)CC12,0.2448
O=CCC1CN2CC12,0.2129
CC1CCC(C)=C1CO,0.2452
CC1C2NC2C2(C)OC12,0.3092
COC1CC1OC,0.3197
N=C1NC=CCOC1=N,0.1875
CN1N=NC=C1OC=N,0.2411
C1C2C3CN=COC2C13,0.274
C1C2N=C3NC4C2N1C34,0.152
CCCc1c(nn[nH]1)O,0.2213
C#CCC1=CC2CC1C2,0.2346
CCCCC(=O)C=O,0.1557
CC1OC2CCN3C1C23,0.307
OC12C=CC3OC1C23,0.2162
CC(C)C1(CC1)COC,0.3313
COCC1OCCO1,0.3294
CC(CCCO)NC=O,0.2818
OC1CC2N3CC3C2=C1,0.2348
CCCn1cc[nH]c1=O,0.2301
CC12OC3C1C2(C)C3O,0.2923
c1c(oc(=O)o1)N(=O)=O,0.1751
N#CC1C2CCC1OC2,0.2881
c1c(nn[nH]1)NCC#N,0.2165
CC(=NO)CCCC=O,0.2214
O=COCC1CNC1=O,0.2762
CC12CC(C1)CC2C=O,0.2235
CC1CC1C1CC(=O)N1,0.2779
CCCC1=CCNC1=O,0.2225
ON=C1CN2CC2C=C1,0.181
CC1=CC2(C)OC2C1O,0.2392
CC1(COC(=O)OC1)O,0.3168
CC(=O)Cc1cn[nH]n1,0.2334
CC12CC3N4C1C4C23O,0.2828
OCCC12CC1OC2=O,0.2651
c1c(ncn1CC=O)N,0.1502
CCC1(CCO1)C1CC1,0.3271
C1C2COCC3COC123,0.2981
CC1(CCN(C1)C=O)C,0.2664
CC1CC11CCC2OC12,0.3446
NC(=[NH2+])C(C#C)C([O-])=O,0.2021
c1ccc(c(c1)C=O)O,0.181
CC(O)C1=CCCC1=O,0.1967
N#CC12CC3CN1CC23,0.2613
C#CCN1CCC1=O,0.2742
OCC1C2NC(=O)OC12,0.2935
CNC(C#N)C1(O)CC1,0.2811
O=CC1CC=CN1C=O,0.1778
CC1=C([O-])C=CNC1=[NH2+],0.1997
CC1OC11COCC1C,0.3351
CC(=O)C1=CCOC1=N,0.1843
CC1C2CC3(CN3)C12O,0.3071
NC(=O)C1CCOC=N1,0.2453
CC12NC(C1O)C2C#N,0.2818
C1C=CC23C4C5C(N24)C135,0.2043
CC1OC23CCC12OC3,0.2797
CCCCCC1(CC1)C,0.3461
OC12CC3C4CC1C2N34,0.3059
NC1(C#N)C2CCCC12,0.296
CC1C2CC3N1C23C#N,0.2667
Cn1c2c(cn1)CCO2,0.2381
CC(=O)C1(CC=O)CN1,0.2116
OC1C2NC2C1(O)C#N,0.2688
CCC(CC)(CO)C#C,0.3101
C(C(=O)N)N=C(CO)N,0.2421
CC1=COC(=O)C(=N)O1,0.1782
CC1C(O)CN1CCO,0.2836
CCC1OC1(C=O)C#C,0.2164
CC(C)(CCC=O)C#N,0.2287
CC12COC3C(C13)C2O,0.2888
CC#CC(=O)NC1CC1,0.2295
NC1=CC([O-])=NC(=[NH2+])N1,0.2166
COC=NC12CC1CC2,0.2363
CN=C1OC(O)=CN=C1,0.1576
C1C=C(C(=O)N1)CCO,0.2218
CCC1CCC(O1)C#N,0.2958
CC1OC11CC2CC1O2,0.3243
O=C1CC2NC(=O)NC12,0.1958
CC1CCC1(O)CC#N,0.298
NC(C#N)C(O)CC#N,0.2935
CC(=N)OC1CCCO1,0.2869
CNC(=O)n1cnnn1,0.2334
NC1=NC2CC(O1)C=C2,0.2193
CC1(O)C(O)C=CC1=O,0.1878
CC1CC11CC(C)C1=O,0.2146
CC1C2(CC2)CN2CC12,0.3075
CCC12CC3CC1(C)C23,0.3256
O=CC12CNC1CN2,0.1956
c1c(nco1)C=O,0.2016
CC1CC1NC(=N)C#N,0.2053
C1C2NCC3OC1C2O3,0.2877
c1c([nH]c(=O)[nH]1)C=O,0.1638
N#CC1(CO1)C1CC1,0.2984
OC1CC1C1CC2OC12,0.3243
CC1=CC(C#N)C2OC12,0.2445
O=C1COC2COC1C2,0.2039
O=CC1CCCCCO1,0.2243
OC1CCC2OC2C=C1,0.2515
Cc1c(c(co1)N)CO,0.2138
N=C1OC2C3CN3C2=C1,0.2024
CCOC1CC=C(C)C1,0.2596
Cc1cc(n(c1)C)C#C,0.1973
N=C1OCC23CC12CO3,0.2564
O=C1C2CC(O2)C11CC1,0.2121
CC#CCCCC#CC,0.2861
C1CN1C(=N)NC=O,0.2315
CC(NC=O)C1CC1O,0.2771
O=C1NCC2NC2CN1,0.2818
Cc1c(cc([nH]1)N)O,0.2205
CC1C2C(C)C1C2CO,0.3369
C1OC2C=CCCOC12,0.251
O=CC1OC2C1NC2=O,0.2057
CN1CCc2c1nco2,0.1916
CC1OCC1CC1CO1,0.3281
CC1(O)CCC(O)C1,0.3284
CCC1=C2CCC2CC1,0.2399
O=COC1CC11COC1,0.2515
CC1C2N(CC12O)C=O,0.2553
CCC#CCC1(C)CO1,0.2956
C(=O)C#CC#CC=O,0.1822
CCc1c(nc[nH]1)C,0.2438
CC12C3CC1C=CC23,0.2377
CC12CC1OCOC=N2,0.2434
COCC(=O)OC,0.2797
C1CC12CCN2CC=O,0.1917
Cc1c(=O)cnoc1F,0.1869
CCCC1(CC1)OC,0.3277
c1c(c([nH]n1)CO)N,0.2193
OCCC12CCCC1N2,0.3102
COC(C)C(C)(C)C#C,0.3068
OC1COCCN2CC12,0.3039
N=C1CC2=C(N1)ON=N2,0.1654
CCC1(CCC1)O,0.3219
O1C2C1C1C=CC3C2N13,0.2216
Cc1c([nH]nc1N)C#C,0.1928
CC(N)(C#N)C1CCC1,0.3018
OC1CC2CC3C2C13O,0.3158
CC1(CC=O)CN1,0.2188
COC1COC2CC12C,0.3055
Cn1ccc(c1C=O)N,0.1636
CC1C2CC1(O)C2C=O,0.2163
COC1C2COC12,0.2973
C1CC1(C(F)(F)F)N,0.3469
N=C1CC(CC#C)O1,0.2862
C1CC11CC2CCCC12,0.3379
COCc1cnco1,0.2422
COC(=N)NC(=O)OC,0.2691
OC1COC2C1NC2=O,0.2559
CCC1C2NC1C2C#N,0.275
CC1CC1CNC(N)=O,0.2993
CN=C(N)NC(=O)C#C,0.178
N=COCC1=CN=NN1,0.2493
Cn1c(c(nn1)O)C=O,0.1711
OC1CC11OC2CC12,0.2984
CC12OC1CC2=NO,0.2497
CC(C=O)C1CNC1=O,0.223
CC(=O)C(C=O)N1CC1,0.2167
CC1C(C)=CCC11CC1,0.2596
CC1C2CC2C11CCC1,0.3332
CC1=C2CCC2(C)CC1,0.2389
N#CC1=C2COC2CC1,0.2039
O=C1COC(=O)C11CO1,0.1891
COCC1(O)COC1=N,0.2782
CC1=C(NC(=O)C1)C=O,0.1569
CC1NC(C=O)C11CO1,0.2114
O=C1CC2(NC12)C1CN1,0.2155
Cc1ccc(cn1)C#N,0.2092
CC(C)C12CC(CC1)O2,0.3206
CN(C=N)c1ccno1,0.2054
C1OC11C2NC2C2NC12,0.2816
CC1N2CC2C2OC12C,0.2944
CC1C(C)C11OCC1O,0.2849
N=C1COC2CC2O1,0.2711
O=CC1=CC2CN2CC1,0.1729
OC1C2NC2COC1=N,0.2768
c1c(c(on1)CC#N)N,0.2038
N#CC1C2C3OCC3N12,0.2585
CC12CNC1=CC(=O)O2,0.2107
CC1(C)C2NC11COC21,0.2658
C1CC2(C1)CC(=O)NC2,0.272
CC12CC3C1C=CC3O2,0.2445
NC1=CC(=O)OC1=N,0.1806
c1c(nc2n1CC2)C#N,0.2251
COCC1CCC1OC,0.3248
O=CC1CN=C(O1)C#N,0.2083
c1nc(n(n1)CC#N)N,0.233
CCOC(C)C(O)C#N,0.2961
CCc1c(nc(o1)O)N,0.2222
CC1OC2C3CC1(C)C23,0.3067
OC1C2C1C1NC2C1=O,0.2302
N=C(CC1CO1)NC=O,0.2293
CC1(OC2CNC12)C#N,0.2586
N=C1OC2=C(NCC2)O1,0.225
N=COCCC(=O)C=O,0.1576
CC#CC(O)C(C)C#C,0.2795
COC1=CC(=N)N=NN1,0.158
OCC1C(O)C2OCC12,0.2952
CNC(=O)N1C2CCC12,0.2661
N#CC1CC11CC2CC12,0.2913
Cc1cc(cnc1C)O,0.2067
CC(CC#C)C(O)C#C,0.2845
CC1C(C#C)C1(O)CO,0.2812
Cc1c(nc(o1)C#C)N,0.1685
CC#CC1CNC(=O)O1,0.2812
CC(C)CCC(O)CO,0.3171
Cn1c(c(nn1)C#C)N,0.2202
CC1=CCOC2C(O)C12,0.2349
O=C1CCN=C2OCC12,0.218
C1OC1C12CN3CC1C23,0.306
CC1CC(C)C(C1)C#N,0.3431
CCCNC(=O)CO,0.2718
c1cocc1C2CC2,0.241
N=C1C=NON=NC1=O,0.1567
CCC1(C)OCC(C)O1,0.3304
CC12CC(C#N)C1N2,0.294
CC(C)C(C)C(N)=O,0.277
CN1CCc2c1c[nH]c2,0.2175
OC12C3C4C3C1CC24,0.2876
COC1(C)COCC1O,0.3143
O=CC12CN1CCC2,0.2189
CN1C2C=CNC(=O)C12,0.2069
O=C1COC11C2CC1N2,0.1897
CC1=CCC2OCCC12,0.2597
CNc1c(cncn1)N,0.2001
CC1NC(=O)C(=O)C1O,0.1704
CCN1C2C1C(O)C2O,0.2798
N=C1ON=CN1C=O,0.1991
OC1COC2CC12C#N,0.2762
CCCC(C#C)C#CC,0.2873
NC1C(CO)C1(O)C#N,0.2411
CC1CC2C(C3CO3)C12,0.3293
NC(CCOC=O)C#N,0.2858
CC1(CC1)OC1CC1O,0.3169
COCCCC#CCO,0.279
OC1(C#C)C2CC1N2,0.2679
CC(O)CC(O)C=O,0.2251
OC12CC3CC1C2CC3,0.3152
C#Cc1c(noc1N)N,0.216
CCC(=O)OC(C)C#C,0.2781
OCC12CC3C1C(O)C23,0.2987
CCC12CCC(CO1)O2,0.3287
N=COC1C2CC1C2=O,0.2435
CC#CC12CCC1OC2,0.275
CC12CC(O)(C1)CC2O,0.32
OC12CC1COCOC2,0.3344
CC(=O)C(=O)NC1CC1,0.1788
CC12CC(CC1)(O2)C#N,0.2731
CC1CC(O)(CC=O)C1,0.2172
O=C1CCCC2COC12,0.2048
ON=C1CC(O)(C1)C=O,0.2105
OCC(O)(C#C)C#N,0.2749
OCCC1NCC1=NO,0.2327
CC(O)C12OC1CC2=O,0.2151
CC(=O)C(=N)OCC#C,0.1952
CN=C(C#N)OCC=O,0.2144
CC1(CO)NC(=O)C1O,0.263
CC1CC(=O)C2(C)CC12,0.2269
CC(O)C1=C(C)N=CO1,0.2352
CCc1c(nnn1C)N,0.2144
C1OCC2C=CCOC12,0.2555
CCC#CC1CN=CO1,0.2684
CC12C(O)C1C1(O)CC21,0.2756
CC(COC=O)C1CC1,0.2856
COCC1(CC1)C(=O)N,0.2737
C(#N)C(C#N)(C#N)C#N,0.3249
c1c2c(c[nH]1)NC=NC2,0.2147
Cc1cn[nH]c1C#C,0.2105
CC1OC2CC(O1)C=C2,0.2453
CC12NCC1C2(O)C#N,0.2612
CC12NC1CCC2C#C,0.2902
OC1CCN2C(C#C)C12,0.2599
C1CC1(CCOC=O)O,0.2662
COC1(C)CC1NC=O,0.2694
COC(C#CC)C1CO1,0.2868
CC(C)(C)COCC#N,0.2921
CC12CC1C(C)(O)C2,0.3197
CC12COC(CO1)OC2,0.3312
OC12CC1NC(=O)C2,0.2657
C#CC12CC1N1CC21,0.246
OC12C3COC1COC23,0.3035
COC(C#C)C1CCO1,0.2773
COC1(COC1)CC#N,0.2861
c1c(c(c[nH]1)N)CC#N,0.221
CC1C2CC1(C)N2C=O,0.2477
CC1=CCCCCC1=O,0.1949
CC(=O)CCN=COC,0.23
CC1=C(C(=O)CC1)C#N,0.1871
C1CC1C2CC(=O)C2,0.2215
CC12CC(C1)COCO2,0.3279
CC1=CNC(=O)C1,0.2096
CN1C2CC3(COC3)C12,0.3059
CC12CC3C1C3(C2)C#C,0.2736
C#CC(=O)NCC1CC1,0.2313
N#CC1CC2CN2C=N1,0.2462
C#CC1N2CCC12C#C,0.2402
CC1(O)C(OC1=O)C#C,0.2601
[O-]C1=CC=NC=CC1=[NH2+],0.1604
CCc1cccnc1C,0.2275
COC1(CNC1C)C#N,0.2586
CC1C2C3N2CCC13O,0.2965
OC12CC1COC=NC2,0.2554
CC12COC1C(O)CO2,0.2946
CC1OC2(C)CCCC12,0.319
OC1CC2(C1)CC(=O)N2,0.285
c1cnccc1C#N,0.2032
OCCC12CC(C1)C2=O,0.2506
CC1=CC2NC2(C)C1O,0.2378
CCn1cncc1C,0.2455
CC12CC(O1)C(O)C2,0.3246
N#CC12CC1C1(CN1)C2,0.2718
COC1(C)CC(C)C1=O,0.1979
C1C=Cc2c([nH]nn2)O1,0.1874
N#CC1NCC1C1CO1,0.2616
c1n[nH]c(=O)n1C(=N)N,0.2293
OC1C2OC2C=C1C#C,0.1948
CC1(CC(=O)C1)NC=O,0.2214
C[NH2+]CC1=C([O-])ON=N1,0.2154
CCN=c1ccocn1,0.2
COc1c(c(n[nH]1)N)O,0.2484
C#CC1OC2C3NC3C12,0.2528
CCCC(C)(CO)OC,0.3081
C#CCC1(CN1)CC#C,0.282
CN1CCNC(=O)C1=O,0.2104
C1CC23CC4CC2C4C13,0.3375
CC1(O)CCCC(=O)C1,0.226
CC1CC(C1)C1CC1,0.3511
Cc1n[nH]c2n1ccn2,0.2124
CCC(=O)C(=O)C1CN1,0.1573
OC(C#N)C#CC1CC1,0.252
Cc1cc(on1)CC#C,0.2473
CC#CC1CC1C(C)=O,0.2184
COC1C(=O)NC1(C)C,0.255
CC1=CC(=NN1)C1CN1,0.2329
COc1connc1=O,0.162
CC(CC=O)(C#N)C#N,0.223
OCCC1C2CC1O2,0.3097
COC12C3NC1C=CC23,0.2284
Cn1c(=O)c(cnn1)N,0.1753
NC(C#C)C(N)C(N)=O,0.2553
CC#CC1(C)CC2CC12,0.2959
CC(O)C(=O)C1CC1C,0.2338
CC(O)C(C)([NH3+])C([O-])=O,0.2587
CC1C2(O)CC1(O)C2=O,0.2343
CCC(OC=NC)C#C,0.2717
CC(O)(C#N)C(O)CO,0.2966
CCC1COC11COC1,0.3149
CC1C2CCC22CCC12,0.336
OCC1(CC#N)CN1,0.2838
CC1CC2(CC2C#N)C1,0.3047
C#Cc1cnccn1,0.191
CC1(C)CC1C#CC#C,0.2155
C1C2OC3OC=NC3C12,0.2727
OC12CCOC1CC=C2,0.246
C1CC1C#CC2CC2,0.2757
CC1CC2(C1)OCC2=O,0.2211
O=CC1C2C3CN3C12,0.1972
O=C1CC2C3C4C(C13)N24,0.21
CC1C=C(C#C)C2CN12,0.1937
CC1C2COC1C1CC21,0.3317
CCCC1C2COC12C,0.3078
OC1CC2(C1)CCCO2,0.3115
CCC1(C)CO1,0.3465
CC(C)C1C2CC(=O)C12,0.2297
C1CC2C=CC=CCC12,0.1961
CCC1CC1C(C)C,0.3504
COCC12CCC1C2O,0.3199
C#CC(C#N)C1CCO1,0.2737
N#CCNC12CC1OC2,0.2552
CN1CCNC(=N)C1=O,0.206
N#CC12OC3C1C=CC23,0.2187
CN1CCC(C#N)C1=O,0.2585
CC(C)C#CC#N,0.247
c1c(=O)cc(oc1O)O,0.2116
C1CCC(CC1)C2CC2,0.3559
OC12CN3CC1(C#C)C23,0.2551
N=C1N2CC2COC1=O,0.2072
CN=C(N)C(O)C(N)=O,0.2462
CC1C2C(CO)C(=O)N12,0.2284
CC(C(N)=[NH2+])C([O-])=O,0.2315
CC12CC3C1C1CC2N31,0.3046
CC12OC3(C)C1C=CC23,0.2214
NC1CN2C1=NNC2=O,0.2323
CCC1CC1(C#N)C#N,0.288
CCC([NH+]=CN)C([O-])=O,0.2574
O=CC12CC(=O)C1CN2,0.1998
[NH3+]CC#C[C-](C#N)C#N,0.1513
CC1C2OC2C2C(O)C12,0.2978
CC1COCC1(O)C=O,0.2212
CC1(OC1C=O)C(N)=O,0.2001
c1c(c(ncn1)O)F,0.224
CC12CC3C=CC1N23,0.2136
CC1C2CC2NC1=O,0.2633
c1c2c(c([nH]1)N)OCO2,0.2362
CCC(CC)OCC,0.3245
Cn1cc(cc1C#C)N,0.1815
CC12CC1N(CC=O)C2,0.1974
C#CC12CC3(CC3)C1N2,0.2719
CCC12CC1(C)C(=N)O2,0.2783
OCC1CC2(CO)CC12,0.311
c1c(cn[nH]1)C2CCC2,0.2554
CC1COC(C)C1,0.3219
OC12CC1COCC2,0.3256
COC1C(C)C1C=O,0.222
C1OC2CC1OCC2,0.3236
c1cc(oc1)CC#N,0.2345
CCC(=O)C(C=O)C#C,0.2129
CCC(=O)C1COCO1,0.2219
CCNc1[nH]nc(n1)O,0.2491
OC1COC2=C1OC=N2,0.2076
CC1C2CC3OC2C13,0.3263
O1N=NC2=CC=NC2=N1,0.1512
C1C2CC3(C12)C1COC31,0.2961
CN(CC#N)C=O,0.2699
CCC12C3OC1C1C3N21,0.3053
C1CC2(CCOC2)O1,0.3187
O=C1CCC=CC2CC12,0.2221
Cc1c(oc(=O)cn1)N,0.1514
CC(C)C1CC(C)O1,0.3231
CC1CC(=N)OC(=O)O1,0.2737
CC12CC1CC(=O)CC2,0.2231
ON=C1C2C3C4C3N2C14,0.2277
CC(N)C(C#N)N1CC1,0.2748
O=C1CN2CC(C2)O1,0.2328
CC1(O)C2NC2C11CN1,0.2892
O=C1CC2(CC3CC23)N1,0.282
CC1C(C=O)C(O)C1=O,0.2152
CCC(O)C(=O)OC=N,0.2412
CC1C2C3C4C3C1(C)C24,0.3273
O=C1C2CCC1N=CO2,0.1968
CCC(C(N)=[NH2+])C([O-])=O,0.2311
c1c(oc(=O)[nH]1)O,0.2489
CC1CC(C)(O)C1=O,0.2179
CC1(CO)CCC(=N)O1,0.2831
OC1C=CC23CC12CC3,0.2252
CN1CC1C1OC1C#C,0.2364
CCN1CCOC1=O,0.302
CC1CC=C2COC2C1,0.252
CCOCC(=O)CC=O,0.2018
COC12CC1C1COC21,0.3024
O=C1CCC2OCC12,0.2167
CN1N=C(O)C=CC1=N,0.1425
CCC(CC)(C=O)OC,0.2102
CCCc1cnnnn1,0.1657
C1C2OCC3CCC12O3,0.3054
CCOc1c(nco1)N,0.2056
C#Cc1ccc(cn1)N,0.182
CC1(CC(=O)C1)CCO,0.2221
CCC(C)(OC=N)C#N,0.2832
NC(=O)C1OC2CC12,0.2551
c1nncnn1,0.1355
OC12CC(C1)CNC2=O,0.276
NC(=O)CCC(O)C#C,0.2779
CC(C)C#CC(=O)C,0.2077
CC12C3CC1CCC23O,0.314
CC(CO)OC(=N)C#N,0.2226
c1c(ncnc1N)N,0.2255
O=CC12CC3C(C1)N3C2,0.219
OCCCN1CC1CO,0.2894
OCC1CC1(O)C1CC1,0.3074
CC1C2CC1C(=O)C2=O,0.154
C1CC(C1)CCC#N,0.3412
C1CC2=CC=CCOC12,0.1861
Cc1cnc(nc1N)F,0.2153
O=C1C=CC2CC12C#C,0.1817
OC12CCC1CC(=O)C2,0.2216
CC12CC1COC2=O,0.2744
c1cn2cc(oc2n1)N,0.2277
OC1C2CN2C1=O,0.2216
CC1CC2N1CC21CO1,0.2864
OC1=C(O)N=CC(=N)N1,0.1332
CC1=CC(N)=NC(=N)O1,0.1795
CC12CN1CCCC2O,0.2851
O=CC1OC11CC2NC12,0.2058
CC1CC(C)C2C(O)C12,0.2935
CC1CN1C(=O)NC=O,0.2327
CC1(O)C2C1C1CC2O1,0.2988
c1cc(oc1)CCCO,0.2357
O=CN1CC1CC1CC1,0.2528
O=C(C1CN1)C1CN1,0.2227
COC(C)(C=O)C1CN1,0.2083
CC1OC2CC(C#C)C12,0.2801
CC1(C)CC2NC12,0.3129
CCn1c(c[nH]c1=O)N,0.2326
N#CC12CCC=CC1N2,0.2308
CC1NC(C#N)C1(C)N,0.2647
CCC12CC3C1CCC23,0.3612
CC(O)CN(C)CC=O,0.2091
N=C1OC(OC1=N)C#C,0.2355
C#CCC1C2CC1OC2,0.2898
CN1C2C(O)C2CC1=O,0.2588
CC(C)(O)C1(CN1)C=O,0.223
CC1CC2(CCO)CN12,0.3028
CCC1C2CC1(O)CO2,0.2967
O=C1CC2=CCC3C2N13,0.2049
CC1OCOC1C1CO1,0.3306
CCC(C1C[NH2+]1)C([O-])=O,0.2756
Cc1cnn(c1)C2CC2,0.247
C#CC1C2CN1C2C#N,0.2487
N#CC1CNCC2NC12,0.2722
C1C2C3NC3CN12,0.2925
CC(C)(C(=O)C=O)OC,0.1593
CC1=C(C#N)C2OC2C1,0.2074
CC12OC1C1C(O)C21C,0.283
CC1(CC[NH2+]C1)C([O-])=O,0.2781
O=CN1C2CC1C=CC2,0.2337
Cc1ccc(n1C=O)C,0.1789
CC(C)(C)c1ccon1,0.2558
CC1C2C=CC3CN2C13,0.2219
CCC1C2OC2C11CC1,0.3302
OCCN1C2COCC12,0.3174
OCC1=NC=NNC1=N,0.1613
OC1C2CC2CC2NC12,0.3061
CC(C)CC(O)CC=O,0.2226
CC12OCC1CC2C#N,0.2839
CC(=O)C1CC2(C)CC12,0.2206
OCC1C2CC1(O)C=C2,0.2378
COCC(=O)C1CN1,0.2331
C1C2CN3N=CC=C3C12,0.2489
c1c(c(c[nH]1)O)N2CC2,0.2268
NC1=CNC=C1C1CN1,0.226
c1(=O)[nH]c(n[nH]1)O,0.2616
O=C1CN2CC3NC3C12,0.2089
O=C1N=CON=NC1=O,0.2382
CC1(CCC12COC2)C,0.3058
O=C1CC2NC(=O)CC12,0.2157
CC(CO)C1CC1C=O,0.2277
c1nc2c(o1)CNC2,0.2214
CC1C=CN2N=CN=C12,0.2072
Cn1c(cc(n1)C#C)O,0.2177
ON=C1C2OC2C1C#N,0.2446
CC1OCCC1OC=O,0.2566
CCOC1(C)COC1=O,0.2531
CC12CC1(C)C=CCC2,0.2435
CC1CC(C1)C(C)(C)C,0.351
COC12CC1(C)CCC2,0.3289
FC1=CC(F)=CC(=N)O1,0.1785
NC1=NC23CC2(CC3)O1,0.2547
CC1C2C1C1(C)CC2O1,0.3404
CCC1C2CC(C)C12O,0.3164
CC1C2COC(C2)C1C,0.3103
C,0.5048
CNc1nnon1,0.1925
c1c[nH]ncc1=NO,0.1575
CCCc1c(cn[nH]1)O,0.2306
CC12C3CC1C1C3N21,0.3116
CC#CC1(CN1)C(C)O,0.2665
CC(=O)CCNC(=O)C,0.2305
C(C1CO1)C1=NNC=C1,0.2665
CC1C2CNC1C(=O)O2,0.2448
CCCC#CC(C)(C)O,0.2938
CC(O)C(O)(CN)C#N,0.2624
CCCC1CCOCO1,0.3492
OC(C#C)C#CC=O,0.2034
CC1=CCC2OCC=C12,0.197
O=CC1OC1C(=O)C#C,0.1736
CN1C2CC3CC1C2O3,0.289
O=CC1CCCNC1=O,0.2205
C1CN1CCCC#N,0.282
CC1=CC(=N)OC(F)=C1,0.1741
COC(=NCC#N)N,0.2765
CCCC12COC1CO2,0.3009
OC1C=CCOCC=C1,0.2168
CC1CCC1(C)C(C)=O,0.228
CCC1CCCC(C)O1,0.3284
C#CC1C2C3C1CN23,0.2834
CCC(=NO)C(=O)NC,0.2094
C1CC2CC=CC(C2)O1,0.2534
NC1C(C#N)C1(O)C#N,0.2431
CC12CCC(O1)C21CO1,0.3374
CCC1(C)CN1CC#N,0.2726
C1CC(=O)CC(=C1)C=O,0.1834
C1C2C1N1C3CC1C23,0.3216
O=CCC(=O)CC1CN1,0.2136
CC12CC1N1CC21CO,0.2877
O=CC12OC1CC2C#C,0.2131
CCOCC(O)C=O,0.2246
CN1CC1C12CC1CO2,0.2934
CCOC1CC2(C)OC12,0.3258
C1C2OC3C2OCOC13,0.3144
CC1C2C=C(C)C1C2=O,0.2411
OCC1CC2(OC12)C=O,0.2199
Cc1ncc(nn1)F,0.1659
COCCC(=N)NC=O,0.2317
CC1C(=O)OCC1(C)O,0.2762
O=CNC1=CC2NC2C1,0.205
C1COCCCOC1,0.3155
CC(=O)Cc1[nH]ccn1,0.1843
CN(C=O)c1cn[nH]n1,0.213
CC1=CCC2(O)CC12O,0.2448
OCCC1C2N1CC2=O,0.219
COC1C(C)C1C#N,0.2885
CN1CC(C1)OC=O,0.2342
CC12C3C4CC(CN13)C24,0.3145
NC1C(COC1=O)C#N,0.2489
C#CCC(=O)CNC=O,0.2177
NC(=O)N1CC(O)C1=O,0.2344
Cc1cc(oc1NC)N,0.2187
COCC(=O)C1COC1,0.2223
CCC(C)C1(CO1)C#N,0.3024
Cc1nc([nH]n1)C#C,0.2142
CC1(O)CN2CCN=C12,0.2354
C1C=CC=CNC(=O)O1,0.1784
CCC1(CC1)NC(=O)N,0.2982
CC1CC(=O)C2CC1O2,0.2098
c1[nH]c(=O)nc(n1)N,0.2116
CC(CC=O)C1CCC1,0.228
OCCC1CCO1,0.3227
CCC1OC(=O)C=C1C,0.2261
CCn1cc(nn1)OC,0.2219
OC1C2C=CC3OC3C12,0.22
CC1=CCC23CC(O2)C13,0.2493
CCC(=O)C(CO)C=O,0.2052
CN(CCO)C(=N)C=O,0.1559
OCC12CC1CCCC2,0.3316
CC1OCOC1C,0.3354
CC1OC(=N)C1(C)C=O,0.2227
CC1(O)CC1(O)C#C,0.2749
CC1C2C3OCC3C12C,0.3006
OC12CN(C1)CC=C2,0.2213
CC1CC(C)C11CC1,0.3459
C(C#N)OC(=O)NC=N,0.2529
CC12NC1CC=CC=C2,0.1853
N=C1OC2C3OC3C12,0.2813
CC(C)c1c(nno1)O,0.2017
CN1C(C#N)C1(C)C=O,0.2091
CCNC(=O)OC=NC,0.2662
CC12CN(C1)CC(=N)O2,0.2495
CC1(C)OC(=O)NC1=N,0.2688
CC1CC2C(C)CC=C12,0.2476
CC1(C)CC2(NC12)C=O,0.2175
OC1CN2CC12CC=O,0.2197
NC1=NCC2(CO2)C1O,0.2558
OC12CC1CC(=N)OC2,0.28
c1c[nH]c(c1N)C(=O)N,0.1786
CCN1C=NC(=N)N=C1,0.1882
Cc1c2c(c[nH]1)CCN2,0.2215
CCC1C2CC(C#N)C12,0.3028
O=C1COCC(O1)C#C,0.2591
C#CC1(CN2CC2)CN1,0.268
OCC12COC1C2C#C,0.2761
C1CC1C12CC(C1)CO2,0.3218
COC1(C)CCC1C#N,0.2954
O=COC1C2CC1CC2,0.2843
N=C(C#N)N1CCC1,0.2071
O=C1CCC2OCOC12,0.2001
N=C1CNCC(=O)N1,0.2209
Cc1cc([nH]n1)C(=O)C,0.2016
O=C1C(C2CN12)N1CC1,0.205
CN1CC1C(CO)C=O,0.2107
CN=C1CC(C)(O1)C=O,0.2106
CC1(CC=O)CCOC1,0.2261
O=CC12CCCCC1O2,0.2193
CC1C2C3C(N13)C2(C)O,0.3002
C1CC1COCCC=O,0.2282
CC1N2C3C2(C)CC13C,0.3125
CC1OC(=O)OC1C,0.3295
CC1C=CC2(C)COC12,0.2588
CC12C3C1C1(O)C2C31C,0.2882
OCCC1COC(=N)C1,0.2868
CC1C2OC11CC(O)C21,0.2717
CCC(C)OC1CC1C,0.3191
CC12OCC1(C=O)C2O,0.2123
CC(NCC(C)=O)C=O,0.2089
CC1(C)CCC(C1)C=O,0.2293
CN1C(CC1=O)C1CO1,0.2798
CC1(O)CC=C(CO)C1,0.2612
CC1(COC1=O)N1CC1,0.2413
C1CC=CC2(C1)CC2,0.2516
C1C=C(CC1=NO)C=O,0.1873
CC1(CCOC=N1)C#C,0.2651
N=C1OCC2(CN12)C#C,0.2671
COC1(C)CN=CO1,0.2791
CNc1cccc(c1)F,0.2041
CN(C)C1C=CCC1=O,0.1909
CCOCC(C)CO,0.3259
CC1CCC=C1C#C,0.2091
CN1CCC12COC2,0.285
CCCC(O)C(C)(C)C,0.3258
CN1C2C3OC4C(C23)C14,0.2777
O=CC1(CC2CC2)CO1,0.22
CCC12OC1CCC=C2,0.2478
N=C1NC2(CC2O1)C#C,0.2416
OCC1OC1C(=O)C#N,0.1874
N=COC1CC=CCO1,0.2673
CNC1CC1(C=O)C#N,0.1836
CC(=O)C1(C)C2CC1O2,0.2187
CC1C2CC1(C#N)C2C,0.3249
O=C1OC2CC12CC#N,0.2751
COC1(C)CC2(O)CC12,0.3209
C#CC(C#C)C(=O)C#C,0.1933
O=CC1(C#N)C2CCC12,0.2166
CCC1(CC=O)CO1,0.223
Cc1c(n[nH]c1N)C#C,0.212
c1c(nc(c(n1)F)O)O,0.1847
O=CN1CC1C1CC1,0.2542
CC1(O)C2CN(C=O)C12,0.2506
CCc1cc(c[nH]1)C#C,0.2169
CC1N2CCC11OCC21,0.2757
OC1=NC(O)=NC(=O)O1,0.2247
CC1CN2CC(C#N)C12,0.2512
COC1C(O)CC1C#N,0.2907
c1c2c([nH]n1)CC=CC2,0.2454
CC#CC1(CC1)C=O,0.2229
CCc1c(c(co1)C)O,0.2227
OC1C2CC1OCC2,0.3051
C(c1c(nno1)N)N,0.1864
COCCC1CC1OC,0.3328
N#CCC1(CN1)C1CN1,0.2662
C1NC11C=CC2COC12,0.2428
N=C1OC2COC12C=O,0.2092
CC1(C=O)C2CC2C1O,0.2229
CC(O)C(O)CCC#N,0.3074
COCCCCC1CO1,0.342
O=CC12NC1C=CC2=O,0.1738
CC1C2OC1C1(C)OC21,0.3099
CN(C)C(=O)C1(CC1)O,0.2534
COCC(=O)CC1CC1,0.2329
C1OC11C2CCC1CC2,0.3313
CC1(CC1)C1C2COC12,0.3107
C1C2C1C1COCC2O1,0.3105
OC1CC2(CC2)OC1=O,0.2734
C#CC12CC1CC21CO1,0.268
OC1C2OCCC(O)C12,0.3165
OCC(O)C1CC=CC1,0.2657
CC1NC1COC(N)=O,0.3097
CC1C2N(C)C(=O)C12O,0.2397
CC1CNC(C)=C1C=O,0.1777
C#CC(=O)CCNC=O,0.1971
CN1CC11CC(C)(O)C1,0.2948
CC12CCC(CO)C1N2,0.3135
CC(=O)C(=O)C(=N)NC,0.1212
OCCOCC(O)C#C,0.2835
CC1CC2OC12,0.3397
CC#CCOC(=O)CN,0.2584
[O-]C(=O)C1CCC2[NH2+]C12,0.2736
CC1=C(C)C(CC1)C=O,0.2014
OC12COC1C2CC=O,0.2237
O=CC1CC1OCC#C,0.2272
CC12CCC1C=CC2,0.2616
C1N2C3C4=CCCC13C24,0.1702
OCC1C2CC2NC1=O,0.2599
CC1CC2CN2C1CO,0.3099
COc1cnoc1C=O,0.1771
CCCC(C#N)C#CC,0.2868
CC1COC(=N)CO1,0.2725
CCC1(CC1)N=COC,0.2493
CC#CCC1(O)CC1C,0.2932
CC1C2(O)CCC12CO,0.3106
Cc1c(nn[nH]1)N=CN,0.2041
ON=C1C2C3COC1C23,0.2438
NC(COC=O)CC#N,0.2789
OCC1NC2COC12,0.2989
OC12C3OC1C1C3OC21,0.2836
O=C1OCCC11CO1,0.2513
CC(C)(C=O)C1COC1,0.223
CC1(O)C2C3CCN2C13,0.3331
CC1C2C3OC2(C)C13C,0.3082
N=C1C=NOC=NC1=O,0.1783
NC1C2C3N2CC13C#N,0.2552
CC1COC(C)C(=O)N1,0.2618
OC1C=CC2COC1O2,0.2452
CC(CO)CC(N)C#N,0.2845
CC(=O)C1(CC1)C(=O)C,0.2211
CC(=O)CC1CC(=O)N1,0.2193
CC#CC1(CN1)C#N,0.2529
C1C(=NO)C(=O)C(=N1)N,0.1457
CC1CCCC(C1)=NO,0.2529
N=C(C#N)N1CC1,0.217
CC1(COC=NC1)C=O,0.2232
CC(=O)Cn1ccnc1,0.1889
O=CN1C2C1C1CC2O1,0.2632
CC(CCC1CC1)C=O,0.2262
C1CC1(C=O)OCC=O,0.2199
CC1NC1C(CO)CO,0.3136
CCC1(CO)OCC=C1,0.2509
C1CC1NC(=O)C(=N)N,0.2143
COC1CC(O)CC1C,0.3169
CC1=CC(C[NH3+])=C([O-])O1,0.2203
C1OC11CC2CCC=C12,0.2327
CN1CCC(=O)C1=O,0.1737
CC1(CCC1)CC#C,0.3104
C1CC12C(=NO)CO2,0.2261
NC(=O)OC(C=O)C#C,0.2235
C1CNc2c1oc(=O)[nH]2,0.2226
OC12CCC1N(C2)C=O,0.2632
NC(=O)CC1OCC1=O,0.1992
OC1(C=O)C2CC1O2,0.2044
CNc1conc1O,0.2144
CCOC1CC1OC=N,0.2699
COC(=O)C(O)CO,0.2556
CC1=CC2CC=CC1O2,0.2324
COC1CC2(CO2)C1C,0.3185
CC1C2=CCN3C2C13C,0.1666
O=C1C2(CO2)CC11CO1,0.1852
c1ccc2c(c1)con2,0.1611
C(CC(C#N)C#N)C=O,0.225
c1nc([nH]n1)CCO,0.2658
c1c(=O)nc(on1)C#N,0.1761
N=C1C=CC=CN1C=O,0.1469
O=CNC1CC(C1)C#C,0.2771
CC#CC1(CN1)C#CC,0.2499
CC12CCCC1=CCC2,0.2507
OCC1CCNC1=O,0.2737
CC(OC(=N)C#N)C#N,0.243
CCNc1cnc(o1)O,0.2286
CCC(C)(CO)C#N,0.3136
CCCC12OC1CC=C2,0.2475
C#CCC1CCC1C#N,0.2892
CC#CC1OCC1C=O,0.2156
CC1=C(NC(=O)C1)C,0.2098
[O-]C(=O)CCNC=[NH2+],0.0766
NC1=CC(=N)C(F)=NN1,0.1775
CC(C)C1(CCC1)C=O,0.2248
CC1C(O)C11CC(=O)C1,0.222
C1C2C3OCCC3N12,0.3071
ON=C1CCCC1C=O,0.2208
C1N2C3C4C=CC13C24,0.2205
N=COC1C2CCC1O2,0.2793
OC12CC1OCC2=O,0.2075
Cn1cc2c(c1)OCO2,0.2276
CN=C1OC2CC12C=O,0.2159
C1C=CC2=CC3OC3C12,0.1899
O=CNC1C2CC1OC2,0.2616
CNc1[nH]c(=O)ncn1,0.2112
O=C1CC(=O)C2CC12,0.2141
CC12C3CC1(O)C(=O)N23,0.2491
COCC(CC#N)C#N,0.2985
N=C1CC(CCC#C)O1,0.2885
CC#Cc1cn[nH]c1N,0.2203
CC#CC1C2OC1C2=O,0.2317
CCN=CNC=O,0.234
CC1C2C3CC(=O)C2N13,0.2177
CCc1cocc1CC,0.2398
C1CC=CC(=O)C1,0.1885
C1CC1C1CCC11CC1,0.3396
CC1C2CC1(CC2)C=O,0.2215
CC1CC2C(CC#N)N12,0.2747
CNc1cnno1,0.2097
C1CC2OC1CCC=C2,0.257
CN(C)C1COC1=N,0.2394
CNc1cc([nH]n1)OC,0.2364
Cc1c(n[nH]c1O)C=O,0.1853
CC#CC1CC11CCO1,0.2683
O=C1NC2CCCC2O1,0.313
N#CC1OCC1C1CO1,0.2766
CC1CCC(O)C1=NO,0.2455
c1cnc([nH]1)COC=O,0.2281
CC1(O)CC2C(O)C12,0.3078
CCC12CC1OCC2C,0.2999
OC1C2CCC12N1CC1,0.2874
CC1CC11CC(=O)C1O,0.2156
N#CCC1COCO1,0.3053
COC1C2NCC12C#N,0.2466
CC1CC(C)(O)CCO1,0.3191
CN=C1C=NOC(O)=C1,0.1621
[O-]C(=O)C1=NNC(=[NH2+])N1,0.207
OC1(CC2CN2C1)C#C,0.262
NC1C2OC2C1(O)C#N,0.2438
ON=C(C1CN1)C1CN1,0.2237
CC1(O)CCC1CC#N,0.3066
CN1CCc2c1non2,0.198
COCC1CC1C1CC1,0.3323
C1C2CC3=C(N=CN3)N12,0.225
NC1=NCC(O)C1=NO,0.1823
COC(C)(CC#C)C=O,0.2089
COC1CC23CC(C2)C13,0.2997
C1C2C3OCC3CN12,0.291
CC1=CCCC=C(C1)C,0.2483
CC12OC1CCCC=C2,0.255
CC1(C)OCC1CC#C,0.2935
CC12CC=CCCC1O2,0.2674
CC(O)C1OCC2CC12,0.3228
OC1CNC(=O)N2CC12,0.2829
CC(C)CC(O)C#N,0.312
CCC1=CN(CC1)C=O,0.2056
C#CCC1COC=N1,0.2671
CC(=O)C(=O)NCCO,0.1793
CCC(C)C1(CO1)C#C,0.2872
Cc1cc(nc(n1)C)O,0.2278
CC1OC(=O)C(C)C1O,0.278
N=C1OCC2C3NC1C23,0.2512
ON=C1C(O)C2OCC12,0.2319
OC12CC1C=CCOC2,0.2452
CC(C)OC(C)C,0.3224
CC1(O)C2C3CC1C23,0.3205
O=C1C2CC(N2)C11CN1,0.2019
C1CC23OC2(C1)C1NC31,0.3185
c1c[nH]cc(c1=O)CO,0.2044
CC#CCCCOC,0.3044
CCCC#CC(C)CO,0.3009
CC1CCC=CC(C)O1,0.2527
CC(O)(C#N)C1CC1O,0.3156
CN1C=NC(C=O)C1=O,0.2099
C1CC(=NO)C=C1N,0.1898
OC12CN(CC1)C2C#N,0.2541
CCC(C)CC1(O)CC1,0.3028
CC1OC(=N)CC11CC1,0.2857
OCC(C#C)C(F)(F)F,0.3064
O=C1NCC2C(C#N)N12,0.2597
c1nncn1CC2CC2,0.2656
c1cn2c(coc2n1)O,0.2302
OC12CC1C1COC2O1,0.3237
OC1CC1C1=CNC=N1,0.2308
CC1N(C)C11CCC1=O,0.1984
CC(=O)C1CCC11CC1,0.2263
CC1=CN=COC1=N,0.1818
CC1(C)CC1(C)O,0.3194
O=CC1CCCCC=C1,0.2215
CC1CCN2C(C=O)C12,0.2021
CC1C2C1C1COCC21,0.3172
CC(CCO)OCC=O,0.2281
NC(=O)C12CC1OCC2,0.2648
CCn1c(=O)n(cn1)C,0.2294
CC1(C2COC12)C(N)=O,0.2625
C(C#N)NC(C=O)C=O,0.1954
O=C(C#C)C1C2COC12,0.1863
CCC#CCC(C)C#C,0.2884
CC1(C2C[NH+]1C2)C([O-])=O,0.2153
CC1C2CC2C(=O)C1C,0.2228
CN=C1OC(CO)C1C,0.2765
C#CCN=C1NCCO1,0.2732
CC#Cc1ncon1,0.2176
C1CC2(C1)CC23COC3,0.3101
N#CCC12CC(O1)C=C2,0.2357
CC1(CC#CC#C)CO1,0.2293
C1CCN=C(C(=O)C1)N,0.1768
Cn1cnc(n1)NC=N,0.2189
CCOc1cc([nH]c1)C,0.2333
C#CC12CC(N1)C2C#N,0.2613
CC1CC2C(O)C(=O)C12,0.2074
CN=CNC(C#N)C#N,0.2415
C1c2c(onn2)N=CN1,0.1772
CC(C=O)C1CC1CO,0.2052
CCC1C2OC(=O)OC12,0.3196
OCC1OCC2OC12,0.3368
CCOC(=O)NCC=O,0.2196
CC([NH3+])(CCO)C([O-])=O,0.2661
C#CC1(C#C)C2CCC12,0.2637
CC1(CN1)C1NC1C#C,0.2692
CC(OC=O)C(C)=O,0.229
CC(O)CCC1OC1C,0.3287
COCc1cnc[nH]1,0.2482
N#CC1CC2(CN2)C=C1,0.2405
C#CC1C2OC2C11CO1,0.2839
COCC1(CN1)C(C)O,0.3248
CN=COC(CN)C#N,0.2451
OC1CC2OCC(O)C12,0.287
CCC1(C)NC1COC,0.3172
CC1=C(F)C(=N)N=CN1,0.1947
N#CC1C2CC3CN1C23,0.2358
CC1C2(C)CC1(C)C2O,0.315
CC1C2COC12C(C)=O,0.2165
[NH3+]CC(=O)NCC([O-])=O,0.2436
OCC12C3OC1COC23,0.2817
O=C1NC=C(N1)C1CN1,0.223
c1cc(c(nc1)C#N)N,0.1748
COC1C2CC3C2C13O,0.3246
CC1(C)C2CC1OCO2,0.3242
CCCC1N=CNC1=O,0.2292
OCC12CCC1CO2,0.3045
CN=C1CC(O1)C(C)O,0.281
O=CCC(C#C)C1CN1,0.2178
CC12CCC(O1)C21CN1,0.3133
CCn1c(cc(n1)O)C,0.2375
CC#CC(=O)OCCO,0.233
COCC(CO)CCO,0.3246
CC1(O)C(=O)C=CC1=O,0.1515
Cc1c(cco1)NC=O,0.2101
CC1C(O)C1C#CC#N,0.2189
[NH3+]CC1=NOC(=N)[N-]1,0.2047
CC(O)CC1CN2CC12,0.2913
O=CCC12CC1OCO2,0.2109
OC1C2CCC22CCC12,0.3172
CCC1(O)C2C3CN2C13,0.3154
c1c(n(cn1)C=O)C#N,0.1874
O=CC1NC1(C#C)C#N,0.2091
C(CO)c1n[nH]nn1,0.2418
C1CC2(C1)CCC(=O)C2,0.2212
OC12CC3C1C2NC3=O,0.2533
CC1C(O)CC(O)C1=O,0.2214
O=C1OCC(O1)C#N,0.294
O=CC12CN1CCC2=O,0.2069
Cc1c(=O)occ(n1)O,0.1521
CCN1CC1(C)C(N)=O,0.2588
Cc1ncc(o1)C#N,0.2084
CC(CO)C(C)CCO,0.3399
CC1(CC11COC1)C#C,0.2868
CC(O)C(O)CO,0.3214
CC1(C)OCCC11CO1,0.3283
C#CC12CC(C1)(N2)C#C,0.2578
CCC1=NCC(C)CO1,0.2688
CC1=C(N=NO1)C1CO1,0.2202
C1CC2=C(C1)C(=O)OC2,0.2277
CN=C1OCOCC1O,0.2752
CC1(O)C2CC(=N)OC12,0.2639
O=C1OCC2CN=CN12,0.2501
CC1(N)CC2NC12C#N,0.2595
CC1COCC2CC12C,0.3222
CN(C=O)c1ccon1,0.2173
C#CC1N2C3CC=C1C23,0.1711
[O-]C(=O)C1NC(=[NH2+])C=C1,0.23
CC1C=CCCC1C#N,0.2637
CC1(CO1)C1=CON=N1,0.2241
C1OC2(CC=CC2)C=C1,0.2452
N=CNC1=NOC(=N)O1,0.2174
N=C1OCC2CCC1N2,0.2717
CC1C2CC2(C#C)C1C,0.2711
CC1OC11CC=CC1,0.2678
CN1CC2COC(C1)O2,0.2983
OC(C#N)C1CC(=O)C1,0.2218
CC1C2C3(C)CC2(C)C13,0.3674
C(c1nnon1)C(=O)N,0.1792
COC1CC2CC2C=C1,0.2506
CC#CC1CC(C)O1,0.2738
CC(CC#N)NC=O,0.2805
C(CO)N(C=N)C(=O)N,0.247
C(C1CC1)C1OCC=C1,0.2465
C1C2C3C1C1=CCN2C31,0.1629
CC12CC3CN1C3C2=O,0.2214
COC1=NC2C(N)C2N1,0.2571
C1NC11C2CC3C2OC13,0.295
CC1(CCC1C#C)C=O,0.2201
CNCC(F)(F)F,0.3162
CC(C)C1CC2OCC12,0.3098
CC1(CO1)C12CC(C1)O2,0.325
COCC1(C)OC1CO,0.3331
CC1C(C)C1(C)C#N,0.3118
NC(C#N)C1COC=N1,0.2684
OC1C2C1C(=O)C2O,0.223
C1CC2C3OC3C2CO1,0.317
C1C2CC1OCCOC2,0.3033
COC1(C)COCCO1,0.3281
O=C1CC2CCC(C1)O2,0.2236
O=C1CCC2=C1N=NO2,0.1692
CCC#CC1COC=N1,0.2674
NC(C#N)C(O)CO,0.2884
OC1=CNC(=O)C(=N)N1,0.1686
Cn1cc(c(c1)O)O,0.2319
CCN1C2C1C(=O)C2C,0.2053
[O-]C(=O)C1CC2C[NH2+]C12,0.2652
CC12CC1COCOC2,0.3362
OCC(O)(C=O)C1CN1,0.2025
Cc1cnc(o1)NC=O,0.2051
O=C1CN2C(C#C)C12,0.216
CC1C(CC11CO1)C#N,0.3023
CN=C1C=COC(C)=N1,0.2011
CCC1C2CC1(O)C2O,0.3064
O=CC#CC1CCCO1,0.2041
O=CNCC1CC=CC1,0.2652
CCC1NC2(CC2)C1=O,0.2097
OC1C2CC3C1(O)C23O,0.2926
CN1C2CCOC(=N)C12,0.2409
CC12CCC1C1CC2C1,0.3562
Cc1ccn(c1NC)C,0.2325
C1C2OC22COCCC12,0.3273
C1CN1C2(CNC2)C#N,0.2582
OC1CC11OCC2NC12,0.2955
CC1(C)CC(CO)CO1,0.3103
CCC1NC1(C)C(C)=O,0.2279
c1(nc(no1)N)C(=O)N,0.1935
O=C1CC=CC(N1)C#C,0.245
CC1C2CC=CC(=O)C12,0.1877
CC12OC(C=C1)C2=NO,0.2228
CN=C(N)N(C=N)C=O,0.2041
CCC(OC=NC)C=O,0.2099
CC1=C(NC(=O)NC1)C,0.2224
CCn1cnn(c1=O)C,0.2322
CC(=O)c1nc(no1)O,0.1904
O=C1C2CC11CCN1C2,0.1954
CN1C(C#N)C2CC12C,0.2431
CC1OC2(CC1C2)C#N,0.2776
CC(C)(C#N)OCC#C,0.2795
OC12CN3C(C1)C(=O)C23,0.2228
CCc1c[nH]c(c1C)O,0.2325
CC1CC2=NNN=C2O1,0.2204
CC1C=CC2(CN2)C1=O,0.2067
C#CCC1C=CC2NC12,0.2448
OC1CC(=O)C1O,0.2084
CCN(CCOC)C=O,0.2704
OC1C2C(N2C=O)C1=O,0.2148
O=CNCC1OCC=C1,0.2437
c1nn(c(=O)o1)CC=O,0.2091
NC(C#N)C12CN1CC2,0.2667
C1CC1N1C2C3OC2C13,0.2909
N#CC12CC(N1)C1CC21,0.2633
N#CC1CC=CC1,0.2663
CNC(=O)C1CC(=O)N1,0.2625
CC1CCC1(C)C,0.3577
CCN1C(C)C1C,0.2906
CNc1cnn(c1)C=O,0.1679
N=C1OCC11C2CCC12,0.2806
CC1(CO1)C1CCC1,0.3473
OC1CC[NH2+]C1C([O-])=O,0.2634
c1c([nH]nc1O)NC=O,0.2068
OCC12CN1CCCC2,0.2925
CCC1(COC1=N)C=O,0.2199
CC1C2C3C(O)C3C12O,0.2722
CC12CC3C1C2C3O,0.3225
CC#CCC1CC(=N)O1,0.2779
CC12OC(=O)C3C1OC23,0.2426
N#CCCC1CN1,0.2918
CCC(=NO)CN1CC1,0.2198
CN1CC1CC1CC1,0.3061
OC1COC2CC1C2=O,0.1995
CN=C1OCC1(N)C#N,0.2616
NC1(CCOC1=O)C#C,0.2405
CC1(CC1)CC#CCO,0.2784
C1COCCC12CCO2,0.3154
C1CN1CCCNC=O,0.2693
CC(C)c1c[nH]cc1O,0.2379
CC(CC(O)C#C)=NO,0.2482
[NH3+]C1C2OC2C1C([O-])=O,0.2751
c1cnccc1O,0.2417
CCC(O)C1OC1(C)C,0.3225
CC1=C2CCC2NC1=O,0.2174
OC1(CC#N)C2CC1N2,0.2681
CC#Cc1c(n[nH]n1)O,0.2038
COCCC#C,0.3131
CC1C2CN2C(C)C1O,0.2808
CCCCC(C)(C)C=O,0.2281
Cn1cc2c(c1)NCC2,0.2153
CC12CC1C1COC1C2,0.3232
CC12C(O)C3C(C1O)N23,0.302
N=C1OCCCOC1=O,0.2238
[O-]C(=O)CC1[NH2+]CC=C1,0.2423
CC(C)(C=O)O,0.2265
C1CC11CC2CC3C1N23,0.3144
CCn1c(cc(n1)C)O,0.256
CC(C#C)(C#N)C(N)=O,0.2631
O=C1OCOCC2CC12,0.2594
OC1COC(C=O)C1=O,0.1946
CC#Cc1cc[nH]n1,0.2222
C1C2OC2C11COCO1,0.3276
COc1nc(c(o1)O)N,0.2218
CCC1NC11CC2NC12,0.303
CC12NC1CC2(O)C=O,0.2128
CC1(C(N1C)(C)C)C,0.2893
N=C1OC(=O)NC=C1,0.1997
C1COC(OC1)CC=O,0.2273
CC1C2CC3N2CC13C,0.301
CN(C)CC#CC#N,0.1928
c1c(=O)nc2n(n1)CC2,0.1807
CC12CCC3(O)C1OC23,0.3104
CC(C)C1OC2CC1C2,0.3239
ON=C1C2CC3CC1C23,0.2463
CC1C=C(C)C2CC12C,0.2449
OC1C2C3C2C2OC3C12,0.3045
c1cnc(=O)oc1C=O,0.1583
CC(C)C(C)(O)CC#C,0.3013
CC1CC(O)(CO)C=C1,0.2545
O=C1OC2OCC3C2C13,0.2662
C(CCC#N)CCC#N,0.3454
COc1c(cc(o1)N)N,0.2143
O=CC12CC(C1)CCC2,0.2232
ON=C1CC2CCC1C2,0.2539
CC12CC3OC(C1)C23C,0.3082
CC1C(=O)C2NCC12O,0.2006
CC12CC1C(O)C21CN1,0.2994
c1coc(n1)N(=O)=O,0.1853
COCCC(=O)C1CN1,0.2312
CC1(O)CC=CC2OC12,0.2419
CC(=O)C(O)C1COC1,0.2175
CC#CC1CC(C1)C#N,0.2767
CC12CCCC1C=CC2,0.2665
C1C2N1C1C3N4CC23C14,0.3064
CN=C1NC(=N)OC1C,0.2455
CN1C2C=CC3(CC3)C12,0.2278
C#CC1C2C3CC2N13,0.2635
CC12C3CC1(O)C1C3N21,0.2915
CC(=NO)C#CC(=O)C,0.1766
O=C1CC2CC3NC3C12,0.218
COC(=O)NC1CC1,0.3068
CC(C)N(C=O)C(=N)C,0.2352
CC(C#N)N(C)CC#C,0.2481
CC(O)C1NC1C(C)O,0.3126
CC#CCC1(C)CC1O,0.3022
CN1CC(O)C11CC1,0.2921
O=CC12CC1CC2,0.2263
CC12C3CC1C(=O)C2C3,0.2189
CC1CC2OC2C(C)O1,0.3351
CCCCC(=O)NCC,0.2775
CC1N=COC1C1CN1,0.263
OC1C2(O)CCC12C#N,0.2616
NC1C2NCC2OC1=N,0.2575
CC12COCC(N1)C2=O,0.2223
CN1C2C3CC3(O)C12,0.2996
CC(CC(C)C=O)C=O,0.2242
CCC(C#C)C(O)C#C,0.2834
OC1CCC(O)C=C1,0.259
O=COC1CNC1=O,0.2597
CC(=O)C1(CC1)CCO,0.2313
O=C1OC2C1CNC2=O,0.2492
CC#CCC(=O)NC=O,0.2183
OC1C(O)C2(O)CNC12,0.2898
COC12CN3C1C(=O)C23,0.2366
CNc1c[nH]cc1O,0.23
C1C2OC1C1CCC2O1,0.3032
CCC1NCC(O)C1=O,0.199
CC12CC3CC(=O)N1C23,0.2381
COC(C=O)C1(C)CO1,0.2162
N#CC1=CCCC2NC12,0.2142
COC1CC1C1CN1C,0.2933
CC1CCN(CC#N)C1,0.2571
C1C(=NO)C=CC(=O)O1,0.1762
CC1=NC=C(O1)C1CO1,0.2259
CN1C=CC(=O)NC1=N,0.1942
CC1NC(C)(C#N)C1N,0.2687
CC1C(O)CC1C#C,0.3018
CNC(=O)CC(=O)N,0.2523
CCCC(O)C(C)C,0.328
CN1C(COC1=O)C=O,0.2071
OC(CCC=O)C#C,0.2291
c1c(con1)C2CC2,0.2412
CN1CC(O)C1CC#C,0.2747
CCc1cnoc1,0.246
N#CC1=CC2OCC2C1,0.208
CC1C2OC11CCCC21,0.3065
CC1CC2C=CC1C2=O,0.2376
CCC1(CO1)C1OC1C,0.3429
N=C1C=CN(C=O)C=N1,0.1742
N=C1ON=C(N=C1)C#N,0.1606
C1c2c(onn2)OC=N1,0.2012
CCC1(CNC=N1)C#N,0.2464
CC1COC1(C)CO,0.3202
Cn1ccc(=NO)cn1,0.1539
OCC12NC1CC21CO1,0.2849
CNC(=O)C(O)CO,0.275
NC1=NC2COC2C1O,0.2542
CN1CC(O)C1CC=O,0.2069
CC1=C(OC(=N)N1)C#N,0.1806
CCC1OCC2(C)NC12,0.3081
C#CC1=CCC2CC1C2,0.2025
CC1(O)C=CC=CC=C1,0.18
N=C1CN2N=CC=C2N1,0.2096
O=CC1=NC(CO1)C#C,0.1943
CC(C)C1C2CC1C2C,0.3755
CC1C2CC=C(C)C12,0.246
CC1OCC(C)=CC=C1,0.1865
CN=C1NC=NC(O)=C1,0.1707
CCCC1OCC1C=O,0.2155
CC(=O)n1cnc(n1)O,0.2004
NC(=O)C1=NCC2CN12,0.202
CCOC1CN(C)C1C,0.2932
CC1OCC1(O)C1CC1,0.3049
CCC(O)COC(C)=O,0.2839
OC1C2CN2C11CC1,0.3011
CCC1C(C)C1(C)C#C,0.2901
CC1(C)OC2C3CC2C13,0.3236
CC(C)(C(=O)C#N)OC,0.1934
c1cc(=O)occc1=O,0.1688
CCC1CC(=O)C1C,0.221
OCC1C2C1C1CCC21,0.3079
C1COC(=O)N1CC=O,0.21
OC1CN2C3CC2C13O,0.2845
OC(C#N)C1CC(=N)O1,0.2724
C#CC1OCC2OC12,0.2896
CC1COC(C)(C1)C=O,0.2133
CC1OCCC1CC=O,0.2238
N=C1NC2C(CC2=O)O1,0.182
CC12CCC3(O)CN1C23,0.2846
Cn1cc(nc1C#C)O,0.1822
O=CN1CC=CC1C#N,0.2416
C#CC1CC=CC1C#N,0.2629
O=C[C-]1[NH2+]CCC1=O,0.1934
COC(C=O)(C=O)C#C,0.1883
CC1=NOC=C1C1CO1,0.2429
COC(=O)C1(C)CN1,0.2559
COCCN=COC=O,0.2309
CC(=O)C1CC2CN2C1,0.2124
CC1CC1C1=NC=NN1,0.258
CC12CCC1(CO)CC2,0.3271
CC1NC11CCOC1=N,0.2615
OCC1CC1CCC#C,0.3131
CC1C2CC1OCCO2,0.3163
COC1CC1O,0.3028
C1CC1Cc2n[nH]nn2,0.2579
c1c2c(c([nH]1)O)OCO2,0.2348
CCCCNC(=O)CC,0.2782
O=C1CC2CC1C21CC1,0.2256
OCC12CC1CCC=C2,0.2499
OC1C2CC(O)C(O)C12,0.3015
OC1CC2CC12NC=O,0.2597
CC1CC11OC(=O)C1O,0.2593
c1cnn2c1C=CC2=O,0.1482
CC(C)CC1C2CC1C2,0.3678
N#CCCCC1CCO1,0.291
CC12CC1C=CCCO2,0.2514
CC(=O)CCOCC=O,0.2252
Cc1ncc(c(=O)o1)F,0.1898
CNC(CN)(C#N)C#N,0.249
CCN(CC)C(=N)C=O,0.1638
COC12CCC3C1CC23,0.3394
CCC12CC(C1)N1CC21,0.3152
OC12CC(C1)C1COC21,0.3121
COC(C)C(O)CO,0.316
CC1(C)C2OC2C1=NO,0.2448
O=CCC12CC1C1CN21,0.2048
C#CCCC(=O)CO,0.2318
CC1C2OC2(C)C1O,0.3276
CCC1CC2OCC1O2,0.3307
CC(C)c1coc(=O)[nH]1,0.2413
C#Cc1ccc([nH]1)C#C,0.1754
CCN(CC#C)C(=O)N,0.2792
CCC(CC#C)C(C)C,0.313
CC(C)OCCC(=O)N,0.2755
COCC(CC#C)C#N,0.3032
C(C1CO1)C1=CNC=C1,0.2502
CC1(C)CC1OCC=O,0.2193
COC1CC(=NO)C1O,0.2379
CC1C2NC1C(=O)C2=O,0.1429
OCC12CC3C(C1)C23O,0.2981
C1C2COCC12,0.3407
OC(CC=O)CC1CN1,0.2243
COCCC1NC1C=O,0.2217
COCCC(CO)OC,0.3177
OC1(CC#C)CC1C=O,0.2266
OC12C3C4C3C1OCC24,0.2971
CC1CCC2OCC12O,0.3157
CN(C)C12CC3C1OC23,0.2851
COCc1cnno1,0.2327
OC1CC1C1=NOC=C1,0.2425
CC1=COC(=N)C(=N)O1,0.1838
C1OC23CC(C2)CCC13,0.318
C1C2C3COCC2C13,0.3409
OC1COCC(=N)OC1,0.2741
CC1C2OC1(C#C)C2=O,0.2306
CC1(CC1)c2ccno2,0.2318
C1C2CCC11OCOC21,0.3345
N=C1CC2CC(CO2)O1,0.279
OC1(COC2CC12)C#C,0.2614
OC1CC1(NC=O)C=O,0.2202
CCCc1c(cco1)C,0.2339
CC(C)C1(CN1)C1CN1,0.3005
CCNc1cnno1,0.2094
ON=C1C2C3N4C3C1C24,0.2454
CC1=CC2NC1C21CO1,0.2242
CC12OC1CC2(O)CO,0.297
CC12NC1CCCC2=O,0.2207
C1CC11CC2CCC1O2,0.335
CC(OC(=N)C#N)C#C,0.2234
COC1OCCC1O,0.3418
COC(C)(C[NH3+])C([O-])=O,0.2601
C1CC12CC(=O)NC=N2,0.2173
OCC1(CN1)C1CO1,0.2957
O=CCC1(CO1)C#C,0.223
CN=C1C=CCO1,0.2071
CC12CC3C1C3(O2)C=O,0.2104
OC1CCC11OCC1O,0.2962
CC(=N)OCC1CO1,0.2989
CCC1C2C3NC3CN12,0.2811
CC1CC11CC(O)C1C,0.3197
CC12C3OC1C(=O)C23O,0.215
C1CN1c2n[nH]nn2,0.216
Cc1cnnn1CC=O,0.2062
N#CCC12CC1OC=N2,0.2599
CN1CC1(C=O)C=O,0.1929
CC1CCOC(=O)O1,0.3194
C1CN1CC2COC2,0.3243
C#CCN(C=O)C(=O)N,0.2493
CC(C)C(CO)C(N)=O,0.2743
CC1CC=C(CC#N)C1,0.2543
CC1OC=NCC1C=O,0.2193
C1C2C3CC1OCCC23,0.3153
CCC(C)C#CC(C)=O,0.2077
O=CC1CNC(C1)C#N,0.2194
C1C2CN1CCOCO2,0.2755
CC(O)C1CCC2OC12,0.3245
Cc1c2cc[nH]c2on1,0.2195
CN=C1CC2(CC2C)O1,0.2691
Cc1c(n[nH]n1)N,0.224
CCOC(CCO)C=O,0.2114
CN=C1NC=NC1C,0.2213
OC1C2NC(=O)CC12O,0.2607
N=C1N(CCC1=O)C=O,0.1691
O=C1CC23OCC2CC13,0.2068
CC1CCC(C)=C1C#C,0.2054
C1C2C1C1C3OCC3C21,0.2893
CC1N2CC1(C2)N1CC1,0.3065
N#CC1C2OCC12C#N,0.2643
N=C1OC2C1COC2=O,0.2493
C1CC1N1CC1C1CN1,0.2842
CC1(O)C(=O)OC11CC1,0.262
COCC1(CC1)CCO,0.3261
c1nc2c(o1)C=CCC2,0.1761
CC1C=C2CC3(C)C2N13,0.1651
O=C1OCC(O1)C#C,0.294
CCC12CC3(CO3)C1O2,0.3211
C1CC#CCCCOC1,0.2761
CCCC(C#N)N(C)C,0.2665
CNc1cc(c(o1)N)N,0.2122
CC1C2CC3C(C2)C13O,0.3106
C#CC12CC1CCC2,0.2886
CC1C2CC(CO)C1O2,0.3101
O=C1OC2C(C3CN3)C12,0.2386
NC(=[NH2+])C1=NC(O)=N[N-]1,0.1549
CC1(C(C1(C)C)C#C)C,0.2858
C1NC11C=CCCC=C1,0.231
OC1CCC=CC(=O)C1,0.1888
C1CC12CC(=O)COC2,0.2099
CC1CCC(=O)NC1,0.2673
CC1COC2CC12CO,0.2957
O=CC1CC2(CC12)C#N,0.2135
Cc1cn2c(n1)ocn2,0.206
CN=CNC(=O)N,0.2498
CC(CN(C)C)C#N,0.2665
NC(CC#N)(C#C)C#N,0.2682
CC(C=O)C1(CO)CO1,0.2211
CC(C=O)C1CC1C#N,0.227
COC1C2CN2CC1O,0.2843
CC(=O)N1C2C3OC2C13,0.2508
C#Cc1cnc(nc1)N,0.1839
CC(C)OC(C)CCO,0.3191
CC1C(C)(O)C1(C)C#N,0.3028
OCC1OC(C#C)C1=O,0.2083
CC1=CC2(C)COC2C1,0.2578
CCC1(C)CC1(O)C#C,0.2737
O=C1CC2CCOC1O2,0.2047
NC12COC1C(=N)OC2,0.2598
COC1CCC=C1CO,0.2594
C#CC1(CC1)CC(=O)N,0.2638
CC1(C)CC1OCC#C,0.2818
CC1OC(OC=O)C=C1,0.2547
OC1CCOCC2CC12,0.2995
CC(C)C(O)C1CN1,0.3173
NC1CCNC1C#N,0.2651
CC1(CC(=NC)OC1)C,0.2761
C#CC1COCOC1,0.2987
OC1(CC=CC1=O)C#C,0.1841
CC1CN1CC1CCO1,0.3128
c1cn[nH]c1OCC=O,0.1824
c1cnoc1C(=O)C#N,0.18
O=C1NC2CC12C#C,0.2457
CCC1(CC1)OC(C)=N,0.2866
C1C2=C(CO1)C(=O)OC2,0.2127
CC1=CC(CCC1)(C)C,0.261
CC1CC2CC(C)(C2)O1,0.3149
COc1cc([nH]c1)N,0.2314
CC1(COC1)OC=O,0.2641
CCN1CC2OC2C1=O,0.2491
CC1C2C(C)OC(=N)N12,0.2782
CCC1OC(C=O)C1C,0.2115
O=C1CC2CN=CN12,0.233
NC(=O)NC12CC1CC2,0.2856
CC1CNC2=CON=C12,0.2058
OC12CC1CCNC2=O,0.258
CC1N2CC2C11CC1,0.3099
OC12C3NC(C13)C2=O,0.2215
CC1NC11C2CN2C1C,0.2994
CC(=O)CCC1CC1,0.2336
CC1C2CC3C(C2O)N13,0.307
C#CC1CC2CC(C2)O1,0.2852
CC(N)(C#N)C1CO1,0.3014
C1C2C3OC4C2N1C34,0.2893
CC1C2C1C(C)(O)C2=O,0.216
CC(NC=O)C1CC1C,0.2818
CC1C(O)C2OC12C#N,0.2656
CCN=C1C=CON=N1,0.2009
CC1C2CCC1OCO2,0.3213
CC1CC1C1=CCCC1,0.2521
c1nc(c(o1)C(=O)N)N,0.1845
O=C1CCC(=O)C2CC12,0.2188
CC12OCCC1OC2=N,0.2761
CC1CC2C1C=CC2C,0.2572
CC1=C(COC1=O)NC,0.2075
CC(NC=O)C1OC1C,0.2787
Cc1nc(c(o1)C#C)O,0.1872
OC1(C=O)C2OC(=O)C12,0.2075
FC1=C(F)C(=N)C=NO1,0.1743
CC(C)C(=O)C1CO1,0.217
CC1CC1(N)C(F)(F)F,0.3125
COC1C2NC1C21NC1,0.3107
CC(CC=O)C(=O)C#N,0.172
C1CC1C1C2CC3C2N13,0.3193
CC(=N)Nc1cc[nH]n1,0.221
C1C2OC3(C12)C1CCC31,0.302
CC1CC(O1)C1CC1O,0.3146
CCC(=O)CCC#N,0.236
C#CC12OC3C1NC23,0.2509
O=C1O[C-]2CC[NH2+]C2=C1,0.1558
CC#CCCC(O)C=O,0.2051
CN1CC11C2C3CC2C13,0.3168
OC1CC11CC(C1)C=O,0.2214
CC#CC1(CNC1)C#N,0.2577
CC1C2C(C)N1CC2=O,0.2064
Cc1cncc(n1)OC,0.1964
Cc1c(coc1OC)N,0.2251
CC1(C)C2CN1C2C#C,0.2526
CC12NC1(CC2O)C#C,0.2541
CC(=O)CC1OCC1=O,0.2171
NC1=NOC(=N)OC1=O,0.1725
O=C1C(OC1C#N)C#C,0.2093
OC12CCC1C(=O)C=C2,0.1865
CCCN1CC1CCO,0.299
CC1=NOC=C1OC=N,0.234
CC1CCCNC(=O)C1,0.2702
CCC1(CN1C)C(C)O,0.3156
CN1C=NC2(C1=O)CC2,0.2181
CN1C2C=CC3OC3C12,0.2103
CC#CC12CC1C(=O)N2,0.2334
CC1COC(C)C(=O)C1,0.212
O=CC(=O)CC1CO1,0.1561
CCC(C)OC(=O)C=O,0.1806
CC(CO)CNC(N)=O,0.3008
O=C1CCC=CC2OC12,0.2132
C1CC2CC3CC1C2C3,0.357
OC1C2(CO2)CC11CO1,0.2965
CC1C2OCOC1C=C2,0.2443
c1cc(nc(c1)O)C=O,0.1759
CC1(COC(=O)O1)C,0.332
CC12C(CO)C1C1CN21,0.2851
CC12NC3C1NC23,0.2914
Cc1c(cco1)C(C)C,0.2334
NC(=O)C1C2OCC12O,0.2607
CC1(COCCN1)C=O,0.1977
CC12CC1CC2(C)C,0.326
NC(C#N)C1COC1,0.2758
C1CC11C2CC=CC1O2,0.2379
CCC1OC1CCC#C,0.3157
CC1OCC2CCC12C,0.3243
CC(=O)C(=O)OCCO,0.1819
CCCCC1(CC1)CO,0.3328
O=C1NCC2CCC=C12,0.2126
CC(CC(C)=O)C(N)=O,0.232
OC12CCC1(O)C1CC21,0.2822
COC1(CC1)C#CCO,0.2684
C1CN1C2CC(=O)C2,0.2225
COC12CC3N(C1)C23C,0.2983
CC1C2C=CC(C=O)C12,0.2142
CC1CC1C12CN(C1)C2,0.3028
CC(=O)[C-]1OC(=[NH2+])C=C1,0.1685
CC#CC1(O)CCC1=O,0.1979
CC1=NNC(=N)C(=N)N1,0.1881
O=C1CN=C2OCCC12,0.2102
NC(=O)C1(O)CN2CC12,0.2546
CN1C=COC(=O)C1=N,0.1679
N=C1N=CNC=CC1=O,0.1767
CC(=O)C1=NC2CC2N1,0.1672
OC12CC3C1C2C3C=O,0.2194
OCC1C(C=O)C2CN12,0.2108
ON=C1CC2OC1C=C2,0.2321
CC(O)C12CC(=O)C1N2,0.2215
CC#CC1NC1(C)C#N,0.2561
OC1CC2CN2CC1=O,0.2018
CC1C(=O)N2CC12CO,0.2343
CNC(=O)NC1CC1,0.3004
OCC12CCC(CO1)C2,0.3204
c1c([nH]cn1)CC#N,0.2481
CC(O)C12C3C4C(C13)N24,0.2782
CC1CC11CCN2CC12,0.3105
CCOC(C)C(=O)NC,0.2754
NC1=CC(=N)OC11CC1,0.2045
NC(CC#C)C(N)C#N,0.2595
OCCC1OCC1C=O,0.2163
CC1C2OC1(C#C)C2C,0.2548
CC12C3C4N3C1(C)C24C,0.2727
C#CC1CN1CCC#N,0.2666
COCC(C)(O)C=O,0.2236
C1CC23CC4C(C12)N4C3,0.3176
CC1CC2CC12C,0.3301
OC1CC2OC2C1C=O,0.2303
CCC12COC3C1CC23,0.3141
CC1OC1CCCO,0.3364
NC1C(CC#N)C1C#N,0.2676
NC(=O)C1=CCCC1O,0.2122
COC1C2CC(CO)C12,0.313
CC12CC1C(CO)CO2,0.2977
CC1C(C#N)C1(O)C#C,0.263
O=C1NC2C1OCC2=O,0.1952
C1CC23CCC(C=C2)C13,0.2494
CCC12CC3(O)CN1C23,0.293
CNc1c[nH]c(n1)OC,0.233
CCC1(CC)C2CCC12,0.3277
O=C1CC2C3C(CN23)C1,0.2182
CC(C[NH3+])(CO)C([O-])=O,0.2727
CCC12CC(C1)(N2)C#N,0.2694
c1cc2n(c1)C=CCC2,0.1982
Cn1cc(c(c1N)N)O,0.2281
O=C1CN2CC2C(=O)C1,0.2029
CCNc1cnoc1N,0.2228
CC1CC=CCC2CC12,0.2628
CC(NCC#N)C#N,0.2659
CC1N2C(C1=O)C2(C)C,0.214
CC1(O)C2C3OC3C12O,0.2618
COCC(C)OC=N,0.275
C1C2CC3C4OC4C1C23,0.3269
C1CC2(C1)C1CC2CC1,0.3552
CC1OC1C1CNC1=O,0.2832
CC12CC1CC2N1CC1,0.3005
COCCC(=O)NC=O,0.2214
O=CC12CN3CCC1C23,0.2023
C1C2CC34COC3C1N24,0.2938
CCNC(C#N)C(C)O,0.2706
CCC(=NC)OCC,0.2747
CC(=N)OCC(O)C=O,0.2275
CC1(CN1CC=O)C=O,0.2156
OC1C2CCC1C2C#C,0.3024
NC(=O)C1=CC2CC1C2,0.2039
OC1CC11CCN1C=O,0.2524
CC1(CO)CC1(C)CO,0.3271
CCC#CC(=O)C#N,0.1913
CCc1cc(co1)C#C,0.2116
CN(C=N)c1c[nH]nn1,0.2014
CCC12C3C1N1C3C21C,0.2745
C1C2N=COC3CNC123,0.2338
c1c([nH]c2n1ncn2)O,0.2428
NC1=NCC2OCC1O2,0.2496
N=C1OC2C=CC3C2C13,0.2269
COC1C2OC1C1CC21,0.3261
OC1C2C3CC1(C#C)N23,0.2633
COC12CC1C1CCC21,0.3157
CN=C(N)C1(CO1)C=O,0.2
CC1(CO)OC(=N)C1O,0.2804
CC1(C2(N1C)COC2)C,0.2924
O=C1CC=C(C1)C1CN1,0.2125
c1nc(nc(n1)O)CN,0.1991
N=C1OC=CC(=O)C=N1,0.1593
OC1CC2CC(=O)C12O,0.2219
OC1C2CC3C4C3N2C14,0.2852
O=C1C2CC1N=CN2,0.196
Cc1c([nH]cc1O)C,0.2301
CC1CC2(CO)NC12C,0.2705
c1nc(nn1C=O)CO,0.208
OC1COC(=O)C2CC12,0.2619
COCC1(O)CC1OC,0.3125
COC1(CC1C#C)C=O,0.2123
OC1CCN2C=CN=C12,0.2463
CC12CC1CC1CC2C1,0.333
COC1CC2CC1C2,0.3369
OCC1CC(O)C11CN1,0.2994
c1cn(nc1O)C2CC2,0.2384
C#CCC1OCC11CO1,0.2976
OC(C#C)C1C(O)C1O,0.2725
CN=C1ON=C(F)N=C1,0.1542
OC12C3CC4CN(C13)C24,0.2763
O=C1C2NC2C2CN12,0.2209
COC(=O)C1(COC1)N,0.2504
CC(C)Cc1cc[nH]c1,0.2463
CC(C)C(C)C,0.3838
CN1C2C1C1C(O)CC21,0.2939
CC1C2CCCOCC12,0.3198
CC1NC(=O)C(O)C=C1,0.2261
C1NC11CCCC=C1,0.2396
CC(O)C(CO)C#C,0.294
Cc1c(=O)[nH]cnc1O,0.1904
CCC1(CC1O)C#CC,0.2816
CCN=C(C#N)NC,0.2032
CCc1ccncc1O,0.2112
OC12CN3C1C2C3=O,0.2399
CC1CC(=O)C(O)CO1,0.2279
CCC#CC1(CN1)C#N,0.2524
OC1COC2=C1NN=C2,0.217
CC(C)CC1(CCC1)O,0.3208
CC12CC(=N)OC1C2O,0.272
c1c(ncnc1N)C#N,0.1894
OCC1C2NC3C2OC13,0.2968
CC(C)CC1=CCCC1,0.2578
NC1=C(F)C(=N)ON=C1,0.1604
CC1C2(C)CC1(O)C2,0.3351
COC1C2N(C)C1C2=O,0.2415
c1c(nc(oc1=O)N)F,0.1996
FC(F)(F)CCC1CO1,0.3684
OC12CN(C1)CC21CN1,0.2781
CN=C(N)NC(=O)OC,0.2388
NC(=O)OCC1CC1O,0.2708
OC1C2C1N1C3CC1C23,0.3032
c1cnn(c1)CC2CC2,0.2621
c1cnc(cn1)NC=O,0.1914
CC12NC1C1C3OC1C23,0.3052
OC1CC2CC2C1O,0.3039
OC12COC1C2CC#N,0.2864
O=C1C=CC2CCCC12,0.1892
OC1CC2(C1)COCO2,0.3206
CN1C2C3OC3C12,0.2625
CC1=NOC(=O)C(=N)O1,0.2082
c1c2c([nH]c1O)C=CC2,0.1702
OC1(CNC1=O)C=O,0.2016
CC1C(CC#N)CC1=O,0.2202
CC12C3C4C(C=CC14)N23,0.2299
Cn1ccc2c1CCO2,0.216
C(F)(F)(F)F,0.6221
CCC1(CO1)C(C)CO,0.324
CN1C2CC2C=CC1=O,0.1963
CC1(C=O)C(O)CC1=O,0.1981
CCCNc1cocn1,0.2117
OC1CCC2CCC1O2,0.3125
CCC12C3C1C1OC3C21,0.3221
CCC1NC(=O)C11CO1,0.2578
CCC1CC=CCCO1,0.2527
CC(C#C)C(N)C#N,0.2889
OC1C=CC2=C1OC=N2,0.18
c1cc2n(c1)CCN2,0.2311
CCC#CC1(CO)CN1,0.2715
CC12COC(CC1=O)O2,0.2163
C#CC12C3CC1CCN23,0.2703
O=CC1(NC2CC12)C#N,0.2035
OCC1NC11CC2OC12,0.3144
CCC1COC(C)=N1,0.2693
CC1COC1C,0.3248
CC1OCC1(C)C(N)=O,0.2703
OCC12CC3=NCC1N23,0.1927
OCC1CCC=CC=C1,0.1894
CC(C(O)C#N)N(C)C,0.2667
CN(C=O)C1(CC1)C=O,0.21
c1cc(oc(=O)c1O)O,0.1609
CC1C2CC1NC(=O)C2,0.2669
O=C1CC(C#C)C1C#N,0.2194
CCc1[nH]cc(n1)NC,0.218
C#CCOC(=O)CO,0.2822
c1nc(on1)N2CCC2,0.2333
OCC1NC11CN2CC12,0.2936
O=C1CC(CO1)C1CN1,0.266
CCc1c(c(on1)N)N,0.2252
CC1(CO1)C#CCC#C,0.2754
c1(c([nH]nc1N)N)O,0.2398
CC(=O)OCC1CC1,0.2835
OC1C2(O)CC1(O)C2O,0.2971
CC(O)C1N2CC1(O)C2,0.3014
O=C1OCC1C1COC1,0.2593
Cc1ccc(c(=O)o1)O,0.1684
N=C1OCC2(CC12)C=O,0.2221
c1c(nc(o1)NC=N)N,0.1886
C1C2(N1C=O)COC2,0.2511
c1c[nH]c(c1O)C2CC2,0.2194
O=C1CCOC2COC12,0.2053
C1CCCC2(CC1)CO2,0.3287
CNC(=O)C(C)(O)C#C,0.2549
OC1(CC=O)CCC1=O,0.1896
Cc1c[nH]nc(c1=O)C,0.1911
CN1C(CO)C(O)C1=O,0.2687
CC1C2CC(C)=CC1O2,0.2372
CNc1ncc(o1)C=O,0.1731
CCOCC1(CC1)OC,0.3242
CN1C(=N)COCC1=N,0.2273
c1nc(on1)NC(=O)N,0.2395
OCC1OCC(=O)C1=O,0.135
OC12CC1CC2CC#C,0.2983
CCC(C)N(C)CC#N,0.2569
CC1(CC(C1)C=O)C#C,0.2219
Cn1ccn2c1ncc2,0.216
OC12C3OC1C3OC2=O,0.2369
COC(C)(C)C(C)C#C,0.3065
CC1=C(CCC1)C#N,0.2165
OC1CC2C3CC12CO3,0.2958
C#CC12CC(C1)CCO2,0.2822
OC12C3NC1CC23C#C,0.2546
CC1OC1C1(C)CC1,0.342
C1CN=C(NC=C1)C#N,0.18
CC#CC12CC3CC1C23,0.267
CCN(C=O)C(=O)N,0.2534
N=C1OC(=CN=C1)C#C,0.1467
CN=c1c(=O)onno1,0.2084
CC1N2C(C)CC12C#N,0.252
CC1COCOC(C)=N1,0.2542
CC(C)c1cn(nn1)C,0.2492
CCCC1(CN1)C1CN1,0.3044
N1C2C1C1C=CC3C2N13,0.2208
CC1NC11C2NC2C1C,0.3009
Cc1cnc(o1)OC=O,0.2126
NC(C#N)C1=COC=C1,0.2388
C1CC(C1)C1CCC=C1,0.2628
CC1COC2COC2C1,0.3237
COC1C(CO)OC1=N,0.2688
COC1C2CC1C(O)C2,0.3198
OC1C2OC11CCOC21,0.2943
CNc1cn[nH]c1CO,0.2104
CC12CCOC1C(=N)O2,0.2717
Cc1c(=O)nc(on1)C,0.1869
COC1(C)C2OC2C1=O,0.1945
CCC1(C)CCC1C#N,0.3236
CC1CC(C#N)C11CO1,0.2978
OC12CC1(C#C)C1NC21,0.2584
N=C1CN(C=O)C(=O)O1,0.2395
CC1CC(C)(C)CC1O,0.326
CCOC1CCC1C=O,0.2266
C(c1nc(=O)onn1)O,0.1584
OCC12N(C)C3C1NC23,0.2778
COC(C)(C)C(O)C#C,0.2854
CC(=O)Oc1nc[nH]n1,0.2649
C#CCC(=O)C1CC1,0.2325
CC(C)C(C)C(F)(F)F,0.4063
N=C1C=COC=NC1=O,0.1865
CN1CC(C1)C#N,0.2593
OC1CC2=C(COC2)C1,0.2502
CC1CC2=C(C)C=CN12,0.246
c1cn2c(n1)CNCC2,0.2452
CC(C#N)N1CC1C#C,0.2673
Cc1[nH]c2c(n1)cco2,0.218
CC1OC(CC1=O)C#N,0.2183
O=C1C2CC3(CO3)C1N2,0.2345
CCCC1CC(O)C1=O,0.2202
CCOC(=N)C(=O)CC,0.201
CCCC1(O)CCOC1,0.3171
O=C1C2CC1N2CC#C,0.2313
C1N2C=NC3CC=CC123,0.2343
C1COC(=N1)C#CCO,0.2164
CC1C(C)C(C)C1C,0.3394
OCC1(CO)CC2OC12,0.2969
CC1=CC2C(O)C2CC1,0.2371
CC#CC1N2CCC12C,0.2577
CN1C2CC2N(C)C1=O,0.2794
CC(C)C1(C)NC1C#N,0.2866
C#CCNCC#N,0.2699
CC1CC2=NCC(=O)N12,0.2295
CC12CC3C(C(O)C1)N23,0.2977
CC12CC(C1)C(CO)O2,0.3187
OC1CC11CC(=N)O1,0.278
CC1C2COCC1C=C2,0.2504
CC(C)(CC#C)C1CO1,0.3113
OCC1(O)CCC=CC1,0.2681
[NH3+]CC1[N-]C(=O)C1C#N,0.2142
COc1c(n[nH]n1)N,0.2131
N#CC1CN=COCO1,0.2593
c1c(c(c[nH]c1=O)N)O,0.165
NC(=O)C(O)CC=O,0.2231
C1CC(=NO)CC=C1,0.2531
OCC1(O)CC2(O)CC12,0.3015
CC1(O)CC11CCO1,0.2907
CCCC(C)(O)C1CN1,0.2953
CC12CCC(C1)OC2=N,0.2876
NC1=NCCNC1C#N,0.2454
OCCCC(C=O)C#N,0.2226
CCOC1(C)CC1CC,0.3295
C1CC1(CCC#N)C#N,0.3151
CC1C2C3CC1(C)N23,0.3187
CC1[NH+]2CC1(C2)C([O-])=O,0.1748
CC(CC#N)NC(N)=O,0.2853
CC1C(O)C=CC1C=O,0.2073
O=C1C(NC1C#N)C#C,0.207
OC1CN2C3CC12CC3,0.2946
CC1CC23CC12CC=C3,0.2334
CCC1CN(C1)CC=O,0.2034
CC12C3CCC1OCC23,0.3183
OC12CC1(O)C1(CN1)C2,0.2847
CC(O)(CO)C1COC1,0.3112
C#CCc1coc(=O)[nH]1,0.2333
OCC12CC1OC(=O)O2,0.3143
NC(=O)C1OC1CCO,0.2623
NC(=O)C(OC=N)C#C,0.2556
CC1CCC(O)C=CC1,0.2565
OC1CC(=O)COC1=N,0.2216
COC1CC(C)(C)C=C1,0.2577
[NH3+]C1CN(CC([O-])=O)C1,0.2458
O=C1NCC11CN1,0.2707
CC#CC(C)C,0.3036
CC1=CON=NC1=N,0.1656
c1c(c(oc(=O)n1)N)O,0.1696
CC12CC(OCO1)C2=O,0.1972
CCC1COC(C)O1,0.343
CC12CN1C(C)(C2)C#N,0.2764
Cn1cc([nH]c1=O)OC,0.2308
CC1CC1(O)C(=O)CO,0.2261
OCC1(CC1C#C)C#N,0.2665
O=CC12COC1CC2=O,0.2019
CC12OC3C4C1C4(O)C23,0.3072
CC#Cc1[nH]nc(n1)C,0.2123
OC1C2CCC11OCC21,0.3085
Cc1c(nco1)OC=O,0.2247
C1OC11C2NC1C21CO1,0.3187
N=C1ON=NC(=N)C=N1,0.1561
Cn1c(n[nH]c1=O)N,0.2468
CN1C2C1C1(C)OC21C,0.2704
OCC1CNC(C1)C#N,0.27
Cc1cnn(c1C#N)C,0.2172
CC1C2C3N2C1C31CN1,0.3003
CN(C=O)C(=O)NC=O,0.2189
O=C1NC=CCC2OC12,0.2139
CC1(OC1CO)C1CC1,0.3355
OC12CC3CN(C13)C2=N,0.2319
O=CC(=O)C1OC2CC12,0.1475
N=C1C=NN(C=O)N=C1,0.1699
CNc1c(nn[nH]1)OC,0.2047
OC1C2C(=O)CC12C#N,0.2229
NC(CNC=O)CC#N,0.2556
COCC(O)CCC#C,0.3145
CCC12OCC1NC2=N,0.254
CNC(C#N)C#CC#C,0.2208
OC1CCNC(=O)C1O,0.2639
O=CC1C2COCOC12,0.2206
CC(C)N=C(C)NC=O,0.2341
CC12OC(=N)CC1C2O,0.2726
C1OC11CCC2(CO2)C1,0.3246
CC(N)(C#N)C(N)C#C,0.2667
NC(=O)C1NC1C=O,0.2144
C1N2C3C4COC13C24,0.3163
C#CCc1c(c[nH]n1)N,0.2207
O=CC1C2C=CC1C=C2,0.2083
Cc1c(cno1)CC#C,0.237
CCC(CO)NCC#N,0.267
CCC(=O)CC#CC,0.2286
CC1CC2OC(C1)C2O,0.2992
C#CCNc1n[nH]nn1,0.2116
CC1CC2C(O)CC12,0.3221
O=CC1C2OC1C21NC1,0.2086
COC12CC1CC2C=O,0.2173
O=CC1(C=O)C2CCN12,0.1992
CC(C)c1conc1N,0.2379
C1CC(C1)CC2(CC2)O,0.3183
CC1CCC(=O)NC1=N,0.245
CC1(CCC1(C)C)C,0.3478
COCC1(C)CCC1O,0.3198
CCC1C=CC(=O)N1C,0.2079
CC(C(N)=O)C1(C)CC1,0.2682
C(c1nnon1)NC=O,0.1902
NCC1(OC2CC12)C#N,0.2604
CCC1(C)C(C)CC1C,0.3439
CC1CC(O)CC1=O,0.2202
OC(C#N)C12CN1CC2,0.2578
O=CC12CC1NCC2=O,0.1994
O=CC1OC2CC12,0.2128
N#CCC#CC1CO1,0.2717
CC1(C)CNC1(C)C#N,0.2725
CCC12CC(CC1)O2,0.3241
O=C1CC2CC(C#N)N12,0.2324
CC1NC1C(O)C(N)=O,0.2786
NC(C#N)C#CCO,0.2658
OC1C2NC1C21CO1,0.3237
OC1C2OC(CC#C)C12,0.2857
Cc1nc(n(n1)C)C#C,0.2117
CCC(CC#C)C(N)=O,0.2706
c12c(nc([nH]1)N)nn[nH]2,0.2094
CC1C2CC(O)CC12O,0.3135
COC1C2NC(=O)C12O,0.2369
CC1(C=O)N2CC2C1=O,0.1932
CC(C)n1cn[nH]c1=O,0.2376
CC1C(C)N1CCC#N,0.2689
C#CC12CN1CC=CC2,0.2467
OC1CCC(C=C1)C#N,0.2634
OC12CC3CC1(C=O)C23,0.2217
C[NH2+]C(CC#N)C([O-])=O,0.258
C1CC2CCC1CCO2,0.304
CCc1cccc(=O)[nH]1,0.1765
CC1OCCC2CC12,0.3269
C1OCC2OC1C1OC21,0.3302
N=C(OC=O)C(=O)C#C,0.1694
O=C1CNC2C3CN1C23,0.225
N#CC12COC1C1CN21,0.253
CN=C1COC(CO)O1,0.2781
CCC1(C)CCCC1C,0.3608
Cc1cnc(cc1O)O,0.221
CC(O)CC1(C)CCO1,0.3085
NC1CC2(CC2)OC1=O,0.2522
CC1CC2C1=CCC2=O,0.2203
C1CN1C1CC2CCC12,0.3016
Cn1ccc2c1cno2,0.2052
Cn1c(c(cn1)C#N)N,0.2294
CC1=C(N)OC(=N)C=C1,0.1589
ON=C1C2CC1(C2)C#N,0.2704
OC(CCOC=N)C#N,0.2727
CC12CC3(CCO3)C1N2,0.3107
C#CC12CC(C1)C21CO1,0.2884
C1C2CN1C1=NC=CN21,0.2357
O=C1CN=COC2CC12,0.2129
CC(OCC#C)C#C,0.2746
COC(C)(CCO)C#N,0.288
NC1=C(N)C=CC(=N)O1,0.158
CC1(C)CC2(CN2)C1O,0.3029
OCC1CC11CCC=C1,0.2469
O=CC1CC11CC2CC12,0.2275
CC1(N=CNC1=N)C#C,0.2288
C1CC1OC2(CC2)C#N,0.2789
CCC1CC1C(O)CO,0.3159
C#CCN=C1CN=CN1,0.2223
C1CC2OC1C1NC21,0.3086
OC1=CC(=N)C=NC=N1,0.1416
Cc1cnc(n1C)CO,0.2305
CCC1=CNC(=N)O1,0.2211
CC1(NC1C#N)C=O,0.2222
CC(C#C)C1(C)CC1,0.3117
CC(C)c1cncnc1,0.2093
CCC1COC(=N1)C#N,0.2176
c1cnc2c(n1)CCC2,0.1928
CC1CC2C3OC1OC23,0.3066
CC1(OC2COC12)C#N,0.2774
C1OC2C3OC4C1C4C23,0.2853
C1CNC=C1C(=O)C=O,0.1341
CC1(O)C2C3CC2(O)C13,0.3072
CC12COC3CN1C23C,0.3099
OC1=NC(=CN1)C1CO1,0.2417
CC1(C)OC2(C)COC12,0.3055
OC1C2NC2C2COC12,0.2916
CCOC1CCCCC1,0.3272
CC(C)c1ccncc1,0.2308
CCCC12CC(C1)C2,0.376
CC1OC2CC(C)(C2)O1,0.3281
CC(O)C1(C)NC1C#N,0.2873
CCOC1CCC1=NO,0.2433
CC(O)CC12CC(C1)C2,0.3297
c1c(c(on1)C#N)C#N,0.1973
COC=NC1CC1CO,0.2474
c1c(n[nH]c1N2CC2)N,0.2332
OC12C3CC1OC(=O)C23,0.2631
C#CC1CCC2(CO2)C1,0.3092
C1NC11CCOCOC1,0.3186
COC(CCC#C)C=O,0.2111
CC(=O)N1CCC(=O)C1,0.2091
OC1CC2(CNC12)C#N,0.2688
C#Cc1c[nH]cc1O,0.2105
CCC(C#C)C(O)C#N,0.2811
Cc1c2c([nH]n1)CCC2,0.25
CCCC1NC1C=O,0.2218
C1C=CC=CC=CC=C1,0.1722
CCC12OC1C(O)C2O,0.3153
CCC1CC2OCOC12,0.3234
CNC(CO)C(=O)C=O,0.1416
C1OC2CC34CC(C3)C124,0.2963
c1c[nH]c(c1N)CCO,0.2235
CC1CC(O)C(=O)C1O,0.2176
CCc1c(ccn1C)N,0.2169
OC12CCC1C1OC1C2,0.3295
CCOCC12CC1CC2,0.3313
OC1C(O)C11COC1,0.2776
CC12C3C4N3C1C24C,0.2727
CCC1(OC1CO)C#C,0.2801
CC1CC2C3OCC3C12,0.3085
CC12OC34CCN(C13)C24,0.2838
c1conc(c1=O)C#N,0.1739
OC1C2C3C1C(=O)CN23,0.216
OCC1(COCO1)C=O,0.2092
OC(CCOC=O)C=O,0.2293
c1cc(c(nc1)O)N,0.1932
N#CC1OC1C1CO1,0.2805
CC1(C)C2C3CC3C12C,0.2805
CC1C2NC(=O)C1C=C2,0.2168
CC1CC1CC#C,0.3138
CC1(CCC11CO1)C=O,0.2238
OC1C2C3OC1CC23O,0.2969
C#CC12OCC3C1OC23,0.2694
c1nc2c(o1)C=CCO2,0.1634
O=CC1CN2C3CC3C12,0.1952
c1ccn(c1)CC=O,0.1758
COCCc1n[nH]nn1,0.2314
CN1CC2(C1)CCO2,0.29
Cc1c[nH]c(n1)O,0.2542
O=C1COC(=O)C11CN1,0.2007
C1CCC=CC(=O)CC1,0.2097
CC(C#N)C1CC(C)O1,0.2931
OC1(CC1)C1CO1,0.3296
C1CN=C(C(=O)C1=O)N,0.1388
C1CC2(C1)CC=CCO2,0.2634
CC1(C)CC1C(N)C#N,0.2904
OC1CC=CCNC1=O,0.2599
CC1=NC(=N)N=CC=N1,0.1491
N#CC12N=CN3CC1C23,0.2216
CC1=CCOCOC1,0.2565
CC1=CC2CC1OC2=O,0.225
OC(C#N)C1COC1=O,0.2782
CC1CC2=CCOC12,0.2352
O=C1NC=C2CCC2O1,0.2175
CCOc1cn[nH]n1,0.2338
O=C(C#N)C1(CN1)C#C,0.1728
O=CNCC1CC(=O)O1,0.264
OC1CCC2CCC2C1,0.3332
CC(C#C)C1=CN=CN1,0.2478
CCN1C=CC(=O)C1=O,0.1471
Cc1ncc(n1C)C#N,0.2105
CCC1CC(CC#C)C1,0.3118
CC1OC1C#CCC#N,0.2682
c1(nc(nc(n1)F)O)O,0.2622
CC1(C)OC2CC(C2)O1,0.3197
COC1CCC(C)(C)O1,0.3362
CCC1C=CCCC=C1,0.2562
C1CN2C1C1C3NC3C21,0.2615
CCCC1OCC(C)=C1,0.2489
C1C(N=CO1)(C#N)C#N,0.2718
CCCc1[nH]ccn1,0.25
N=C1OC2C3CN(C3)C12,0.2554
N=C1OCC11C2COC12,0.2616
C(c1c(c(on1)N)N)O,0.1967
OC12CC1OC1(CC1)C2,0.2945
c1c[nH]c2c1cc(o2)N,0.2173
C1C2OC3=C(NC=N3)C12,0.215
OC1C2CC11CCCN21,0.2839
CC12CCOC1C2C=O,0.2167
OCC1(NCC=C1)C#N,0.2322
C1CCC(=O)C=C(C1)N,0.1939
CC1CN2C=CN=C2O1,0.2428
CC1CC(CNC=O)O1,0.279
CCc1c(c(co1)N)C,0.2213
CC#CC1OC1CCO,0.273
COC(C)C12CC1CO2,0.3087
C1CC2(C1)CCC2=O,0.2136
CC1C2CC2CC11CO1,0.3352
OC12CC(COC1)C2=O,0.2221
C1C2C1C1C3CC1C23,0.3543
CC(C)CCCC=O,0.2289
C1CC1C1C2OC1C=C2,0.2364
CCC1OCC1(C)OC,0.3166
OC1CC11CCOC1=N,0.2781
OC1C=CC(=O)C2OC12,0.1857
O=COC1=NC2CC1C2,0.2332
CCCCC(O)C1CC1,0.3347
CC1OCC2C3CC12O3,0.3109
OCC12CN3CC(O1)C23,0.2649
CC#CC1C=CC2CC12,0.2443
OCC1OC2CCC2=C1,0.2345
c1cc(ncc1F)N,0.1882
CC(C)C(C)(C)CO,0.3347
CC12OC1C1CC(O)C21,0.3107
C1C(CO1)(CO)CO,0.2955
C1CC(=C(C1)C#N)CO,0.2158
OC1C2OCC2OC1=O,0.2645
COCC1C2CC(C)C12,0.3322
OCC1CC(O)C1,0.3299
c1cc(c(cc1O)O)F,0.2098
CC12CN3CC(O1)C23,0.2752
NC(=O)C1(CC#N)CN1,0.2667
OC1CC11CC2NC12,0.2985
CC12C3C=CC1C(=O)C23,0.2046
CC1CC23NC(C12)C3=O,0.2489
c1c(n2c(n1)ocn2)N,0.2051
COC1CC2C(C)C2O1,0.3175
N=CN1C(C=O)C1C#C,0.1924
CC(C)OCCOC=O,0.284
OCC12CN1C(=O)OC2,0.2883
CC(CC(O)CO)C=O,0.228
CCCOC1CN=CO1,0.2794
c1cn[nH]c1NC=O,0.2126
Cc1c(c(ncn1)O)O,0.2109
C1C2OC3CN4C1C2C34,0.2848
OCC1CC2(CC2)C=C1,0.2463
CCCC(C)(C)CC=O,0.222
CC1C2C3C(CN13)N2C,0.2643
O=C(C#N)N1CC1C#N,0.2221
C1C2CC3C=CC1C3C2,0.2504
CC1OC2C3C2C(=O)C13,0.2371
OC1C2C3CC1(C=O)C23,0.2191
C1CC23CC4CC12OC34,0.316
CNC(=O)C(O)COC,0.2771
O=CC1NC1C1CCC1,0.2216
C1C2OC2C2=CNN=C12,0.2505
C1CC(=O)C=CCC1=O,0.1854
CC1=CCC=CC2OC12,0.2303
N=C1OC2CNC1CO2,0.2589
Cc1c(c(on1)C)OC,0.235
C1CC11CC2OCC12,0.3123
C1OC2CC3C4OC13C24,0.2984
CCc1c(nc(o1)C)O,0.2134
CC1(CNCC#N)CO1,0.2719
CC1(CN2CC12)OC=N,0.2607
CC#Cc1[nH]nc(n1)N,0.1888
O=C1NCC2NC=NC12,0.2403
CCC1(C)C(C)C1C,0.3295
COC1CC(C1)OC=O,0.2714
N#CC12C3NC1C=CC23,0.2268
CN=C1CCC(C)O1,0.2743
CN=C1NC(=O)C2OC12,0.2241
OCCC12CC(O)(C1)C2,0.334
CN1C2CC(CC#N)C12,0.2782
CC12CC1(CC2)C#N,0.2811
c1nc(c(o1)C(=N)N)N,0.1795
N=C1NC(=O)C=CCO1,0.1922
CC(O)C1(O)CN(C)C1,0.2916
CC(=O)C1CCN2CC12,0.2168
CCC1=NC2C(O)C2O1,0.2553
COc1nc(co1)N,0.2284
Cc1ccccc(=O)c1,0.1563
N#CC1=CCC2OCC12,0.2171
COCC(=O)C(C)C#C,0.2259
CC(=O)CC1CCOC1,0.2328
CCC(C)(COC)OC,0.3248
CC(CCOC=O)C#N,0.2866
C#CCC1(CN1)C#N,0.2916
C#CC1C(C#C)C1C#C,0.2571
OCC1=CN=NNC1=N,0.1687
C1C(CO1)C(=O)NC=N,0.2247
O=CCCC1CCCO1,0.2294
CC1C2NC(=O)C1C2O,0.2614
C1CC23CN(CCO2)C13,0.2642
C1C2OC3CC2C1C=C3,0.2423
N=C1OC(=O)OC11CC1,0.2665
C#CCNC(=O)NC=N,0.2557
c1c(nc([nH]1)CO)C#N,0.2288
O=C1CCC(CC#C)O1,0.2783
CC(C)C(=O)C(C)(C)O,0.2245
C#CCCC(=O)NC=N,0.2391
CC1C2CC1(CC#N)C2,0.335
OCC1(CC1)C(O)C#N,0.3011
CC1OC11C2NC2C1=O,0.2054
C[NH2+]CC(COC)=N[O-],0.152
COc1ccc[nH]c1=O,0.1772
COC(C#N)C#CC,0.2666
C1OC2C3OC1C=CC23,0.2287
OCC12COC1C(=O)C2,0.1993
COC(=NCC(=O)N)N,0.2397
CC(O)C12CC1OCC2,0.2936
CNC12C(C)C1OC2=O,0.2344
c1c(=O)c(noc1N)N,0.1954
O=C1CC23CC4N2CC134,0.1792
CC12NC1CNC2=O,0.2581
Cc1cncnc1C,0.2137
CCC12CC1N1CC21C,0.2911
CC(OC1COC1)C#N,0.2702
CC1NC2(C)CC12C#N,0.2493
C(C1CO1)C1=NNN=C1,0.2568
C1C2CCOC1C=C2,0.2462
CC(C#C)C(C=O)C=O,0.1993
OC1CC2CN(C=O)C12,0.2633
COc1ncc(cn1)N,0.175
CC#CCC1COC=N1,0.2595
CC1C(O)CC1CC#N,0.3121
OCC1NC=NC1C=O,0.1968
COC1CC(CO1)=NO,0.2505
c1c(c[nH]c1N)CC#N,0.2309
CC1C(O)C1COC=O,0.2792
CC1CCC1NC=O,0.2777
OC12C[NH2+]C1[C-]2C=O,0.1692
O=CC12CC3C1N2C3=O,0.2126
c1coc2c1nc[nH]2,0.2215
CCN1CC1(CC)C#N,0.276
CCCN=COCC#C,0.2696
c1ccn(c1)C=O,0.1934
CC(O)C1N=COC1=O,0.2429
COC(=O)N1CCC1C,0.2889
CC1(CO1)C1CC2CC12,0.3322
CC(C)(C)NC(=O)NC,0.3001
CC12C3C4C3C1(C=O)N24,0.1954
CC1OCC2CC1(O)C2,0.3101
CC12CC1C(O)(C2)C=O,0.2268
C#CC1(CC1)OCC#N,0.2616
COC1CC1(CO)C=O,0.224
CC12CC3N1C(C2)C3=O,0.2153
CC1C(=O)CC2OC12C,0.2262
COc1ccc2n1CC2,0.2346
CC(C)n1cc(nn1)N,0.2173
CC#CC(=N)OC(N)=O,0.231
OC1COC2CC1(O)C2,0.2937
C1OCC2C3OC2C13,0.3097
COC1CC2(C)CCC12,0.3215
CN=C1NC(=O)C=C1,0.1816
NC1=NC2C(CO)C2O1,0.2674
CC1OC=NC2CC12C,0.2496
CC1CC1(O)C1CCC1,0.3204
C1CN1CCCCCO,0.3104
C1C=C2C3OC4C3N1C24,0.163
CN1CC2CC2(C1)C#N,0.2473
O=C1OC2C3C2N2C3C12,0.248
CCC1(CO1)C1CC1,0.3531
CCCC(C)(O)CC#N,0.3083
Cc1nc(c(o1)OC)O,0.2114
CC#CCc1cc[nH]n1,0.2595
OCC12CC3(CN3)C1O2,0.3099
CC(C)(C)C#CCO,0.2775
CCOCc1cc[nH]c1,0.252
CCCC1(CC1)CC#N,0.32
C#Cc1ccccc1,0.203
CCC1C(O)C2(C)CN12,0.2896
CCC1=C(COC1)C#C,0.2031
CC(O)C1C(O)C1(C)O,0.2964
O=C(C#C)C12CC1CO2,0.1839
C1CN1C(=O)N,0.2831
O=C1OCC2C3C1CN23,0.2474
CCc1c[nH]c(n1)C=O,0.1812
CC1C=CC2(C)NC12C,0.2403
CC1C2C3C4C2C1(C)N34,0.3028
c1c(=O)cnoc1C#N,0.1709
CCCC1(O)CC2CC12,0.3154
C1CC2C=CCC2=C1,0.2483
c1nc2n(n1)CCO2,0.2566
CC1(OCC(=NC)O1)C,0.2782
CC1C2C3(CC3)OC12C,0.3022
CC1C(C)N1C(=O)C#N,0.2165
OC1=NNC(=N)C=C1,0.1497
CC1=C(ON=N1)C1CN1,0.2061
COCC12CC1C(C)O2,0.3055
CC1=CCOCC=CC1,0.2388
CC#Cc1c(onn1)C,0.1979
CC1=CCCC(O)C1=O,0.1971
C(C#CC1CN1)C1CC1,0.2678
CC12CCCC1C1CC21,0.3232
OCC1=C2CC3C2N3C1,0.1617
COC(C)C(O)CCO,0.3266
O=C1CC(C#N)C1C#C,0.2107
CC(C)c1coc(=O)o1,0.2539
Cc1c(cno1)NC=N,0.205
CC1NC2CC2OC1=N,0.2559
CN=CNC(=O)CC#N,0.2323
OC12C3OC1C3C2C#N,0.2719
CCC1CC1CC#CC,0.3028
CC12CC1N=COC2=O,0.241
c1c(coc1C#N)C=O,0.1935
NC1=C(N=NO1)C1CN1,0.1952
CC(C)(C=O)C#CCO,0.2172
CCC(O)C1(CN1)C=O,0.2224
CCC12CC1(O)CCC2,0.3271
COc1cnno1,0.2199
CC12CN=COCC1N2,0.258
CNC1C(=O)CNC1=O,0.185
O=CC(=O)C1OC1C#N,0.1509
CCC(C)C(=O)C1CO1,0.2189
ON=C1CC2(CC2O)C1,0.2472
CCC12CC3C1C3(C)C2,0.3201
CC1C=CC(=O)C2NC12,0.1864
CC12NC1CC1OCC21,0.3022
c1nc(no1)CCO,0.2456
CC1COCC(C)C1,0.3255
C(CC=O)COC(=O)N,0.2301
CC1(CO)OCC2CC12,0.3233
OC12CC1(CC=C2)C#N,0.2393
CCCC(=NO)C(C)C,0.2591
CC(C)COCCC#N,0.3053
CC1CN2CC2C2NC12,0.2798
CCC1(C)NC1CC#N,0.2967
CC(C=O)N1CC2CC12,0.1983
C1CC2C=CCCOC12,0.2512
CC1C2CCCOC12,0.3019
CCC1C2C3C(O)C1N23,0.2988
CC1C(O)C=CC1=NO,0.1933
O=CC1C2C3C(N13)C2=O,0.2026
Cn1ccn2c1nnn2,0.222
N=C1C=NOC(=N1)C#C,0.1908
CN=C1OC(=O)CC1O,0.2549
N#CC12CC1N=COC2,0.245
CCCOC12CC(C1)C2,0.3385
CCC1CC11OCC1=O,0.2167
CC(C)([NH3+])C(O)C([O-])=O,0.2628
CCOC1C(C)C1(C)C,0.3135
CC1(CNC=O)CN1,0.2799
CC1CCC11CCOC1,0.3226
CCOCC(CC)C#C,0.3073
CCC1(CO)OC1CO,0.329
COc1c(noc1N)N,0.2323
CC12CC1(CO)C(=O)O2,0.2695
COC1CC1C#C,0.2793
CC12CC3C(C13)C2C#C,0.2899
c1nc2c(o1)CN=CN2,0.1979
COC1CCC2CC1O2,0.3126
CC(=O)C1(C)CCCO1,0.2156
CC(O)C(C#C)C1CO1,0.2973
C1CC2C3CC=CC23O1,0.2257
C#CC1(CC(=O)C1)C#C,0.2179
CC1(C)C=CCC1O,0.2642
CC(=O)COCCOC,0.2192
CC1CC2(CC2)CC=C1,0.2662
CC(O)C1C2CC1(O)C2,0.3341
CC1C2(C)CC(C)C12O,0.307
CCC(C)(O)CNC=O,0.2815
CNC(C=O)C(=N)OC,0.2054
CN(C)C(=O)C(O)CO,0.2596
CC1COC2CCC2=C1,0.2489
c1cc(c(nc1)F)O,0.2113
CC(C)C1OC1(C)C,0.3377
CC1CCC2(COC2)C1,0.3079
c1ccn(c(=O)c1)C=O,0.1601
CC1CC(O)C(C)(C)O1,0.3012
COCC(O)C#C,0.2894
FC(F)(F)C1OC2CC12,0.3174
CCOC=NCCC#N,0.2691
Cc1c(oc(n1)C)C#N,0.2064
OCC1CC1(CO)C#C,0.2921
OCC1C=CC2C(O)C12,0.2272
c1c2c(no1)CN=C2N,0.2035
CC(C)(C=O)C(=O)C=O,0.1431
OC1CC11CCC11CC1,0.2995
O=C1COC2C3OC3C12,0.2112
[O-]C(=O)C1CNC=[NH+]1,0.2388
NC1=CC(=O)C(=N)OC1,0.1819
CC1=CC2(CO2)CC1,0.2478
CC12C3CN1C(=N)OC23,0.2685
O=CC1C2CC2C2OC12,0.2228
c1c(c(on1)C#N)CO,0.2071
Cc1cc(ccc1O)F,0.2069
Cc1nc(nc(n1)F)N,0.2306
CCC(O)COC,0.3297
CC1(C#C)C(O)C1C#N,0.2633
N=C1N=NOC=NC1=O,0.157
CNC(C=O)C(=O)CO,0.1873
CCc1cc(n[nH]1)C#C,0.2251
O=C1NC2CC1C2C#C,0.2529
COC12C3C4C1CC2N34,0.2878
CC12CC1C(CO2)=NO,0.2361
OC1C2C=C3CCC3C12,0.2238
CCc1c(onn1)OC,0.211
CCC(O)CC(=O)CO,0.2379
OC12CN3C1C2NC3=O,0.2446
O=CCC1C2CC1C2,0.228
CC(O)CN1C(C)C1C,0.2908
c1cc(nc(c1N)O)O,0.1799
O=C1NC=CC2CCN12,0.2225
OC1CC(=O)CC2CC12,0.223
C1C2C3C4C5C(C4N12)N35,0.2981
CC12CC1OC(N)=N2,0.2714
CC(CO)C1COC1=N,0.286
OCC12NC3C1C2C3=O,0.2321
CC1CC1CCC(N)=O,0.2783
CC12CC3C(C13)C2C=O,0.2169
Cc1cn2c(n1)[nH]cn2,0.2125
CC(C)OC12CN(C1)C2,0.3161
O=C1C2C3C4C(CN24)N13,0.1963
NC12COC1=NCC2O,0.253
C1CC2CCOC(C1)C2,0.3044
OC1CN(C=N)C(=O)C1,0.2326
NC(=N)C(=O)C1CO1,0.1876
CC1=C(F)C(=N)OC=N1,0.1816
COC,0.3435
N=COC1C2C3NC3C12,0.2581
Cc1c(cccc1F)O,0.2227
C1CC2(O1)C1C3CC2C13,0.3193
OCC12CC3N1C2C3=O,0.234
ON=C1CNC(C1)C=O,0.1981
C(CNC=O)NC=O,0.2715
CC(C=O)C(=O)NC=O,0.1921
CNC(C#N)C1COC1,0.2767
COC1C2CC3CC1N23,0.2848
O=CC12C3C4C3C1OC24,0.2071
OCC12CC1C=CCO2,0.2369
COCC12CN1C(=O)C2,0.2363
c1cc(oc1N)NC=N,0.2144
O=CC1CNCC(=O)N1,0.1795
CC1C2(C)C3OC1(C)C23,0.3092
OC1C=CC23CC12CO3,0.2191
OCC12CC1OC2C=O,0.2199
COC1C2CC1C1CC21,0.3348
O=C1CC(CN2CC2)N1,0.283
CC1C2COC1OC2,0.3314
CC(=O)C1(CN(C1)C)O,0.2057
OC1C2CC1(O2)C#N,0.2555
CCCCN1C(C)C1C,0.289
CC1CC(C)C2OC12,0.3441
OCC1=CC2NC2C1=O,0.181
CC(C)(C)CC(O)C#N,0.3085
Cc1c(c(c(o1)N)N)N,0.2172
CC1(O)CC2OC(=N)C12,0.2783
C1C2C1C1CC2C11CC1,0.3425
OC1CC11CCCC1=O,0.2227
C1C2C3OC4C3C2OC14,0.2976
CC1CC2CCCC2C1,0.3649
C1C2C3OC1C1OC3C21,0.2886
OC1COC2=NNN=C12,0.2198
Cc1nc(no1)NC=N,0.2205
C1C2N1CC1=C2N=CO1,0.2197
N#CC#CC12CN1CC2,0.2018
CC12C3CC(C1C=O)N23,0.2074
c1c2c(co1)OCOC2,0.2258
CCOC(C#N)C(C)O,0.3051
Cc1cnc(=O)oc1C,0.1751
CCn1cc(c(n1)O)N,0.2176
C1C2CC11C=CCN21,0.2165
CNc1c(c(n[nH]1)O)N,0.2414
CC(C)C1OC(=O)C=C1,0.2233
CCC1=CCCC1,0.259
COCc1c[nH]cn1,0.2534
CC1=CCCN1C=O,0.2095
CC1NC(C)(C=O)C1O,0.2054
Cc1c(c(co1)OC)N,0.2213
C#CCNC(=O)C#C,0.2302
CC1=C2C3C4C3C2C4C1,0.1581
CC1=CC(C)(CC1)C=O,0.2057
CC12CCCN1C2C#N,0.2609
CC#CC(=O)NCC#C,0.232
CCCC#CCCOC,0.3039
CC12CC1C1CCCC21,0.315
CC(O)C1=CNC(C)=C1,0.2398
Cc1ccc(=O)ccn1,0.1572
CC1(C)OC1C(=O)CO,0.2258
CC12C3CC1OC23C#N,0.2465
CC(=N)NC(=O)C1CC1,0.2312
CC1(CC1)c2cnon2,0.226
CCC1CC(C)OCO1,0.3482
CC(C=O)C1NC1C#N,0.227
NC1=C(CC2NC12)C=O,0.1801
NC1=NNC(C[NH3+])=C1[O-],0.2108
CC12CC1COC2C=O,0.2219
OCC1C(O)C1(O)C=O,0.2184
CC#Cc1c(nn[nH]1)C,0.2062
CC(C)C12CC1COC2,0.3277
CNC1=NC=NOC1=N,0.1783
COC(CC=O)C(N)=O,0.216
CN1C2C3C(O)C2(C)C13,0.2761
CC(=O)N1N=COC1=N,0.2116
C1CCN=C(NC1)C#N,0.2114
OC(C#C)C1CC=CC1,0.2629
CCCc1c(nc[nH]1)N,0.2177
CC#CC12CCC1C2C,0.2614
C1C2NC2C2=C1C=CN2,0.2303
CC1C2C=CC11OCC21,0.2219
CCc1c(n(nn1)C)O,0.2395
CCCC1CCC=C1,0.2628
OC12CC1C=CC21CN1,0.2339
N=C1OC=CN1CC#C,0.2212
OC(C#C)C12CN(C1)C2,0.2501
CC1(CC1)C2(CC2)C#C,0.2857
O=COC12CC(C1)CC2,0.2791
CC1CC2CC2(O)C1=O,0.2199
CC(C)(CCO)N1CC1,0.3012
N=C1OCOCC1C#C,0.2656
OC1CC2C1CC21CC1,0.3285
CCC1C2C3C(O)C2N13,0.3124
O=C1NCC=CC1C#N,0.2485
C1CC2C1C1C3OC2C13,0.3028
NC1C(O)C1(C#C)C#N,0.2555
OC1CNC1(C#C)C#C,0.2501
CC1CC1C(C=O)C#N,0.221
CC12CC1C(=O)C2CO,0.2255
CC1(CC2CC2O1)C#C,0.2848
OC1C2CC1(O)C2C=O,0.2165
C1NC11C2OC2C2OC12,0.3011
CC12C3C4C(N4C13)C2=O,0.2087
OCC1(O)CC2C(O)C12,0.2808
C(#N)c1c(nc(o1)N)O,0.1993
CC(C1CC1)C1OC1C,0.3372
c1coc2c1oc(c2)N,0.1906
NC(=O)C(O)C(O)C#N,0.2694
C1NC1C1=CCC2CC12,0.2352
N#CC12OC3CC1C2C3,0.2693
COC1CC1OC1CC1,0.3066
CC12CC1(C#C)C1NC21,0.269
O=C1OC2CC2NC=C1,0.1965
COc1ccc(=O)[nH]n1,0.1647
C1NC11C2OC2C11CN1,0.2897
CC12OC3(C)CC1C23C,0.3075
OCC1CC1COC=O,0.2811
CCNc1[nH]nc(n1)C,0.2526
C1COCC1=O,0.2186
O=C1N2C3CC4C(C23)N14,0.2363
CC1CCCCC(C)=C1,0.2522
Cc1ccc(=O)[nH]c1N,0.1714
CC12OC1(C=O)C1OC21,0.2124
CCC(O)CC#CC#C,0.2294
CC(=O)c1ncncn1,0.1665
CC(C)CC1CC(=O)C1,0.2227
O=CC1(CCC#C)CN1,0.2162
OC1CNC1=NCC=O,0.2191
OC1CC1CCOC=O,0.2792
CC12CC(O1)C2(C)C#C,0.2752
N=COC1CCC1=O,0.2031
OCC1=CC2CN2C1,0.2315
C#CC(=O)C(=O)NC=N,0.1486
CC1CC(CO)OC1C,0.3169
CC(C)c1c[nH]cn1,0.2532
c1c2c(on1)C(=O)NC2,0.2148
CC(=O)C12CC1N=CO2,0.2234
CC1=C(COC1)C(C)C,0.2474
CC1(CC1)C(C)(C)OC,0.3251
NC1=NCC(CO)C1=O,0.1806
OCCN=C1OC2CC12,0.2561
CC(O)C1CC(O)C1O,0.3011
CC1CCC2(O)CC12C,0.3273
CCC(O)C(C)(O)C=O,0.2106
CCC1OCC(=O)C1C,0.2142
CC1CCC2C3OC3C12,0.3212
ON=C1C2CC1N2C=O,0.2399
COCC1C2C=CCN12,0.2267
CC12CC(O1)C21CC1O,0.2959
c1c[nH]cc(c1=O)F,0.2
N=C(C=O)N1CCCC1,0.1719
CC12CN1C1(COC1)C2,0.3015
CC1(CO)C=CC2NC12,0.2461
CCC1(CC1)C#CCO,0.27
O=C1OCC2CC2O1,0.3094
NC(=O)C1=CCC2OC12,0.2087
CCCCCCCOC,0.3381
CC1NC1(C)C(N)C#N,0.2658
CC12CC3OCC1(C)C23,0.3183
C#CCC1(COC1)O,0.282
OC12CC3OC(C1)OC23,0.3292
OC(C1CO1)C(=O)C#N,0.1787
CC1CC2C3OC3C2C1,0.3326
CC(=Nc1ncco1)N,0.1833
CC1(C(=NC)NC=N1)C,0.2233
c1c[nH]nc1NC=O,0.2287
CCC1CC2CC12CC,0.3209
OCC1=C2CCC2OC1,0.2346
CC12CC3CC1C3(C)O2,0.3297
N#CC1OCC=CC=C1,0.1908
C1C2CC=C3CCOC123,0.228
CC12OCC1C21CCO1,0.2761
NC(=O)C1COC=NC1,0.2634
C1C2C3C4C5C(C1N45)N23,0.2844
CCC(=O)OCC,0.2862
C1OC2(CN=CO2)C=C1,0.2467
CC12CC(C)(C1)OC2,0.3189
OCC1CC(O)C1C#C,0.2911
c1c(nncn1)N2CC2,0.167
CN1C2CC=CC1C2=O,0.22
CC1C2CCC1(O)C2=O,0.2227
CC1CC=CC(C)(C)O1,0.2663
CC1CC1C1C(O)C1O,0.2916
CNC1C(=O)OC1(C)C,0.2355
OCC1OC(=O)C1C#C,0.2657
N=C1COCC(=O)O1,0.2499
Cc1ncn(n1)C(C)C,0.2647
C1OC11CC2OC12,0.3282
CC12CC1CC1CCC21,0.3296
O=C1OC2CC1NCC2,0.2377
CC1OC1COCCO,0.3364
CC1CC11OC2C(C)C12,0.2987
CN=C1C=C(N)ON=N1,0.2239
CC1CC2CC(=O)N2C1,0.255
OC12CN3C4C(C1)C4C23,0.2812
C#CC12COC3C1OC23,0.2705
CCC1OC2(CO)CC12,0.302
COc1nc(co1)O,0.2345
CN1C2C(O)C1C21CC1,0.3135
COCC(C#C)C(C)C,0.3121
CC1(CC1)C1CC1C#N,0.2914
C#CC12CC3C(C=C1)N23,0.2162
CCC1(COC1)CO,0.305
CC1CC1CC#N,0.3283
CC1(C)OC(=O)C2OC12,0.2511
O=C1CC2C3C4C2C1N34,0.2082
C1NC11CN2CC=CC12,0.2288
CC12CC1C(O)COC2,0.3189
N=C1OC2CC1CC=C2,0.2463
OC1C2CC(=O)COC12,0.2126
CC1=CC(O)CC1C=O,0.2099
CC12C3C1C(O)C2C3O,0.3035
CCC(C)CCO,0.3416
COC(C)(C)C1CCO1,0.3158
C1C2C3OC1C23,0.3137
Cc1ccnc(=O)n1C,0.1776
CC1=CC(O)C(=O)N1,0.2119
C1C2C1C13COCC21N3,0.3149
CC1C2C3CC2C13C,0.3725
OC1(CCOC1)C1CO1,0.3203
OC1(COCC=C1)C#C,0.2514
O=CCCC1CCC=C1,0.2247
CCc1c[nH]cc1OC,0.242
CNC12CN(C1)C2C#N,0.2437
CC1=CC2CC1C=CC2,0.2332
C1OCC1C1C2CC1C2,0.3263
OCC12C3OC(C13)C2=O,0.2222
OCCC1CC1CC=O,0.2259
CC1C(=O)CCC1(C)O,0.2231
CC(C)C1(CO1)C#C,0.2873
CC1COCOC=NC1,0.2569
COc1c(c(on1)N)N,0.2377
O=CC1CN=C2OCC12,0.2143
OC1C2CC(O2)C1C=O,0.2173
CCC1(O)CCC1O,0.3177
COCCC(N)C#N,0.2844
CC(=NO)C(=O)NC,0.2105
COCC(N)C#N,0.2952
Cc1cc(ncc1N)O,0.184
CN1C2CC=CC12C=O,0.2143
OCC1C2C3CCC2C13,0.338
C1C=Cc2c1nc([nH]2)O,0.1765
c1cnoc1CNC=O,0.2387
CNc1c(c(co1)N)N,0.2168
C1C2CC3OCC(O3)C12,0.3264
C1C2OC2C2OC=NC12,0.2666
CC1(CC(O)CO)CO1,0.3121
CN1CC(=O)C1C1CO1,0.204
c1c(ncnc1F)F,0.2447
CC1CC(C)C(C)C=C1,0.2656
CN=C1OC2CC=CC12,0.2499
OC1CC=CC1C#N,0.2659
CNc1[nH]c(=NC)on1,0.2418
CC1CC2N1C(C)C2=O,0.1996
CC1C(C)C11COC1C,0.3115
C1CC1C2(CC2)C3CC3,0.3465
c1cnc2c(n1)[nH]cn2,0.1885
COC1CN(C)CCO1,0.3043
CNC1CN2N=NC=C12,0.2498
CNC(CC#N)C=O,0.2004
c1c(nc(c(=O)[nH]1)N)N,0.1521
CC(OC(C)(C)C)C=O,0.2143
OCC1C2CC3C(C2)N13,0.3369
CC(C)Cc1cnon1,0.2548
CCC1C2CC1C(O)C2,0.339
N#CC1NC2CCCC12,0.2657
CC(C)N(C)C(=O)C#C,0.2189
CC(C)C(=N)OCC=O,0.2299
CCC(C#N)N(C)C=O,0.2701
C#Cc1cnoc(=O)n1,0.1567
COC12CNC1C(=O)C2,0.2012
CC1=CCC(=NO)C1O,0.2412
OC1C2C1C1(CN1)C2=O,0.2146
CC1C2CC2C1(O)CO,0.305
CC1=C(F)C=NNC1=N,0.1641
CC1OC2=C(O1)N=NO2,0.1357
CC12CC1CC1CC1C2,0.3352
CCCC12CC1C1NC21,0.2828
Cc1c(cno1)CO,0.2419
CCCC(=O)C(O)C#N,0.237
CCC1CC2C(O)C2C1,0.3181
CC12CC3(C=O)C1OC23,0.2016
O=CC12CC1OC2,0.2213
CC(=O)N1C2CC2C1=N,0.2368
CC1C2C(=N)OCC12O,0.2751
c1nc(c(o1)C=O)C#N,0.1798
OC1CC2CC1(O2)C#N,0.2631
CC12COCC1C2O,0.3103
C1C2CCC=CC1C=C2,0.2474
Cn1cc(cn1)CO,0.2505
c1ncnnn1,0.1627
CC1C2C(=O)CC12C#C,0.2223
CC1CC2OC(=O)C2O1,0.2498
CC(OC(C)=O)C=O,0.2291
c1[nH]c2c(n1)OC=NC2,0.2178
C1C(=CNC(=O)N1)C=O,0.1828
CC#CC1=CCOCC1,0.2083
C1C23COCC12OCO3,0.32
CC1CC2N(C)C12CO,0.3173
CN=C1C=NNC(O)=N1,0.183
CCC12CC3(C)C(O1)C23,0.2996
OC1CN=C2NC3C1C23,0.1976
c1nc(c2n1CCO2)N,0.2073
OC1COCC1=O,0.2183
OC1(C2CO2)C2COC12,0.2946
NC(=O)CC1OC2CC12,0.272
C1OC1C12CC(C1)CO2,0.3241
N=C1N=CN=NOC1=O,0.1652
C#CCC(=O)OCC=O,0.2298
CCC(CCO)CC#C,0.312
OC1C(O)C1NCC=O,0.2068
C1C2COC3CC(C3)C12,0.3151
CCN1CCC(=O)C1=O,0.1731
CCOC(=N)CC(C)=O,0.2232
C1COc2c1non2,0.2214
C1NC11C2CC1OC2,0.3174
O=CCCC(=O)C1CO1,0.2147
CC1OCCC(O)C=C1,0.2474
C1C(=O)C(=NO)C(=N1)N,0.1454
O=CC1CC1C(=O)C#C,0.1722
CN1CC=CCC1=O,0.2516
CC1(C)OCC1(O)C#C,0.2691
C#CC(CC#N)(C#C)N,0.2693
Cc1nc(co1)CC#N,0.2433
CC1(CC(O)C=O)CC1,0.2231
CCC1CC(COC)C1,0.3377
O=C1CC2C3CC2(C3)N1,0.2637
C1NC1C1=COC=N1,0.2387
CCC1=NCC2CC2O1,0.2717
CC1CC1C(F)(F)F,0.3743
COC(C)C(C)C(C)=O,0.2298
Cc1cnn(c1NC)C,0.2319
Cc1c([nH]cn1)C(=O)N,0.2066
NC1(C#N)C2CN2C1=O,0.207
CC12CCNC1C(=N)O2,0.2586
C1C2C1C1CC2C2OC12,0.3376
OC12CC3N(C1)C23C#C,0.256
CC1(O)COC11COC1,0.3027
O=C1CC2(CC3NC23)C1,0.2194
O=C1CNC11C2COC12,0.1975
C(=O)n1nc(c(n1)O)O,0.192
OC1COC1CCC=O,0.2296
CC1OC(C)C1(C)CO,0.3047
C12C3C4C1C1C2C3N41,0.2566
CC12OCC1C2(O)C=O,0.2146
N=C1COC(=N)N1,0.2533
CC(C)C12CC=CC1N2,0.2331
COC12CC(C1)C2C#C,0.2983
CC12CN3C1C(O2)C3=O,0.2089
CC12COC1C2C=O,0.2122
O=C1C2C=CC11CCN21,0.2325
COC1=NCC(N1)C#C,0.2539
CC1CC2C(C=O)N2C1,0.1997
C1c2c(non2)OCO1,0.2266
CN=C1NC2C(C)C2O1,0.2704
CC1C(O)C2C(O)CC12,0.291
CN=C1OC2(C)CC1C2,0.2779
C1CC2(CCC=C2)O1,0.2508
O=CC1OC2C3CN3C12,0.2033
COC(CC=O)C#C,0.2224
OC12CN3C1C2C3C=O,0.2055
CCc1nc([nH]n1)NC,0.2516
CC1=NC(=N)OC(F)=N1,0.1999
c1cc(oc1)NC=O,0.1987
CC1CN2CC3(CO3)C12,0.2772
CC12NC(=O)C1C1NC21,0.2561
CN1CC1(C)CC(C)=O,0.2131
COC1C2CC(C)C12C,0.3097
N=C1NC(C=O)=CN=C1,0.1244
CC1CCC2COC1C2,0.3096
CC1(C)CCOC(=N)O1,0.2897
CCC(=O)C1COC1,0.2308
C(C(CO)(C=O)C#N)O,0.2139
NC=[NH+]C1=C([O-])C=CO1,0.1168
CC1OCC1(O)CC=O,0.2043
CC1(O)CCC1CCO,0.3269
C1CC2C1C21CC2OC12,0.3351
O=CC1CCOC(=O)C1,0.2208
NC1=CC(=O)CC1C#C,0.2054
CC1(O)C2(O)COC12C,0.2642
CNc1nn(c(=O)o1)C,0.2426
N1C=NC2C3C4OC3C124,0.2397
CCC1CC(C)C11CO1,0.3254
CC1CCCCC2OC12,0.3346
CC1C2NC2C1(C)O,0.3042
C1C2C3C4CN2CC4N13,0.2875
CCC12C(O)C1C1CN21,0.2791
Cc1c(cco1)CC=O,0.1959
CCc1cc(n(c1)C)N,0.2343
O=C1NC2CC11COC21,0.2539
OC12COC3CC1C2C3,0.3033
CC1(C)CNC(C=O)=N1,0.1638
CC1=CCN2C(C#C)C12,0.2271
OC1CC2CC2(C1)C#N,0.3088
CC12C3C(CC13O)C2O,0.3051
CCN=C(C=O)NC,0.1545
CC1(C)NC(C#N)C1O,0.2604
C1C2OC3=C(NC=C3)C12,0.2197
CCC1CC11CN2CC12,0.3052
CCCC(O)CC=O,0.2228
CC(C)N=COC1CC1,0.2696
OC1C=CC2NC1C2=O,0.2061
CC1(O)CCC(C)(O)C1,0.3222
[NH3+]C12CC(C1)(C2)C([O-])=O,0.2393
OC12CC1C1NC1C2,0.3069
C1C(=O)CC1(CO)CO,0.2223
CCC(C)C1=CCOC1,0.249
CC(O)C1CCO1,0.3238
CCC1C(C#C)N1C=O,0.2531
CC1CCC(C)(O)C1,0.3282
CN=C1CN=C2CCN12,0.2195
C1Cc2c(non2)C=C1,0.2025
CCC(C)C1CC1C#N,0.3151
c1cc([nH]c1)C(=O)C#N,0.1625
Cn1ccoc1=O,0.2355
CCCOCC#CC=O,0.2058
CC1C(C#N)C1C(N)=O,0.2526
CC1=CCC2(OC12)C#N,0.2425
CC12CNC1C(=O)CO2,0.1974
O=C1CC23OC12CC=C3,0.22
CNC(=O)CC(=O)C=O,0.1406
N#CCC12CC1C1OC21,0.2723
CC1(C)OC2CC=CC12,0.259
CN=C(CCO)NC=O,0.2308
CCn1c(c[nH]c1=O)C,0.2306
CCC1(CC1)C(=O)C#C,0.203
C#CCOc1ccon1,0.2516
CC1C(OCC1=O)C#C,0.2155
CCC1OCC=C1CO,0.2503
O=C1NCC(N1)C1CC1,0.3076
CC1C2CN1C2C(C)=O,0.2178
C1OC1C1=NNC=C1,0.2528
CC(CC#N)C#C,0.2994
CC(=O)C12OC3CC1C23,0.2209
CCc1c(cc(o1)C)N,0.2117
C#Cc1c(cno1)CO,0.2
CC1NCC(=N)OC1C,0.2603
CCC(OC=N)C#CC,0.2794
CCOCC(=O)C=O,0.1562
CCC#CC(=O)C,0.2084
NC1C2NC2COC1=O,0.2616
OC1C2CC1C1OC21,0.322
C#CC1CC=CC2CC12,0.2457
CCC1(CO1)C(O)C=O,0.2238
OC1CC(C1)NCC#N,0.265
COCC1C2CCC1O2,0.3217
OCCC(O)COC=N,0.2827
Cc1c(oc(=NC)[nH]1)N,0.2184
CCC1C2NC2C11CN1,0.3014
C1NC1C1(CN1)C1CN1,0.3043
NC1=C(F)NC=NC1=N,0.1777
CCC12CCC1=CCC2,0.2434
CC1=CCCC2CC12,0.2496
O=C1CC2C3N2CC3=C1,0.1729
CCC#CC(C)C#N,0.2867
CCCCCC(C)CC,0.3771
OC1C2NC2C1CC#C,0.3026
OC1(C=O)C2CCC12,0.2189
N=C1N=CC=NOC1=O,0.1769
COCCC1CC(=O)C1,0.2231
O=C1CC(=O)C2OC12,0.2121
NC1COC2=CON=C12,0.214
CNc1nc(on1)C#N,0.1724
CNC(=O)CO,0.2707
CC(N)(C#N)C(N)C#N,0.27
O=C1CC2OC2C2CN12,0.253
CC12CCC1COCO2,0.3331
CC(C)C(=O)CC(=O)N,0.2142
COC(=O)C1NC1C#N,0.257
O=CC12CC(N1)C=C2,0.2029
CC1(C#C)C2OCC12O,0.2628
CC1(CC2(C1)COC2)O,0.3017
OC12CC3C1OC(=O)C23,0.2678
O=CCC1COC(=O)O1,0.2249
CC1C2CC1C2CC=O,0.228
OC1CC23CC(O2)C13,0.2985
CCC(=O)NC(=O)CN,0.218
CN=C1OCC1C#C,0.2738
c1c(=O)oc(c(n1)N)N,0.1456
Cc1cnn2c1CC=C2,0.2001
CC1C=CC(=N)NC1=O,0.2135
c1c(noc1C=O)CO,0.1905
c1cc(c(nc1)O)O,0.2039
CC1C2CC(C#C)C12C,0.2953
CC1CC1(C)C#C,0.2941
CC12C(OC1=O)C2C#N,0.2665
OCC(O)C(=O)C#C,0.1839
CC1(C)C(O)C1OC=O,0.2464
N=C1NC=COC1=O,0.1709
CCCOC(CO)C=O,0.2132
CN(CCC=O)CC#N,0.2137
C1C2COCC1O2,0.3276
CC1OCC11NC1C#N,0.2681
Cc1c(ocn1)C#N,0.2111
OC1C2CC3C2CC13,0.3339
C1NC11C=CCC2NC12,0.2499
Cc1c[nH]c(=O)nc1N,0.1929
OC1CC(C=O)=CC1=O,0.1534
CC(CC[NH3+])C([O-])=O,0.2756
C#Cc1cc([nH]c1O)O,0.2024
CCC1CC1(C#C)C#C,0.2645
OC1C(NC1=N)C=O,0.2135
N#CC12CC1COCO2,0.2787
CCC#CC(=NO)CO,0.201
CC1OC2CC3NC3C12,0.2939
CC1(C)N2C3CC2C13C,0.305
CC(CC(N)=O)C(C)=O,0.2318
C#CC#Cc1c[nH]nc1,0.1898
CC1OC2C(O1)C2(C)C,0.3304
O=C1OC2CC2C11CC1,0.2784
C#CCNc1cnco1,0.2193
CC1COC(=O)C2NC12,0.2492
CC#CC(O)C(=O)CO,0.217
COC12CC1(O)C(=O)C2,0.2241
CC12CC3CC4C1N4C23,0.3007
OC1(CCCC1=O)C=O,0.1836
O=CNC1=CC2OC2C1,0.2044
C(CO)C(=N)NC(=O)N,0.2499
OC12CCC1CCC2,0.3284
CC1=CC2C(C1)N2C=O,0.2356
CCC1CC(C)(C1)C#C,0.3106
CC(O)C12CN1C(=O)C2,0.2385
C#CC1CCN=CO1,0.2682
CC1N2C3C4C=CC13C24,0.2191
N=C(C(=O)C#C)N1CC1,0.1711
CC1=CC2NC2C2CC12,0.2414
CC(C#N)C1(C)NC1C,0.2956
O=CCC1CNC(=O)C1,0.2102
O=CC(C#C)C1CC1,0.2192
COCc1c[nH]nc1N,0.2304
C1CC11CCOC2CC12,0.3177
CC1C2OC(C3CO3)C12,0.3133
OC1CC2CCN3C1C23,0.2814
O=C1OCCC2CC12,0.2634
CC(C)C1(CO)CC1C,0.3326
CN=c1c(ncc[nH]1)F,0.1545
COC1C2CC2(C)C1=O,0.2072
CC1CC2OC2C1=NO,0.2431
CC1CCCNC(=O)N1,0.2951
c1nc(nc(=O)o1)N,0.2146
CCC(CCO)C1CO1,0.3416
Cc1c([nH]c(c1O)O)C,0.2264
NC(=O)C1C=CC2OC12,0.226
CC(O)C1=NON=C1N,0.2122
c1c(c(n[nH]1)N2CC2)N,0.2188
CCC1CC1C(=O)OC,0.2793
c1c(c(=O)nno1)N,0.1488
CCC(C)(CO)CO,0.3249
CCC1C2C3CC1(C)C23,0.3318
C1CC11OC=NC2CC12,0.2449
CC(=N)OCC1CCC1,0.299
CC12CC1OC(=N)O2,0.2993
CC1C2CC(CC=O)C12,0.2257
Cc1cnccc1F,0.2406
OC1C2CC1C1CC1C2,0.3271
C1CC1(CC#N)N2CC2,0.2728
N=C1OCC2OCC2O1,0.2942
CCC1CC(O1)C#CC,0.2743
CC1C(COC1=O)C#N,0.2752
CC(O)(CO)C(O)C=O,0.2305
NC(=O)C1CCC2CN12,0.2703
COC1C(=O)COC1=N,0.2045
Cc1c(nc([nH]1)O)C#C,0.2067
O=C1CC2CN2C2CC12,0.2204
CC(O)C12CCC1N2,0.3172
c1c(nn(n1)CC=O)O,0.1994
Cc1nc(=O)cc(o1)O,0.2098
c1c(c(=O)nc([nH]1)N)N,0.1896
CCC12CC3(C)CC1C23,0.3303
CC1=C(C)C(=N)N=CO1,0.2045
CC1N=COC1(C)C#C,0.2688
N#CC1CCOC11CC1,0.2817
CC(C)OC1C2CC1C2,0.3311
Cn1cc(nn1)C2CC2,0.2349
COCC1CCC2CN12,0.3076
C1NC11COCC=C1,0.2365
OC1COC2CC(=O)C12,0.209
CN1CC11C2CC1C2=O,0.2382
CC1(O)CC2(OC12)C#N,0.2764
COC1(C)CCCO1,0.3415
O=C1OCOCC11CN1,0.2584
CC1(CCC1)C(O)CO,0.3111
CC1=CC2(C)NC1C2O,0.2286
CC(C#C)C1(CN1)C#N,0.2844
C1CC11CC2C3OC2C13,0.3118
CC12CCC1C2C1CC1,0.3301
O=C1CC2(CC12)C1CO1,0.2321
CN1CC1C1(CC1)C=O,0.2048
CC1CC2CC(C)(C1)O2,0.3126
NC(=O)CC(C=O)C#C,0.2246
CC1C=CCC1(C)C#N,0.2627
C1CC2N=CNC=NC12,0.2181
FC(F)(F)C1(CO1)C#C,0.2857
C1C2C3C4C=CCC13C24,0.2517
CC1NC11CNC1=O,0.2707
CC(C)C1CC1O,0.3319
N=C1OC2CC1CO2,0.2865
OC1CC1C1OC1C#N,0.2777
CC1(Cn2c1ccc2)C,0.2498
CC1(CN1C)C,0.3063
CCC1C(C)CC1OC,0.323
OC1CCC(C#C)C1=O,0.2131
O=CC12CC1N1CC1C2,0.2228
CN=C1N2CC2C11CO1,0.2332
CC1=NC(=N)NN=C1N,0.1406
CC1(COC1)OCC#N,0.2583
OCCC12COCC1N2,0.3232
NC1(C#N)C2NC1C2O,0.2747
CC12CN1C(C=O)C2O,0.1963
NC(=O)C(CO)C1CO1,0.2739
CCC1=CC(OC)OC1,0.2605
CC1OC(=O)NC=C1,0.2271
CC(OC=N)C(=O)C#N,0.1768
C1CC2CCC3C1C3O2,0.2884
CC1=C(OC(=N)O1)C#C,0.1886
N=C1OCC=CN1C=O,0.2243
COC(C)(C#N)C#CC,0.27
c1cnc(cn1)N,0.1881
CC(=N)OCCC#C,0.2981
CC(O)CCC1(C)CO1,0.3318
CC12OC(=O)C1(N)C2N,0.2434
CNc1c([nH]nn1)OC,0.2108
COC1(CO)COC1=O,0.2658
CC1C2CCC12OC=N,0.2764
C1OC11C=CC2COC12,0.247
CNC(=O)C1(CO1)C#N,0.2523
OC12COC1=NC1CC21,0.2363
OC1CC11CC(O1)C=O,0.2041
CCCC1=CCCC1,0.2588
CC12CC(CO1)CCO2,0.3269
OC12C=CC3C=CC1C23,0.2238
O=C1CC2CC2C2OC12,0.2145
CC1=CC2CCCC2C1,0.2606
COC1C2C3C=CC2C13,0.2256
OC1C(CNC1=O)C#C,0.272
CC1C2C3C4C3C1(O)C24,0.3016
NC1CC2CNC12C#N,0.244
O=CC12C3CN1CC2N3,0.1899
CC1=CC(OC1=O)C#C,0.2288
C1C=C2C3OC4C3C1C24,0.1712
CC1CC(C1)C#N,0.3338
CCC1(NC1C)C(C)O,0.2947
CCOc1ncc(o1)C,0.2396
CCC1OC11COC1C,0.3284
CCC1C2C(=O)OC12C,0.273
CC1CC(CC#C)C1=O,0.2165
CC(=O)CC1CC(=O)C1,0.2207
COC12C3CC4C1N4C23,0.2961
O=CC1CN2CC12C#C,0.2049
CN1C2CCC22OCC12,0.2644
CC12CC1C1(CN21)C#C,0.2369
NC1=NC(=N)N=CN=C1,0.1565
c1cn[nH]c1CNC=O,0.2434
NC12C(CO)C1NC2=O,0.2306
CCCC1C2C3CC2C13,0.3702
CC1(C)CC2(C)CCC12,0.3337
N=C1CC(CC#C)CO1,0.2839
CC(C)(C#CCC=O)O,0.2206
CC1COC1(C=O)C=O,0.1869
N#CC12CC=CCC1N2,0.2623
COC12CCN3C1CC23,0.3129
COC1(CC1)CC=O,0.2251
CC12C3C4CC(C=C14)N23,0.1481
CC1C2CC11COC1C2,0.3171
C1C2OC3COC1CC23,0.3235
N#CC1(CCO1)C1CC1,0.2869
CC(C)N1CC(C)C1=O,0.2722
C1OCC2C3OC3C12,0.3124
CC12CC3(O)C(C13)C2=O,0.2424
CC1C(O)C1N(C)C=O,0.2512
COC1C2CC1(C)O2,0.3133
OC1=COC(=O)C(=N)O1,0.1671
OC1CCCC2CN2C1,0.2974
O=CC(C#N)N1CC1,0.2253
C1OC11C2CC1O2,0.3194
OC1CC2C=CC3C1C23,0.2334
COC1C2C3OC2C13O,0.303
CC12CC1C1CC1O2,0.3103
CN=C(C(=O)N)NC=O,0.1974
O=CC12CC3C(C1)C3O2,0.2145
CC12CC3CC(OC1)C23,0.3172
O=CC1=CNCC11CN1,0.1681
O=CC1C2OC2C11CN1,0.2155
CC1(OCC1C#C)C#C,0.2686
CC(=O)NC(=O)N,0.2427
OC1CC2CC3(CN3)C12,0.2948
OC12C3CC1N=COC23,0.2464
CCC(CO)C1CCO1,0.3148
CC#CC#CC(=O)OC,0.19
OC12CC3C4C1N4C23,0.2887
CC12CN1C(C=O)C=C2,0.1997
CC#Cc1cccn1C,0.1973
COC1CC2OC(=O)C12,0.2738
CC1C2C3OCC1(O)C23,0.2906
Cc1c(occ1C=O)C,0.1825
Cn1c(nc(n1)C=O)N,0.1952
CC1C(C)C2C1OC2=N,0.2833
CCC1OCC=C1,0.248
CC(C)(C#N)C(=O)OC,0.2819
CC(C)C1CC(=O)N1,0.2815
C1C=Cc2c(n[nH]n2)N1,0.1721
Cc1cc(c(=O)oc1)N,0.1632
C1C2NC3COC2OC13,0.3113
c1nc(c(c(=O)o1)F)O,0.1842
Cc1cnccc1C=O,0.1776
CC(O)C1C2OC(=N)C12,0.2748
c1c2c(c([nH]1)N)nn[nH]2,0.1771
CC12CC1OC2C1CC1,0.2994
COC1(C[NH2+]C1)C([O-])=O,0.2635
COCC#CC1(C)CO1,0.274
CC1(O)CCC=C1CO,0.2612
OC1COC1C1CCC1,0.3001
CCC1(C)OCC1=O,0.2228
N=C1CCNCC(=O)O1,0.2171
OC1COCC(C=O)=C1,0.1894
C1C2CC1C1OCC1=C2,0.2372
CN1C2CC1(C2)C(C)=O,0.2018
CCC(=O)C1CCN1C,0.1855
Cn1cnc2c1COC2,0.2376
CC1CN1C1(C)CC1C,0.2998
C#CCC1C2C3CC1C23,0.3028
Cc1cc([nH]c1)NC,0.2368
CC1=C(CO)CC2OC12,0.2345
COC12CC1CC2,0.34
CC(C)(C#N)OC,0.3015
CC1CC2OCCC=C12,0.2511
COC1CNC(=O)O1,0.3171
C1C2C=C3CN4C(C12)C34,0.2082
OC1CC11CCN=CO1,0.2677
O=COC1CC1C=O,0.2253
N#CC1CNCC2CN12,0.2532
N=C1CC(C#N)C(=O)N1,0.2497
CC(=O)N1CC(=NO)C1,0.2301
CC1CCC(O)CCO1,0.3188
C(CO)NC(=O)C(=O)N,0.2109
Cc1c(c([nH]c1C)C)C,0.232
C1C(=O)OCO1,0.2772
CC1(O)CC1(CO)C=O,0.2085
c1coc-2ncnc2n1,0.1608
c1cnc(cn1)F,0.2082
Cc1ncc(o1)N(=O)=O,0.1828
CC1C2C3C1OCC23O,0.3019
CC1NCC2(OC12)C#N,0.2422
C[NH2+]CC(C#N)C([O-])=O,0.2198
OCC12CCC1C(=O)O2,0.2776
CC(O)C1=COC(=O)O1,0.251
OC1CCCOC1=O,0.2637
C#CC12CCC3CN1C23,0.2681
CC12OC=NC1C1OC21,0.2707
CCC(CO)(CO)C#C,0.2951
CCOC1CCCC1C,0.3218
CCCCN1CCC1=O,0.2783
c1c(c(oc1N)N)CO,0.2156
CC1C2OCC1C(=N)O2,0.2867
OC1CC(O)(C1)C1CO1,0.3178
OC1C2OC1C(=C2)C#C,0.1949
COC1CC11CC(=N)O1,0.2643
CC(=NO)C(O)CC=O,0.2309
CC1NC11C2OC1C2=O,0.2424
CCOC1(COC1)C#C,0.2795
CCC1NC(=O)C1(C)C,0.2779
CC#CC1(CCO1)C#N,0.2546
OC1CC=CC2OC2C1,0.2464
OC1C2C1C(=O)OC2=N,0.2498
CC12C3C1C1OC3C21,0.3248
CCC1=CCC(=O)NC1,0.253
C1CN2C3C4C1C4C23,0.2842
CN=COC(C)C(C)=O,0.2254
C1CC2OCC3OC23C1,0.3164
CCOc1cnc(o1)N,0.2306
CC(O)C(O)(C#C)C#N,0.2828
CC1(C#C)C2OC2C1O,0.2859
C1CC11C2CCCC1O2,0.315
C1CC=CC2NC2C=C1,0.217
CCCCNC(=O)OC,0.3107
CN1CCC2(CO2)C1=O,0.251
CC1(CO1)C1(CO1)C#C,0.2801
CCC1OC(=N)C11CC1,0.2812
OC(C#N)C1(CC1)C#N,0.3028
CCC(=O)OCCO,0.2844
Cc1cnc(c(n1)C)N,0.1839
NC(=O)C1CN1CC#N,0.2436
CC1CC2CC2C(=O)O1,0.2634
CC1(C)C2(C)CCC12O,0.3042
Cc1nc2c(o1)CCO2,0.202
c1c(c(c(nn1)O)N)F,0.2028
c1c(c(c([nH]1)CO)N)O,0.2245
O=CC1COCCN1,0.1847
CC1=CC2C3N2CC13O,0.2248
CCc1ccoc1C,0.2335
O=CC12CC3C1N3C=N2,0.2148
CC12CC(O1)C1(CC1)C2,0.3294
C1C2CC3CCCC1C23,0.3291
N=COCC1=NNC=N1,0.2504
NC(=O)CC(=O)C1CN1,0.2034
c1ccc2c(c1)cco2,0.2031
CN=CN1C(C)C1C#N,0.2464
CCNC(=O)C(N)C#C,0.2602
CC(O)C(=O)C(C)(C)C,0.2248
CC1C2CC1C21CC1,0.369
C1CC23NC2(C1)C1NC31,0.3221
OC1=NC(=N)OC=N1,0.1909
N#CC12CC(CO1)CO2,0.2902
c1nc(c(c(=O)o1)N)F,0.1662
CC1(C)C2C3CC3(C)N12,0.3059
C#CCC12CC1OC=N2,0.2584
O=C1CN2CC1C=CC2,0.1956
c1(c(=O)onc(n1)N)N,0.1674
CC(O)CN1CC1CO,0.278
Cn1c(nnc1N)N,0.2479
N=C1NC=NCCC1=O,0.1895
OC1CNC2=NNC=C12,0.2185
CCN1CC1C(O)C#N,0.2534
CC#Cc1c(cco1)C,0.1938
CC1CCOCOCC1,0.3431
CCC(CC(N)=O)C#C,0.2674
N=C1OC=NOC1=O,0.2116
Cc1c(coc1N)C=O,0.1852
C1CC1(C#N)C2(CC2)O,0.2934
C1OC1C1=CC=CN1,0.231
O=COCC1NCC1=O,0.2169
CC1C2CC3OCC1C23,0.3124
CN1CC1CC(F)(F)F,0.3174
OCC1OCC(=O)C1O,0.2162
CCNC(=O)CCC#C,0.2738
COC1=NC(=N)N=NO1,0.2392
CCC12CC1(CC2)C=O,0.2176
COC12CC(C1C)C2=O,0.2338
CNc1c(ocn1)C#C,0.1748
CC(C)c1cn[nH]c1O,0.2512
COC(=O)CC1CO1,0.2817
C1CNC(=O)CC1=NO,0.2417
CC12CC1(O)CC(=O)O2,0.2679
CCN1CC1(C)CC,0.3019
COC12CC1CCC2O,0.3067
CC12CC(=O)C1C1OC21,0.213
NC(=[NH2+])C(C=O)=N[O-],0.1272
Cn1cc(c(=O)nc1)O,0.1942
CC(CCC#C)N1CC1,0.2922
CC#CC#CC(O)C#C,0.2151
N#CC1C2CC1C21CN1,0.2823
CC1CC(C)NC(=O)N1,0.2918
CCC1(CO1)C(=O)OC,0.2594
NC1(CN2CC1C2)C#N,0.2701
CC1(O)C2CC2C1C=O,0.2098
OC1C2C3NC1(C=O)C23,0.1941
O=C1NC2CC2C1=O,0.1723
Cn1c2nncn2nn1,0.1992
CC12CC(C1)C2,0.3917
O=C1CC2C1N2CC#C,0.2117
CCC(=NO)C1CC1,0.2482
NC1=CC2=C(N1)ON=N2,0.1249
C#CC(C#N)N1CCC1,0.2469
N=C1OCC1(C=O)C=O,0.2122
NC(=[NH2+])CC(=O)C([O-])=O,0.1832
CNC(=[NH2+])C(CO)=N[O-],0.138
CC(O)C1OC2CC1C2,0.3111
CN1CC11CCC1C=O,0.2111
CC12C3CC3N1C2CO,0.2779
CC1(O)CCC(=O)C1=O,0.1404
CN=C1OCC(=C1)C#N,0.1749
CCOC12CC1C1NC21,0.2863
CCCN=c1[nH]nn[nH]1,0.1957
CCC1NC1(C#C)C#C,0.2527
COC(=N)CC(=O)OC,0.2614
C1C2N1CC21OCC=C1,0.2399
CC(C)([NH3+])C([O-])=O,0.2713
CC1=NC2CC2C(=O)O1,0.2432
CC(C=O)C#CCO,0.219
CN(C)c1c[nH]nc1,0.2147
CC12CC(=NO)C1(C)O2,0.2476
Cc1c(c(oc1N)O)N,0.2148
COC1(CO)CC=CC1,0.2632
Cn1c(cnc1O)C#N,0.2049
N#CC12CCC3C1OC23,0.2718
CC(C#N)C1CC(=O)O1,0.2872
OCC12CC(C1)C(O)C2,0.3284
CC1CC2(O)CC3C1C23,0.319
COc1cnc(cn1)F,0.1857
CCCC(CCO)C=O,0.2267
COC(=O)C12CC1OC2,0.2504
OCC1(O)CCN2CC12,0.2879
CC1(CC=CCN1)C#N,0.2541
CC1=CCCC2OC12,0.2455
CC(C=O)N1CC1C#C,0.2174
c1c(ncc(n1)N)CO,0.1824
CC(CNC=O)N1CC1,0.2808
CC1OC1CC1CO1,0.3501
O=C1COC2COC12,0.1956
COC12CC1OC(=O)C2,0.2681
OC12CC3(C1)OC(=N)C23,0.2684
N#CC1CNC2COC12,0.2831
c1c(onn1)C2CC2,0.2211
CC1CN(C)C11COC1,0.2854
OCC1CC1C(O)C#N,0.2828
CCCn1cc(cn1)C,0.2531
COC1C2C3C4C1C2N34,0.3029
CCC1(C)CC(CO)C1,0.3368
CC12CC=CC1(O2)C#N,0.2381
C1CNC2(C1=O)COC2,0.1968
COC1CC1(C)NC=O,0.2695
CC(=O)C12CC3C1OC23,0.2099
Cc1coc(n1)C(=N)N,0.2015
CCc1c[nH]c(c1O)C,0.2311
CN(CC1(C)CN1)C=O,0.2726
COc1c(con1)C=O,0.1991
N=C1CC2(O1)C1CC2C1,0.2854
CC1(C)CC2(OC12)C#N,0.2738
CC(C#CC=O)C(C)=O,0.187
O=CC1OC2CC12C#C,0.2055
c1cn2c(n1)onn2,0.1841
c1cn(nc1N)C(=O)N,0.208
CCOC(C)C(C)OC,0.3371
CN1C(CC#C)CC1=O,0.2757
CC1COC(=O)C1C=O,0.2244
O=C1OCC2CC3C2C13,0.26
CC1COC1C(=O)C=O,0.1433
[NH3+]CC1=N[N-]N=CC1=N,0.1461
O=CC1=NC2CCC2O1,0.1849
CCC1=C(C)C(C)OC1,0.2462
CC#CC1CC2CCC12,0.2912
OCC12OC3C1NC23,0.2891
OCC12C3CC(C13)C2=O,0.242
CC1OC1C(=O)CC#C,0.213
CN=C1OC2C3OC1C23,0.2389
CC(=NO)C1CCOC1,0.2514
CC1CC2=CN=CN12,0.256
CC(C)c1ncon1,0.2683
CC12C(O)C1C1CN21,0.2814
COC12CC1N1CC1C2,0.3067
CCC1(CCCC1)C=O,0.2263
CC1(CCOC1=O)C=O,0.2165
CC1(COC(=O)OC1)C,0.3172
OC1CCC1C(=O)C#N,0.1776
OCC1CC1OC1CC1,0.3189
NC(=O)C(CC=O)C#C,0.232
C1OC2C1C1CCC=C21,0.2342
CC1CCC11CC2OC12,0.3308
CC12CCC1(C)N1CC21,0.3117
CC12NC1COC1CC21,0.3042
CC1C(O)C1CCC=O,0.2267
COC1(C)COC1C,0.3171
O=CN1CC(=O)C1C#C,0.2063
CC1CC2CC12CO,0.321
CC(C)C(CC=O)C=O,0.2199
OC1C2N=COCC12O,0.2404
OC1CC11CC=CC1,0.2646
C#CCC1CC2OCC12,0.2941
CC#CC1CC2(C)CN12,0.2652
COCCC(C)C(C)=O,0.23
N=C1OCCC2CC12,0.2723
CC1=CN=C(O)OC1=N,0.1857
CC1NC(=O)C1O,0.2703
C#CC1CC2OC2C1,0.3054
c1c(oc(=O)c(n1)F)N,0.1558
O=C1CNC(CO1)C#C,0.24
CC12CCC1C(N2)C#N,0.2634
CC12CC(C)(CC1)O2,0.3266
CC1COC2=NOC=C12,0.2402
C1CCC#CCC=CC1,0.2443
COC=NC(C)CO,0.2582
CC1C2COC=NCC12,0.2606
COCC1C2OC=NC12,0.255
CC1COC(=O)C11CO1,0.2495
CC#CC12CC(CC1)O2,0.2694
CC1(C#C)C(O)C2CN12,0.2761
NC12C(OC1=O)C2C#C,0.2389
CC1OCCCCC1O,0.3259
CC(=O)OC1(CC1)C=O,0.2331
NC1C(OC1=N)C#N,0.2571
CC1CCC(C)C(=O)C1,0.2226
CCC12NC3C1NC23C,0.2944
CCC(=O)NC(=O)C#C,0.1987
OC12CC1C1OC(=O)C21,0.2572
CCc1cc(nn1C)O,0.2358
N#CC1=CC2OC2C1,0.2081
CC1N2CC1(C)C2C#C,0.2549
C#Cc1cocc1C#N,0.2127
OCC1CC(O1)C=O,0.2132
c1cnccnc1=O,0.1592
CC1CC2NC(=O)C2O1,0.2549
C1C2C3CC4C2OC4C13,0.3015
COC1CC2CC2(O)C1,0.3109
N=C1NC2(CC2O1)C=O,0.1912
CCC#CCOC=O,0.2685
O=C1C2C3C2C2CC3C12,0.218
O=CCC12CC1C(=O)C2,0.213
CC1NC1(C)CC#N,0.2817
C(=O)C#CC(=O)C=O,0.153
CC#CC1COC(=O)O1,0.2838
CC#CC1(CCO)CN1,0.2692
O=CCC1CCC11CO1,0.2256
COC(=O)CC1(C)CN1,0.251
C#CCC12COCC1N2,0.2979
CC(NC=O)C1NC1C,0.2762
OC1CC(=O)OC1C=O,0.205
COC12CCC1N1CC21,0.2899
O=CC12OC1CN1CC21,0.1899
CC1C2CC1C(O)C2C,0.3253
OCC1(CO1)C=O,0.2106
CN1C2C1C1C2NC1=O,0.2505
C1CN(C=C1)C(=O)C#N,0.1785
C#Cc1nc(co1)C#N,0.1995
c1c[nH]c(=O)cc1F,0.1857
N=C1OC=NN1CC=O,0.1897
CC1=CCC2(C)CC12C,0.2465
CC(C)COCCC#C,0.3117
Cc1ccc2n1CCN2,0.2265
CC1C2CC2C1(N)C#N,0.293
CCCC1CC1CC#C,0.3132
CCC(=O)C12CC1OC2,0.224
c1c(cncc1O)CO,0.2086
CCC(C)COCC=O,0.2291
O=COCC1CN1C=O,0.2525
CC(C)C1C(C)CC1=O,0.22
CNC(=O)C1(C)CO1,0.2671
CCOC1C2CC(=O)C12,0.2293
CC12CN1C(CO)C2=O,0.2175
C#CC#CCC1CO1,0.2298
CC1CC2OC2C2NC12,0.3097
C1CN=C(C1=O)N,0.1859
CC1CC=C(C)CO1,0.2624
N#CC12CN(C1)CC=C2,0.221
CC12CC1(O)CC1NC21,0.318
CN1C2CC(C=O)C12,0.2123
O=CCC12OC1C1CC21,0.2069
CC(O)CC1NC1C#N,0.2621
CC12OC1C1(O)COC21,0.295
COC(C#CC)C1CN1,0.2736
CC1COC(=N)OC1,0.2868
N#CC1=CCN2CC2C1,0.2003
OC1CCC2CC=CC12,0.2647
OC(CCC1CO1)C#C,0.2967
CC(C)(CC=O)NC=O,0.2169
CC1COC(=N)C=CN1,0.1946
Cc1c(c([nH]c1N)O)N,0.2342
C1NC11CC2NC12,0.3049
CN=C1NCC11OC1C,0.2412
COC(CO)C(C)C,0.3222
N=C1OCC=C1C#C,0.1938
O=CC1=CC2OC2CC1,0.1885
OC1CC(OC=N)C=C1,0.2503
C#CC12CC3C(C=C1)C23,0.2382
OC1CCC2OC(=N)C12,0.2867
C1CC2(CC2)OC1,0.3118
CC1=CC(NCC1)C#N,0.2437
O=C1C=CC(=O)C2OC12,0.1621
CC1NC1C1OCC1C,0.3102
CN1CC2(C)C(C#N)C12,0.2463
CCC1C2CC(C2)C1C,0.3729
c1cncc(c1O)F,0.2351
CC(O)(CNC=O)C#N,0.2663
C1COC2(C1=O)COC2,0.2104
c1c(nno1)OCCO,0.2041
CC1CC1C1CCO1,0.3253
CC(NCC=O)C(C)=O,0.2089
OC1C=CC2C3NC3C12,0.2495
C1C(CC1=O)CCC=O,0.2192
Cc1[nH]c(=O)cc(n1)O,0.1951
CC1CC2CC1(O)C2,0.3292
CC1CC2C3CC(=C1)C23,0.2189
CCCC1OC2CC12C,0.3112
CC1CCC1(CO)C#C,0.2965
c1cc(=O)[nH]c(c1N)O,0.1759
CC1CC11OCC11CN1,0.2919
C1CC23OC2COC3O1,0.3371
CC12CC(O1)(C=O)C=C2,0.2072
CCn1cncc1C=O,0.1892
CCC1COC(C)C1=O,0.2138
CC1CC(=O)C=C(C)C1,0.1895
CCCC(C)(OC)C=O,0.2128
CC#CC(CC=O)C#C,0.219
O=CC1=NCCN1,0.1639
CC12C(O)C1CC2C#N,0.2893
COCCC#CCOC,0.2849
OCCC12CC1OC2,0.3051
CC12OC3C1C(C#N)C23,0.2723
OC1C2OC(=N)C12C#N,0.2578
CC1CC(=O)OCC1=O,0.2231
CC12CC1C(CO)OC2,0.3321
CC#CC#CC1OC1C,0.2117
CCC1CC2(NC12)C=O,0.2167
O=C1CC=C2CCOC12,0.2137
CC(C)N1CC1CO,0.2876
Cn1c(cc(n1)O)N,0.242
CC1=C(CO)C2OC2C1,0.2338
C1CC1CCN2CC2,0.3207
Cn1c(nc(n1)O)C#N,0.1963
CC(C)C(C)C1CCC1,0.3614
OCC1NC1C1CN1,0.3003
CC1C2CC(O)(CO)C12,0.2977
C#Cc1c(c(c[nH]1)O)O,0.1933
C#CCN1CC2NC2C1,0.2565
CC12C3CC1CC=CC23,0.2455
OC1C2CC1(OC2)C#C,0.2572
CCC(C)(C)C1CC1,0.3497
CC1CC(C#N)N2CC12,0.2768
CC(=NO)CCCC#C,0.2528
CCCC(CO)C(C)O,0.3229
CC(C)C1(C)C2COC12,0.3075
OCC1OCC2CC12O,0.3131
CC1(C)NC(=O)C1O,0.2689
CCC12OC1C1OCC21,0.2971
CC12CC3(O)CC1(O)C23,0.3018
CC(C)OCC(O)C#N,0.2807
OCCC1CCOC1,0.3154
CC1(C)C(O)C2CCC12,0.307
OCC1C2CC=CCC12,0.2672
C1C2OC3C=CC1OC23,0.2333
C(C#N)N=COC(=O)N,0.2704
CCC(O)C(CC)CO,0.3301
COC(=O)CC1NC1C,0.2643
OCC1NC2(CC2)C1=O,0.2141
CNC=[NH+]C1=CN=N[N-]1,0.1347
CC1CC2CC12O,0.3251
CC(=O)C1=CCCC1,0.1945
OC1C2OC3CC2C1O3,0.3172
CC1(C)C2OCC=CC12,0.2406
CC12CC(C#C)C1(C)O2,0.2892
CC1COCC=C(C)C1,0.2476
O=CC1NC11C2CC1C2,0.2224
OC(CCN1CC1)C=O,0.199
COC(C#C)C(=O)C=O,0.1512
CCCCCOC(=O)N,0.3235
CN=C1CCN1C=O,0.2252
COC1CCCN2CC12,0.297
CC12CC3(CC1N23)C#N,0.2631
[NH3+]CC1=CC(=O)C=N[N-]1,0.1874
CC1(CC#N)NCC1O,0.2645
CC1NC11CC(CO)C1,0.31
CN1CC1C(=O)NC=O,0.1965
CCCN1C2C3CC2C13,0.2971
CC(=O)Nc1ccco1,0.1995
CCC12CCN1C2C#N,0.2632
NC(CNCCO)C#N,0.2774
O=C1NC2CC11CCC21,0.2538
CN1N=C(O)OC1=N,0.2378
CC1(CC(O)C#N)CN1,0.3014
CCC1C(C)OC1C#N,0.2787
COCC1C2CCOC12,0.3199
C1C2OC3C4C(C23)N14,0.2863
NC12C(O)C1OC2=N,0.2572
c1cn(c(=O)[nH]1)C(=N)N,0.2143
CCC1(CO)C2COC12,0.3023
c1c[nH]cc1N(=O)=O,0.1817
Cc1ccoc(=O)c1F,0.18
N#CC1(C#N)C2COC12,0.2621
OC(C#N)C1=COC=N1,0.2475
Cc1nc2n(n1)cno2,0.2324
CC1CN(C)C1=O,0.2787
N=C1NC=NC11CC1,0.2135
CC12CC34COC(C13)C24,0.3283
c1c(nc(o1)N)C2CC2,0.2335
C1CN1C1CC2OC12,0.3005
C1CCC2(C1)CCC=C2,0.2614
NC(=[NH2+])C1=C([O-])OC=C1,0.1656
OC1C2C3CC1CC2O3,0.3005
CC1C2NC(C1C)C2=O,0.2366
CC12C=CCN1C2C=O,0.1999
CC12CC1CCC1CC21,0.3174
CC1OC(C)C(=O)O1,0.2732
OCCC(O)C1CC1O,0.3245
OC1C2C3C1C2(O)C3=O,0.2442
CC1(CO)CN1C1CC1,0.3017
N#CC12NC3CC1OC23,0.2558
CCC1CC2C(C)C12,0.3286
CC1CCC(CO)C1C,0.3262
OC1CC2C1C1CN21,0.2891
OCC12C3C1C1C3OC21,0.3186
CC12C3CC1C(=O)C2O3,0.1997
C#CC#Cc1ncco1,0.1709
CNC1C(C)COC1=O,0.2445
COC(C)C(C#C)C#C,0.2858
CC1COC(=N)C=C1N,0.2013
N=C1OCCC1=O,0.1893
C1OC=NC2C3NC2C13,0.2542
c1cncc2c1CCO2,0.2027
CCCC12CC(C)C1O2,0.3294
Cc1ccc(n1C)CO,0.2255
OC1(CC1C1CN1)C#C,0.2623
N#CC1C2C3CN3C12,0.2584
CCC1OC(=O)C11CO1,0.257
O=C1NCC2CCC1O2,0.2587
CN=c1cc[nH]cc1O,0.1757
CC1CC(C)C=C(C)C1,0.2588
N#CC1OCC11COC1,0.2559
CCCCC(=O)C1CO1,0.2238
OC1C(=O)CCC11CO1,0.2187
O=CN1C2CC3CC1C23,0.2554
CCOc1[nH]c(=O)on1,0.2709
OC1CC(O)C1C1CC1,0.3094
N=C1OC2(CC2)C1C#C,0.2742
CC1CC1[NH2+]CC([O-])=O,0.2676
C#CC1CCC2CC1O2,0.2913
c1[nH]c2c(n1)CN=CO2,0.2102
OC(CC#N)C(O)C#N,0.3127
CC12CN3C4C1C4C23C,0.2964
CC(CNC=O)OC=N,0.2752
CCC#CC(CC)C=O,0.2161
CCOCc1ncco1,0.2406
CC(CO)C(C)(O)CO,0.3169
CC(O)C(O)(C=O)C=O,0.1971
CC12CC(C1)C=CC=C2,0.1806
C1C=CC(O1)(CO)CO,0.2517
C#CC(=O)n1ccnn1,0.1902
C1CC1OCC2(CC2)O,0.3297
CC12CC1OC21CCC1,0.3029
O=CC#CC(C=O)C#C,0.191
C1OC2C1OC21COC1,0.2975
CCC12CC1C=CC2,0.2477
C1C2OC3=C(NN=N3)C12,0.212
Cc1c(n[nH]n1)N(C)C,0.212
C1C2N1CC1=NON=C21,0.2096
C1C(=NO)COC(=N1)N,0.2226
NC1=NC2(CC2)C2OC12,0.2331
O=CC1CCC11COC1,0.2212
Cc1cc([nH]n1)CC#N,0.2602
CC(C)CCC(=O)CO,0.2416
OC1CC2C1C21CCO1,0.2975
c1cncc(=O)nc1,0.1633
[NH3+]CC(=O)[N-]CC#N,0.2739
O=CC1N2CC1(C2)C#N,0.2132
CC1CC1(C=O)C1CC1,0.223
CC1C(O)CC11CCO1,0.3026
CCC(C)(C#N)C#CC,0.2847
O=C1C2NC1C2CC#C,0.2461
CC(C)([NH3+])C1=NC=N[N-]1,0.2716
CCC12CCC1C1NC21,0.301
OC1(CC=CC1)C1CC1,0.2658
COC1C(C)OC1=N,0.2705
c1ccc2c(c1)c[nH]n2,0.1738
CC([NH3+])CC(O)C([O-])=O,0.2747
COC1C=CCCC1=O,0.2069
CC(COC1CC1)C#C,0.3054
CN(C)C(C)(C=O)C#C,0.1735
CC12OCC1=CC1CC21,0.2308
c1c(c(c[nH]1)O)CC#N,0.2397
CC(C)(O)C(=O)OC=N,0.2511
CCCCC(C#C)C#N,0.2983
CC1=CCC(OC1)C#C,0.2597
CCC12C3C4C(C13)C24C,0.2938
O=CCC1C2C3CN2C13,0.2135
CCCC1(C)CN1C=O,0.2532
O=CCC1(CC#N)CN1,0.2178
O=C1NC=CCC11CN1,0.2098
O=C1OC2(CC2)C1C#N,0.2769
CC1C2COC(C)C1O2,0.3073
NC1=NCC2N=COC12,0.2486
CC(CC([O-])=O)NC=[NH2+],0.2436
CC1OCC2(CCC2)O1,0.3284
Cn1ccn(c1=O)C,0.2238
C1CC2(CCC=C2)CO1,0.2578
N=C1OC2CC2C2NC12,0.2595
CC(O)(CO)CNC=O,0.2828
O=C1COC=NC2CC12,0.2146
CC#CCC(O)CO,0.2982
CCC1CC1C1CC1C,0.3277
N=C1OC23CC4C2NC134,0.2244
CC(O)CCC(O)C#C,0.296
CC(=O)NC(C)(C)C#C,0.2707
CC1C2CCC=CCC12,0.2607
CC1CCC2(CC12)C#C,0.2872
[O-]C(=O)C12CC1[NH+]=CN2,0.2396
CCC(O)C(CC)OC,0.3208
C1CC2(OC12)C1COC1,0.3246
CCC1(CC(C)C)CO1,0.3402
O=C1CC(CN1)N1CC1,0.2742
NC1C2NC1(C#N)C2N,0.2471
COC1C2OCCC12O,0.2892
CC1N2C3CC2C13O,0.3106
CC(CO)C(C)(C)C#C,0.3172
N=COCC#CC1CC1,0.2694
CN1CC2CN2C(=O)C1,0.2256
CCc1c(cno1)C#N,0.2288
c1cn2c(n1)CCC2=O,0.2032
CC1CNC(=O)N(C)C1,0.2833
OC1=C(OC=N)N=CN1,0.2183
OCC1C2CCOC12,0.3199
C1OC11CC2COCC12,0.3123
N#CCC1C2C3CC1N23,0.2871
CC1CC(C)C2(CC2)C1,0.3412
Cc1ncc(o1)NC=N,0.2341
CN1CC1CC(C)=NO,0.2397
CC1COCC1C(C)=O,0.2226
ON=C1C2NC1C=C2,0.2179
CC(O)CC(CO)CO,0.3028
c1nc2c(o1)CCC2=O,0.2087
CC1C2CCC(O2)C1=O,0.2133
C1CCOCC(=O)NC1,0.2504
CC12CC3C1CC1C2N31,0.3232
OCC1C2CC3CN3C12,0.2913
CC(=O)C1NCC2OC12,0.2157
CC(O)C(C#N)C(C)=O,0.2303
C1CC(O1)C1COC=N1,0.2621
CC12CC(O1)C=CC2=O,0.1703
CC(C)C12OC1C1OC21,0.2923
CC#CC1OC11COC1,0.2663
CC1C2CCOC12C#C,0.267
O=C1COC2(CC12)C#C,0.2081
CC12C3OC1CC(O)C23,0.3019
C1OC2CC3CC12C=C3,0.2456
CCN(C=N)C(=O)C#N,0.2063
O=C1N2CC2C11CO1,0.2188
CCC1(CC1C=O)C#C,0.2164
CN1CC2(O)CC12C=O,0.1991
CCOCC1OC1CC,0.338
CC1CC(=O)C2C1N2C,0.2061
CCC1OC11CC=CC1,0.2678
CCC1(CC#C)CC1O,0.3059
CN1CC1C(=O)CC#C,0.2027
CC1(C)C(O)CCC1O,0.323
CC1C2NC2C(=O)C1C,0.2122
CC1CCN(C1)C(N)=O,0.2901
C(C(=N)NC=O)NC=O,0.2267
CC1CCC(O)C1C,0.3265
COCCC(C#C)C#C,0.2874
O=C1CC2=CCN3C1C23,0.1933
ON=C1CCC(O)CC1,0.2517
N=C1CC2=C(OC=N2)O1,0.2165
CCC(C#N)(C#N)OC,0.2856
N#CC1C2NC1C21NC1,0.2828
O=C1C2CN2C1CC#N,0.2182
C1C2C3OC4CC13C2O4,0.3344
CC1(O)CC2NC12,0.3049
CC12CC3NC1C3O2,0.3084
CC(=N)OC(=O)C#C,0.2331
OC1=NC(F)=COC1=N,0.1583
O=CC1CC(=O)N2CC12,0.2206
CN=COC1CNC1=O,0.2521
OCC(C#C)C1(O)CC1,0.2835
Cc1c(n[nH]n1)CC=O,0.2146
CC1OC1C(=O)C#N,0.1974
CN=C1ON=NC=C1C,0.1588
C#Cc1c(cn[nH]1)C=O,0.1895
CC(C)c1cc([nH]n1)O,0.2583
CC1NCCOC1C#N,0.2628
CCCCCC(O)C=O,0.2354
CCN(CC)C(=N)C#N,0.1965
COCC1CNC1C#N,0.263
COCC1(C)CC2NC12,0.3127
COC1C2NC2C1C#N,0.2752
c1cc(cc(c1)O)C#N,0.1941
OC1C(O)C11CCC=C1,0.2371
c1coc2c1cco2,0.2243
CC(N)C1(CN1)C#N,0.2902
Cc1ncc(o1)C(=N)N,0.1985
OCC1CCC(N1)C#N,0.27
CC1(C)C2CC2C2CC12,0.3235
CC(=O)c1c(cc[nH]1)N,0.1671
OCC1OC2COC1C2,0.3306
[O-]C(=O)C1C[NH2+]CCO1,0.1456
Cc1ccn(c1)C2CC2,0.2431
CC(C)(C)C(=O)N,0.2747
CCCC1OC(C)C1O,0.3023
c1c(c([nH]c1O)N)C#N,0.1981
OC1CC2C3CC1C23O,0.3094
c1c(=O)oc(c(n1)F)N,0.1429
CN1CCOC(C1)C#N,0.2508
C1C2OCC3=CCN1C23,0.2163
CC1CC2(OCC12)C=O,0.2066
CC12C3CC1C(=N)OC23,0.2685
O=CC12NCC1C2C#N,0.1888
CCCC(=O)C(C)(C)C,0.2288
OC1C2CC(OC=N)C12,0.2663
C1CC2CCCC=C2C1,0.251
CC1CC11CCN=CO1,0.2667
COC1C2OC1C2(C)O,0.3177
CC1C2C(N2C)C11CO1,0.3039
CC12NC1C(N)C2C#N,0.2676
COCC1NC1(C)C,0.3185
COC(=O)C1CC1O,0.2472
CC1OC2C(O1)C2C=O,0.2177
OCC1C2CC(C2)C1O,0.3102
CC(CC#C)(CO)CO,0.2973
COC=NC(C)CC#C,0.2641
C#CCNc1conn1,0.1942
c1c(=O)ocnc(=O)n1,0.1808
CCC1(C)CN2CC12C,0.3012
O=C1NCC11CN=CO1,0.2555
CC(OC=O)C#N,0.2782
COC1(C)C2CC1N2C,0.304
CC1CC(CC#C)O1,0.2956
C1C2C3C4C3N3C4C1C23,0.2927
CC1C2NC(=N)C(=O)C12,0.1765
CCC(O)C1C(C)C1C,0.3248
N=C1OC2C3C4C3C1C24,0.2744
OC1C2CCC1C2C=O,0.2249
CCNc1cc(no1)O,0.2344
CC12CC(C1)(C2)OC=O,0.2787
CCCC(=NO)C#C,0.2097
CCC1OCC1C1CC1,0.326
N=C1CC2=C(NN=N2)N1,0.2164
OC1C(=O)C2OC12C=O,0.1807
OC1CC1CC1CCC1,0.3322
O=CC12CC1(CO2)C#C,0.2056
CN=CN1CCCC1=O,0.2272
CCCC1CCCC=C1,0.2642
COC1CCC2(CC2)C1,0.328
CC1(CO1)C1(CO)CN1,0.3159
NC(=O)N1C2COCC12,0.2902
COCCCC#CC#N,0.2311
C1CC23CC4C5C(N25)C134,0.2589
CC1CC2COC2CO1,0.3191
c1c(nc([nH]1)N)C(=O)N,0.2121
COCCOC(C)C#C,0.2893
C1OC2C3OC3C2O1,0.2993
CNC(=O)C(O)C#N,0.276
CC1C=CCC2CC12,0.2636
CCc1cncc(n1)O,0.1979
CC(C)OCC(N)C#N,0.2916
CC#CC1COC1(C)C,0.2869
OC1C2OC2CC11CO1,0.3143
COCC1(C)CN1,0.316
Cc1cnc(cc1N)F,0.2231
CC(=O)C12CC=CC1O2,0.2193
OC1(CC#C)C2CCC12,0.2895
CCCC1C(O)C2CN12,0.2919
OC1COC1C1(O)CC1,0.3196
c1c(nc2n1nno2)N,0.1593
C1CN1C1CCCOC1,0.3217
ON=C1C2CC1COC2,0.2481
C1C2OC11C=CC3C2C13,0.1564
CCn1ccnc1C=O,0.1842
CC1CC2(CCO2)C=C1,0.2496
CCC1OC2(CC2)C1C,0.3053
CC12C3C4C3N(C14)C2=O,0.2254
CC(O)CCC(C)(C)O,0.3252
CCOC12CC(C1)C2C,0.3436
OC12CC(=O)C1OCC2,0.1946
CC(=O)C1NC1CC#C,0.2217
CC12CC(C1)COC=N2,0.2695
CN1C2C3CC(=O)C1C23,0.1928
CC1CC1(O)CCC=O,0.2273
CN1CC2(C)OC2C1=O,0.2488
CC1C2C3C4N2C1C34C,0.2981
CC(CCO)C(C)C#C,0.3142
CC1CC(O)C1(O)CO,0.3052
OCC1(CC[NH2+]1)C([O-])=O,0.2545
CCC1C(C)C1(C)OC,0.3124
NC1CC1(OC=N)C#N,0.2244
NC1C=CCNC1C#N,0.2415
OC1CC11C2NC2C1O,0.3078
COC1CC1(O)C(N)=O,0.2731
CC1OC(=N)C(=O)O1,0.2228
OC1C2COCC1O2,0.2923
CC#CC1CN1C,0.2611
COC(C)COC1CC1,0.3231
CC1(C#N)C2NCC12N,0.2613
CC12CC3C1C2C3(C)C,0.3308
OC1C(C#C)C1C1CC1,0.2764
CN1N=CC([O-])=C1C[NH3+],0.1314
CN1CC11CC2COC12,0.2851
c1cn(nn1)CCCO,0.2575
CC1=CC(C#N)C(=O)C1,0.2215
O=COC1C2CCC12,0.2719
C#CC12CCOC1CO2,0.2698
CC(C)CC1C(O)C1O,0.2812
CCC12CN3C(C13)C2C,0.3013
CC1C(O)C1C#N,0.2988
OC1C2C3C4C3C1OC24,0.3085
COCCOCCC#C,0.309
CC12CC1(CC=O)CO2,0.2059
CC#CCC1(C)CN1C,0.2765
O=CCC(C=O)C1CC1,0.2194
COC(=O)NC(=O)CO,0.2517
C(=O)NC(=N)NC(=O)N,0.216
CC1CC=CC1(O)C#C,0.2511
N=COC1OCCC=C1,0.2618
CC#CC1(C)OCC1=O,0.2086
NCC(OC(N)=O)C#N,0.2692
CC1C2CC2C2CC12C,0.3163
CC12CN3C1C1(CN1)C23,0.2945
OC1C2CCC3CC2C13,0.3115
CC(C)N1CC2OCC12,0.2834
CC1(C)CC(C=O)C=C1,0.2167
CC1N=C2NC3C2C13O,0.1794
N=C1OC2COC12C#C,0.2467
CC1OC(C)C1CC=O,0.2208
CC#CC12OC1CC2=O,0.2092
CC(C)CCC1(CC1)O,0.3249
COC1C(C)C=CC1O,0.2606
N=C1OCC1CCC#C,0.2801
COC(C)C(C)NC=O,0.2793
O=CNC(CC#C)C=O,0.21
COCC(C=O)N(C)C,0.1912
c1nc2c(o1)CCCO2,0.2158
CN=COCCC=O,0.2211
O=CC1NC11CC=CC1,0.2184
CC1CC11CC2OC12C,0.3281
CC1=NC2(CC2N1)C#N,0.2475
N#CC12CC3C4C3C1C24,0.2762
O=CC1CCCC11CO1,0.2265
CC12CCC1CCOC2,0.3217
CC12CCC3C1C=CC23,0.2311
OCC(=O)C1CC2CN12,0.213
CC(O)CCOC(C)=N,0.2929
CC1(CCOC=N1)C=O,0.2165
Cn1c(c([nH]c1=O)O)O,0.2144
Cn1ncc(n1)C=O,0.1988
COC(C)COCC#C,0.2838
CC1CC(C#C)C1C=O,0.2198
CC(C#C)(C#C)N=CN,0.2548
CC1(C(=O)CCO1)C,0.2161
C#CCCCCO,0.3149
COC1C2C1C1(C)CN21,0.2914
CC12C=CCC1OC=N2,0.2523
OCCC(=O)CC1CN1,0.2258
C1OC1C1COC1,0.3292
CC1CN2CC(C)(C2)O1,0.2882
CC(C)(C(=O)CC#C)O,0.2276
CC1(C)NCC(O)C1=O,0.1986
O=C1C2CN3C2CCC13,0.2042
OC12CC1C(C2)N1CC1,0.3054
OC1CC2CC3CC3C12,0.3166
CCC(O)C1OC1C#C,0.2774
CC1C2N(C=O)C1C2=O,0.233
CCC#CC1(CO1)C#N,0.2513
O=C1CC2CN3C2CC13,0.196
CCC1OCC1N1CC1,0.3169
OCC1C2COCOC12,0.3277
Cc1c2cc[nH]c2[nH]n1,0.2239
OCC(NC=[NH2+])C([O-])=O,0.1521
CCC1C(O)C2COC12,0.2949
Cc1cc([nH]n1)NC=O,0.2117
CC1(CC2(C1)CC2)O,0.324
O=C1CNCC2(CN2)C1,0.2141
CC1OC2C1N(C)C2=N,0.2482
C#CC(=O)COCCO,0.1734
COC(=N)C(C)CCO,0.2923
CC1(C)CC2(CO2)C1=O,0.2005
C(CNC(=N)C=O)CO,0.1704
C1C=CC(=O)CC1=O,0.1861
c1coc2c1nc([nH]2)O,0.2183
OC1CC2(C1)C1CN2C1,0.3055
C#CC1N=C2CC3C1N23,0.1919
CC1C2C3CC(C)(C3)N12,0.3007
C1CN(C1)CC(=O)N,0.2637
C[C-]1OC(=[NH2+])C=CC1=O,0.1083
CC1NCC(=O)C1O,0.1999
OCC(CC#N)C1CC1,0.2895
CC1C2NC1(C=O)C2=O,0.2087
CC(=O)OC1CC1C#N,0.2817
CC12C3CC1CCC2C3,0.3336
CCC#CCC(O)C=O,0.2136
OC(CC(=O)C#C)C#N,0.2076
CC12CC(C=CC1)C2=O,0.217
CCC12CC1N=COC2,0.2488
COCC(O)C1CC1C,0.3247
NC(=O)C1OC2CC12O,0.2423
CC12CCCCC1CO2,0.3171
CCNC1=NC(C)CO1,0.273
CNc1c(ocn1)C#N,0.1805
CCCC1(O)CCC=C1,0.2631
NC1(C#N)C(O)CC1O,0.2888
c1cnc(nc1F)C=O,0.1762
CC1CC2C3CN3C2=N1,0.2351
Cc1c(=O)ncncn1,0.1622
N=COC1=CC=NC=C1,0.2337
c1c(c[nH]c1N)OC=O,0.2114
CC(O)COC(C)C,0.3282
CC12CC3NC1C3(C)O2,0.3125
CCN=C1OC=NC=N1,0.1769
CC1(CC#C)CC(=O)O1,0.2819
C1CC1N2CCOC2=O,0.2972
c1c(onn1)CC(=O)N,0.2311
CC(N)(C#N)C(O)CO,0.3013
C1OC2C=CC=CCC12,0.1952
O=CCC1CCNC1=O,0.2224
CNC(=O)N1C2CC1C2,0.2776
OCCC1OCC2OC12,0.3382
CC1(C)C2NC2CC1=O,0.224
CC1=NC(=N)[NH+]=C(N)[N-]1,0.1943
C1C(=NO)CC12COC2,0.2464
O=CCN1C2CC1C2,0.2098
CCC1OC(=O)C1(C)N,0.2677
C(C1CO1)C1=CNC=N1,0.25
N1C2C1C1NC21,0.2717
C(C=O)OCC#CC#N,0.2132
CC12CC(N1)C2(N)C#N,0.2717
CC1C2CN(C12)C(N)=O,0.2802
Cn1c(c(nn1)CO)O,0.2382
OC12CN3C1C2(O)C3=N,0.249
O=CC1CN1C(=O)C#N,0.2041
CC1CN=CN1CC#N,0.2353
CC1=CC(O)C(=N)OC1,0.2539
OCC1CN2CC2C1=O,0.2123
CC12CC3C(N1)C23C#N,0.2597
Cc1c(nc(o1)C=O)N,0.148
COC1C2NC(=O)C12C,0.2493
c1c(oc(c1N)N)C=O,0.1616
CNc1[nH]c(c(n1)N)O,0.2288
CC1OC11COCC=C1,0.246
c1c(ncnn1)C=O,0.1386
Cc1c(nc[nH]1)C2CC2,0.2345
OCC12C3NC1C1C3N21,0.2853
CC1(O)CCOC1C#C,0.2737
NC=[NH+]CC1=N[N-]N=N1,0.1478
CC1(CCC1)C#N,0.3361
CCCC1C2C(O)CN12,0.2876
c1nc(c(o1)N)CC#N,0.2185
C1C2OC2C11COC=N1,0.2581
OC12CC1C(=CC2)C#N,0.2082
Cc1cc(oc1C)CO,0.2251
CNC(C)C1=NNC=N1,0.219
CC(=O)CCCC1CO1,0.2344
CC1OCCCC1(C)O,0.3161
CCN=C1OCC1NC,0.2543
CC1C2OC1(C)C21CC1,0.3165
CC1OC1C1CCC1C,0.3364
CCN1CC1C(O)C#C,0.2562
OC1CC1(OC=N)C=O,0.2126
CC1C(O)CCC1O,0.3227
OC1CC2=CCOC12,0.2331
CC(C)C(=N)OC1CC1,0.294
C#CC1CCC=CCO1,0.2618
O=CC12CC(C1)(C2)C#C,0.2192
CC#CC1C2OCC12O,0.2718
CC1(COC(=O)C1)C#C,0.272
NCC1(NC1C#C)C#N,0.2453
CCC(CC=O)C(C)C,0.2282
N=C1CC=C(CO1)C#C,0.2088
ON=C1C2COC1CN2,0.2324
Cc1cc(n[nH]1)OC,0.2426
ON=C1C=CN2CCC12,0.1746
CCC(C)(O)C(=O)CO,0.236
c1cnc(nc1)C2CC2,0.2094
c1cnn2c1CCC2,0.2611
CCC(CO)C1CN1C,0.2866
CC1C(C)C2=NC=CN12,0.2549
C1CC1C1(CN1)C1CN1,0.2964
N=C1C=CC(=O)N1C=O,0.1609
c1cncnc1CC#N,0.2116
C1NC11C2COCC1O2,0.3088
CC12CC1C1NC2C1=O,0.2405
CC(OC=N)(C=O)C#N,0.2181
CC1OC(=O)C(=O)O1,0.2104
c1nc([nH]n1)CC#N,0.2705
CC1C(O)C1(C=O)C#C,0.1992
O=CCCC1(CN1)C#C,0.2261
CCC1OC=NC1C,0.2692
CC1(O)CCCC1C#N,0.3171
CC1COCC1C#N,0.3017
O1C=NC=CN=CN=C1,0.1791
COC1C(C)CNC1=O,0.2498
C(C=O)n1c(=O)[nH]nn1,0.2112
CCOCC12CC(C1)C2,0.34
N=C1NC2C(OC12)C#C,0.2432
CCC(=O)C1(CC1)CO,0.2323
C#CCNC(=O)N,0.289
CC#CC(=O)NC(=O)C,0.2011
CCC1CC1C#C,0.291
[O-]C(=O)C1[NH2+]CC11CN1,0.2597
CN1CC1C1CN1C,0.304
CNC(C#N)C#CC#N,0.2103
CC1CNC(=N1)C(N)=O,0.1956
CC12CCC3C1N3CC2,0.2993
COC1(C)CC2(CO2)C1,0.3268
CC(O)C#CCOC=O,0.2701
COC1OCC2COC12,0.3148
CC1COCOC1C=O,0.2238
NC1=NC(=O)OC(=N)N1,0.2351
C(CC#CCO)CO,0.2789
CC1C2C3CC2C(O)C13,0.3325
CC1(CC(=N)O1)C#C,0.2795
CC1C2NC2(C)C11CO1,0.3292
CC#CC(C)CC#C,0.2899
CC(=O)C(C)(O)C=O,0.1971
NC1=NC(F)=NC(=N)N1,0.204
CC1(C)OC11CNC1=O,0.2592
CC(=O)CC#CC1CN1,0.2123
CC1OC(=N)N(C)C1=O,0.2506
CNC(=O)CC(O)CO,0.2716
COC12CC1(NC2)C#N,0.2293
CC1(O)CC(CO)C1=O,0.2016
CC1CC(O1)C(O)CO,0.3042
C(CO)N(C=O)C=O,0.2157
CC1C2COC12C1CN1,0.2908
CC1CC1(C=O)C1CO1,0.2194
CC(CO)C1(CC1)C=O,0.227
C1C=CC2N3C=NCC123,0.2188
CC1(O)CC=CC1=NO,0.1947
Cn1c(ccn1)OC,0.2515
C#CC12CN3CC(N1)C23,0.2304
CC12OC1CC2(C)O,0.3178
OC1CC2C3C1CC23O,0.3225
CC(C)C1CC(C)(O)C1,0.3256
OC1C=CCCC1C#C,0.2594
CCC1=CC=COC1=N,0.1673
OCC1CC2CC(O)C12,0.3149
C#CCCC12CC1CO2,0.2929
OCC1=NC2C(O)C2O1,0.2602
C1C(=O)CC12COCO2,0.2158
CC12CC=CC1C2CO,0.2437
CC(=O)C1C2CN1C2,0.2186
OCC12C3OC1C=CC23,0.2241
OCC1(CN1C=O)C=O,0.2043
Cc1cc(ncn1)CO,0.2146
OC1C(=O)C2NCC12O,0.193
c1c(c(c[nH]1)OC=O)N,0.2016
CN1C2C1C1(CO1)C2=O,0.1985
CCC#CC(=O)NC=O,0.2012
CC(=O)C12CC1(C)CO2,0.2178
Cc1ccc(o1)OC,0.224
[O-]C1=COC2=C1C[NH2+]C2,0.0955
CC1NC11C=CCC1=O,0.2132
OCCC1NC2COC12,0.299
OC1CC=CC(=O)C1O,0.182
COC1C2OCC12C=O,0.2171
CC12CC1CCCCO2,0.318
CCC1(O)CC1CC#C,0.3075
N#CC1CC11OC2CC12,0.2797
C1CC1C12OC3C1OC23,0.2926
C1C2CC3C=CCC2C13,0.2585
CC1=C([O-])C(C[NH3+])=CO1,0.2139
CCC(O)CC(C)=NO,0.2563
N=COCC1CN1C=O,0.2481
OC1C2CC2C11CN1,0.3056
CC#CC1CCCC1,0.3019
CC1OC(=O)CC2NC12,0.2731
Cc1coc(=O)cc1N,0.1831
C1C2COC3CC2C13,0.3229
CC(CC(N)=O)NC=O,0.2502
CC12CCC(O1)C2(C)O,0.3106
Cc1c2c(nc[nH]2)on1,0.2121
C#CCC12OC3C1CC23,0.2829
O=CC1COC(C=O)=N1,0.1793
CC1C2C1C1C2C1(C)O,0.2702
CCNC1=CC(=O)CC1,0.2084
OCC(O)C#CC1CC1,0.2708
c1c([nH]nc1NC=N)N,0.2151
CC1C2C=CC(C)(C)C12,0.2455
CC1NC=CC(=O)C1O,0.1839
CCCC1CCCC1=O,0.2189
O=C1C2OC2C2OCC12,0.2038
NC(=N)C(=O)C1CN1,0.187
CCC(CO)C(C)=NO,0.2552
CC#CC1=CCC(=O)N1,0.1837
N#CC1NCC=C1C#N,0.206
O=CCC12CC(C1)C2,0.2263
CCC(N)(C#C)C#N,0.2702
CC12CC1(O)CN2C=O,0.2538
CC1OCC(C)(C)C1O,0.3045
CC12CCC(O1)C(=N)O2,0.2859
Cc1c(nc(o1)O)O,0.2297
N#CC1C2C3CC3N12,0.2456
CC1C(C)C2(CO2)C1C,0.3239
CC1(O)CC2C1OC2=N,0.2847
N=COC1(CNC1)C=O,0.1858
COC1CCCC1C#C,0.2959
CC(O)C1(C)OC1C,0.3215
C1CC23OC4C2C(=C1)C34,0.2004
Cn1cnc2c1CCC2,0.2371
c1c(c(c(o1)N)O)C=O,0.1758
CC1C2OC2C=C1CO,0.2399
CCC(O)C1CC(=O)C1,0.2224
CCC(C)(CO)C(C)O,0.3157
CCCC1C2C3OC2C13,0.3055
C1COCc2c1onn2,0.2224
CC1=CCC(C1)C#N,0.2607
c1nnc2n1c(no2)N,0.2216
COCC1(C)CC1C#N,0.2932
COC1CC2COC1O2,0.3218
COC1C(O)CC1O,0.3034
CC1=CCCC2(C1)CC2,0.2622
CCn1c(ncn1)C=O,0.1978
CC1C2OC=NCC12O,0.2581
CCCOc1n[nH]nn1,0.2297
C1C2N1C1(CC1)C21CO1,0.3115
CC1(CC1)CN(C)C=O,0.2684
c1c(c(no1)O)C2CC2,0.2459
CCN1C=CC(O)C1=O,0.1964
COC12C3C1N1CC3C21,0.2964
CC1CC1(C)C(O)C=O,0.2192
O=CC12CC(CC1)C2=O,0.2052
C#CC1C2C3CC(C3)N12,0.2526
N=C1OC(=O)C2CC1O2,0.2404
CCC1CC(C1)C1CC1,0.3488
CN1C(CO)C11CCC1,0.2851
C1CC=CC2OC2C1,0.2556
O=CN1C2CC(=O)C12,0.2177
CC(O)C(=O)OC=N,0.2418
CCN=C(C)NC(=O)C,0.2347
Cn1ncc(n1)OC=O,0.2367
COC12COC1C2(C)C,0.2941
CC12C3CCC1COC23,0.3117
C#CC1C2CC2C2CN12,0.2697
CC1=CCCOC1C=O,0.2131
CN1C2C3CC1C23C=O,0.2036
CCC1CCCO1,0.3243
CCC12CC1C1(C)CN21,0.2915
CC(C)C12OC1CC2C,0.3213
CCC12OC1C(O)C2=O,0.2026
OCC12OC1CN1CC21,0.2835
OCC12OC1CCC2=O,0.2079
CC1NC(C)(CO)C1=O,0.2077
CC12OC3C1COCC23,0.3087
CC1OC2CC(=O)C12C,0.2155
OC1C2OCC(C#C)C12,0.2795
C1CC(=O)NC=C1,0.2141
CN=C1CC(O)C(C)O1,0.2739
CCC12CC1(CC)OC2,0.3009
CN1C(=O)CC(O)C1=O,0.2366
NC12CC(C1)C2(N)C#N,0.2798
OCC1C2C3OC1OC23,0.3127
[NH3+]CC1(CCO1)C([O-])=O,0.2537
C1C2OC2C2=NON=C12,0.2407
N=COC1(COC1)C=O,0.209
CN1C2C3CC3(C#N)C12,0.269
COCC(=O)C1(C)CN1,0.2187
CC(O)C1=CN=C(C)O1,0.2367
CC12CC=CC1(C)C2O,0.2453
CC12N=COCC1C2O,0.2413
CC1COC2C(O)C12O,0.2955
CC1C(C#N)C1(C)C,0.3093
O=CC12COC1CCC2,0.2242
CC1CC2C3C2C(=O)C13,0.2336
CCCOc1ccoc1,0.2336
CC1(C)C2CC(O2)C1O,0.3197
CCC1COC(=O)C1=O,0.1699
CNC(=N)C(=O)C#N,0.135
CC12CC3(C1)OC(=N)C23,0.27
O=C1OC23COC2C1C3,0.2601
OCCC1(CO1)C#C,0.2842
CC1COC1C(N)C#N,0.2864
OCCC1CC2CCC12,0.3396
CC1=COC(=N)C(=O)N1,0.1777
CC(C)C1COC11CC1,0.3024
C1CC1(CO)C#CCO,0.2732
CN=c1c(ncn[nH]1)N,0.172
N=COC1C2CC1CC2,0.2779
CC(C)n1ccc(c1)N,0.2253
O=CC1OC2C3NC2C13,0.209
OC1C2C3CC3C(=O)C12,0.2142
c1(nc(oc(=O)n1)O)N,0.2314
CC(=O)C(O)C1(C)CN1,0.218
O=C1OCOC1CC#N,0.2722
CC1OCC1(N)C(N)=O,0.2584
CC1N2CC2C2CC12C,0.299
CC1NCC(=O)NC1C,0.2647
CC1CCCCOC=N1,0.2603
C1C=CC2COCCC12,0.2581
N#CC1C2CC3(CC3)C12,0.2998
Cc1c(non1)N,0.2211
OC12CC3C4C3C1OC24,0.3026
C#CC1CCNC1C#N,0.2665
C1CC1C2CN(C2)C=O,0.2656
Cc1cc(n(c1)C)C=O,0.1791
CC(C)([NH+]=CN)C([O-])=O,0.2442
O=C1NC2C3C4C2C1N34,0.2458
C[NH+]=C(N)CC([O-])=O,0.2396
COc1c(non1)C#N,0.2089
N=C1OC2CN3CCC123,0.2381
CC(C)(CCC=O)C=O,0.2168
CC12CC3C(O1)C2C3=O,0.2184
Cc1c(cc(=O)on1)F,0.1865
CC(O)CC(O)C1CO1,0.3218
Cc1c2c(co1)ocn2,0.1887
CC1CC11CCC=C1C,0.245
CNC(C#C)C(=O)C=O,0.1494
C1CC12C(=O)CN=CN2,0.198
CCC(=O)C(C)OC,0.2297
COCCCC(=O)C#C,0.1988
CC1(CC1CO)C=O,0.2332
C#CC1NC1C1CN1,0.2632
CC12C3OC4C(C14)C23,0.3182
CC1NC1C(=O)C#C,0.1942
OCC1=CCCC(O)C1,0.2617
C#Cc1[nH]c(cn1)N,0.1891
OC12C3CC1OCC23,0.3006
Cc1coc2c1cn[nH]2,0.2267
OCC(C=O)(C#C)C#N,0.2083
CN1C(C#N)C1C(C)=O,0.2028
C1C2N1C13CC21OCC3,0.2573
CC#CC1CC1C(C)C,0.2821
OC12CCC3C1COC23,0.3092
CC1C2OCC=CC12C,0.2426
CCCOc1c[nH]nn1,0.2229
C1COc2c1c(n[nH]2)N,0.2505
C1CC(C1)CN2CC2,0.3198
CC1CC1(C)C(=O)C=O,0.1567
C(CO)C#CC#CCO,0.2137
OCCC1COC1C#C,0.2745
CC1OC(C=C1)C1CN1,0.2436
O=CC(NCC#C)C#C,0.1965
CC1C2C1C(C)CC2C,0.338
N=COC12CC1C1OC21,0.2606
CC1CCC=CC(=O)N1,0.2122
CCC(C)(C)CCC#N,0.3476
C1CC2OC2C2OC2C1,0.326
CC1NC2(CCC2)C1=O,0.2134
OC1CC(NC1=O)C=O,0.2147
COc1cnoc1CN,0.2085
OC1=COC=C1OC=N,0.1879
c1[nH]c2ncnn2n1,0.2431
O=CCC1OCC=C1,0.22
CN(C=N)C(=O)C(=O)N,0.1908
OCC1NC11CC=CC1,0.2618
CCC(O)C1=CC=NO1,0.2446
C1C(CN1)(C(F)(F)F)O,0.3029
COC(C)C(C)C=O,0.2266
OC1C2OC1C21CN1,0.31
CCCC1CCOC1=N,0.2842
CC1CC2CC3C2C13,0.3371
CC1C2CC(O)C=CC12,0.2491
CC12OC1C1C2NC1=O,0.2638
CC12NC1(C)C1(O)CC21,0.3143
CC([NH3+])C[C-](C#N)C#N,0.2656
CCC(OC)(C#C)C#N,0.2763
CC1=CCNC1(C)C#N,0.2376
CC1OCCC2CC2O1,0.3217
ON=C1CCC1CC#N,0.247
CC1=CC2OC1CC2O,0.2446
CC1C2C3N2CC13C#N,0.2674
OC12COC1CC21CO1,0.2997
CCC(C1CN1)C(C)=O,0.2209
CC1=NCC2C(O)C2O1,0.2766
CC1=C2CCN2C(=O)C1,0.2012
N#CCC1CC2CN1C2,0.2795
CC#CC1C(O)C1CO,0.2774
CC1=CN=C(N1)OC=N,0.2164
CC1CC2(C)COC2=N1,0.2617
CC1OCC1C#C,0.2888
O=CCC(C#C)N1CC1,0.2283
CC1C2OC2C1OC=N,0.2743
OC1CCCC1(O)C#C,0.2766
CC1OC(=O)NC1C=O,0.2147
CC1C(CCO)C1C#N,0.2788
CC1=NCC(O)CO1,0.2716
CC1CC2(C1)OC2(C)C,0.3258
Cc1c[nH]nc1O,0.2462
CC12CC(=O)C1C2C#N,0.2282
CC1CC11OC2COC12,0.2919
CC12C3C1N1C3CC21,0.3003
OCC1COC(=N1)C#C,0.2117
CN(C=O)C1C2CCC12,0.2641
CC1NC2C(=O)CC12O,0.2024
COC(C)C1=CN=NO1,0.2338
Cc1cnoc1,0.247
COC(CC#N)C1CO1,0.3069
CC1C2CCC11OCC21,0.3116
CN1CC(C1)OC=N,0.2463
C1C=CCOC(=O)N1,0.255
CCc1cc[nH]c1NC,0.2384
O=CC1C2OC1C2C#C,0.2082
CC1(CC=CC(=O)C1)C,0.1877
CC1C2N1C1COC21C,0.2852
CCCC(CC)CC#N,0.3463
CC(O)(CO)C#CC#N,0.2284
OC12CC3(CCC3C1)C2,0.3266
CC1N(CCO)CC1=O,0.2097
CC1COC(=N)C1C=O,0.2255
OC1CC1COCC#C,0.2863
CCCCOCCCC,0.3371
CCc1coc(=O)n1C,0.2336
CC#CC(O)CN1CC1,0.2699
CC1C(C)=CC(=O)C1=O,0.1408
O=C1NCCOC2CC12,0.2647
O=C1CC2(CC#N)CN12,0.2386
CC(=O)C(=O)C1CCO1,0.1487
CC(C)N(CCO)C=O,0.2591
CC1CCOC(=N1)C#C,0.2262
O=CNC12CC3C1CC23,0.2742
CCC1(O)C2C3OC1C23,0.2939
CCC(=O)CC1NC1C,0.2296
Cc1cnoc(=O)c1O,0.1812
CNC(=O)c1nnon1,0.1859
O=C1C2COC11CCC21,0.204
CN1C(=O)CN=C1OC,0.2413
c1cncc(c1O)N,0.2044
C#CC1C2CN2C1C#N,0.2603
C#CCCC(=NO)C#C,0.209
O=CCN1C2CC=CC12,0.2166
Cc1c([nH]c(n1)O)C#C,0.1994
CC(O)C(=N)OCC=O,0.213
CCC#CC(C)(C)C#N,0.282
CC1C2CC(CC#C)C12,0.3038
CC1OC(C)C1O,0.3035
CC1C2CC(O)C12C#C,0.2681
CC#CC(F)(F)F,0.3068
CC1=NC2CC2N1C=O,0.216
O=C1C=CCC2OCC12,0.1828
c1cn2c(n1)[nH]nc2O,0.2178
COC(=O)CCC#N,0.2866
CC1=NC(OC=N)=NN1,0.242
CC1C(O)C2CC12C,0.3137
C#CC12C3C4C3N1CC24,0.2415
C#CCN=C1COCO1,0.262
COC(C)C1CC1C#C,0.2886
COC1CC(=O)CC1C,0.22
C#CCC1(CCC1)C#N,0.2989
CC1OC2CC1(O)C2O,0.3053
O=CC1NC=NC1C#N,0.2028
CC1C=CC(C)C1(C)O,0.2661
N#CCC12OC3C1CC23,0.2717
CN1C2C3NC2(C#N)C13,0.2352
OCC1NC1C#N,0.2802
CCN=C1CC(O1)C#C,0.2624
CC1CC2OC1C2C=O,0.217
CCOCc1ccon1,0.2518
c1c([nH]c(c1N)O)C#N,0.1933
CC1C2OC2C2CC12O,0.3241
Cc1coc(=NC)n1C,0.2158
OC1CN(C=O)C1C=O,0.1989
COCC1C2CN2C1=O,0.2345
CC(O)C1OC=NC1C,0.2682
CC1CCC1(O)C1CN1,0.2931
c1cc-2cncc2oc1,0.122
N#CC1CCC=CCO1,0.2613
CCCOC(C=O)C#N,0.2228
CC1OC2(CNC12)C=O,0.1941
Cc1c(onn1)N(C)C,0.1993
N=C1CC(C=O)=CCO1,0.1923
CC1(CO)NC1C#C,0.2772
CC1CNC(=O)CCO1,0.2663
O=CC1CCC2NC12,0.2176
CCC1=CCC2C(O)C12,0.2354
CC1C2C3N2C1C31CC1,0.3048
CC(=O)C12CC1C(=N)O2,0.2183
CC1(CCNCC1=O)C,0.2093
CCCC(C)N=COC,0.2706
N=C1COCC(N1)C#N,0.2549
CC12CC(C1)COC2=O,0.2767
CN1CC(C1)(CCO)O,0.298
C1CC(C1)C1C2CC1O2,0.3166
CC1C2NC2C(=O)C1O,0.1998
CC1CC(C#N)N1C,0.2567
O=CN1CCC2OC2C1,0.2709
NC(=O)C1CNC(=O)N1,0.2589
C1CC1C12CC3C1N3C2,0.3111
CCC1C(C#C)C1(C)C,0.2862
OC1CCC(O)C(O)C1,0.311
CC(=O)C1OCC(=O)O1,0.2197
CC12OC1(CC2=O)C#C,0.2086
CN=c1ncocn1,0.2045
C1C2CC=C3CN1C23,0.2037
C1CC1(CCC#N)CO,0.3175
CCC1(CO)CC1(C)C,0.3264
CC#CC1NC1C1CC1,0.2742
C1CC=CC(=O)C(=O)C1,0.1525
c1c(c([nH]n1)O)O,0.2418
C#CCC(C#N)(C#N)O,0.2707
CCC1(N)C(N)C1C#N,0.2648
CCOC(=O)C1CCO1,0.2436
C1OC2C=CC1C1NC21,0.2407
COC(CO)CC(C)O,0.3118
NC(=O)C1CCC11CO1,0.2727
CCCOC(=NC)C,0.2783
CC#CC1(CC1)NC=O,0.2598
O=C(C1CO1)N1CC1,0.2389
COC(C)C1NC1(C)C,0.3116
OC1CC1CC(F)(F)F,0.3397
CC1C(C=O)C2OC12C,0.213
NC1=CC=C(O)OC1=N,0.154
CC1(C)CC2CC2CO1,0.3197
CC1NC1(C=O)C(N)=O,0.2178
CC1C=CCC(O)C1=O,0.2102
OCCCC1COC1=N,0.2854
COC(=O)CC(C)C#N,0.2857
CC(=N)OCC(C)(C)O,0.294
OC(C#C)C1CC1C#C,0.2754
C1OC2CC1C=CC=C2,0.183
CCC1(O)CC1C,0.3231
C1COC2(C1)CC=CC2,0.2632
OC1(CC1)C#CC1CO1,0.2602
[O-]N=C(CC#C)C1C[NH2+]1,0.1183
CC(C)(O)C1(CO1)C#C,0.2782
CCC1C2OC(=N)OC12,0.3005
OCC1=CC(=O)C(O)C1,0.194
CCOC(C)C(N)=O,0.2742
OC1COC2C1OC2=O,0.2518
OCC1(COC1)C1CO1,0.3009
C1C2NC3=C(NC=C3)C12,0.2113
CC1=CC2(CC1O2)C#C,0.2326
OC1CC1C#CCC#N,0.2641
OC12C3C4C3C1N1C4C21,0.2821
C1C(=O)COC12COC2,0.2165
c1(c(noc(=O)n1)F)F,0.1882
OC1C2C3NC3C1C2O,0.303
CCOC1C2OC1C2C,0.3149
CCCCCCOC,0.3386
COC1C2OC(C#C)C12,0.2525
CC12CC(O1)C2C=O,0.2052
Cc1c(n[nH]n1)N=CN,0.1983
N#CCCN1C2CCC12,0.2884
CC(O)C1(CO1)C(C)=O,0.2215
CC1CCCNC1C#N,0.2633
CC12NC1CC(O)C2=O,0.1995
CC1(CC([NH3+])C1)C([O-])=O,0.1199
CC(=O)C(CO)C#C,0.2191
NC(=O)CC1CN1,0.2735
CC(C)C1OC1C,0.3428
CC1=CC2C(C1)OC2=O,0.2428
COCC1CC2(C)CC12,0.3333
OC1C=CC2OC1C=C2,0.2162
Cc1[nH]c(c(n1)OC)O,0.2121
C1C2COCOC=NC12,0.2376
CC1=NOC2=C1N=NO2,0.1533
CC1C(C)C11CC(=O)C1,0.2213
OCC1CC2CCC2O1,0.3144
CC(=O)C(=NCC#N)N,0.1946
O=C1N2CC3C2C13C#C,0.237
CCCc1cnno1,0.2339
COC1C2CCC12O,0.3191
C(C1C2CC1O2)N1CC1,0.3144
COC1CN=C(C)O1,0.2792
COC(=O)N1CCC1=O,0.2478
CC#CC1CC1(C)C#N,0.2619
NC1=CC(=O)NC1=N,0.1727
CC(C#N)N1C=NN=N1,0.263
Cc1c(cco1)N(C)C,0.2345
CC(CO)C1CCCO1,0.3288
c1cnc(cn1)OC=O,0.1993
CC(O)C1CNC1C#N,0.2707
CC1(C)CC2CC3C2C13,0.335
C(CC#CC=O)CO,0.2052
COC1CC(C)(C)C1=O,0.1971
COC1=NC2CC2N1,0.2705
C1CC(=O)C=CCC=C1,0.1873
CC1(CC#C)OC1C#N,0.2711
CC1C(CCO)NC1=O,0.2797
O=COC12CC3OC1C23,0.2399
CNc1ccoc1C=O,0.1689
N=C1CC=CC2(CC2)O1,0.2429
Cc1c(c([nH]n1)CO)O,0.2304
CC1=CC(=O)C2(C1)CC2,0.1962
COC(=O)C(C)C1CO1,0.2733
Cc1[nH]c2nncn2n1,0.2253
CC#Cc1[nH]cc(n1)C,0.1993
OC12CCC1C2CC#N,0.3032
CC12CC(C=C1)C2=NO,0.236
CNc1c(nc[nH]1)NC,0.2197
CCC1COC1C#C,0.2735
CCC(C)(O)C(C)C,0.3251
O=CNC(=O)CC1CN1,0.2158
N=COC(=O)C#C,0.2195
N=C1OC(C#C)C11CN1,0.2637
OC1CC2(CC2)NC1=O,0.2676
CCC(NC=O)C(N)=O,0.2467
CN1C2C1C(=O)NC2=O,0.2167
C#CC1OCC1C1CC1,0.2758
CN(C)C1COCC1=O,0.1909
O=C1OC=NC1C#C,0.236
CCC1N=COCC1O,0.2619
O=C1CNC1CC#C,0.2136
C1CC1c2c(n[nH]n2)N,0.2167
COC12CC1(O)C1CC21,0.3025
OC12CC1C1(CO1)C=C2,0.2306
CC(C)C1C(C)CC1O,0.3038
CCC1C2C3C2C2C3N12,0.2976
c1conc1CC(=O)N,0.2164
C1C2N1CC1=CON=C21,0.2272
OCC1OC1C(O)C=O,0.2245
CCC1CC1(C)CCO,0.3368
OC12C3C4C3C(=O)C1C24,0.2084
CN1C2C3C1CC23CO,0.2673
c1ccc(c(c1)N)O,0.2038
C1CC1C12CC3CC1N23,0.3189
CC1C2CC(O2)C11CN1,0.3012
C1C2CCC=C3COC123,0.2266
O=CNCC1(CO1)C#C,0.2679
CC1N2C(C#C)C2C1=O,0.2094
CC1COC(C)C1=O,0.2163
CC1(C)C2OC=NC12C,0.2516
CC1=CN=C(O)C(=N)N1,0.1617
C1CCOCCCOC1,0.3183
CCC#CCC(C)CO,0.2961
OC1C2OC1(C#N)C2=O,0.2211
CCN1C2C3OC3C12,0.2632
CC1=C2CC3N(C1)C23C,0.1617
CC12NC1C1OC21CO,0.2759
CN1CC(C1)(CO)O,0.2939
OCC1C2COCC12,0.3169
CCC(O)C(C=O)C=O,0.1984
CNc1cnc(=O)[nH]n1,0.1434
CCCCCC(C)OC,0.3338
CC1(O)C2CC1CC2,0.3254
CN1C=C(OC=N)N=N1,0.2247
N#CCCC1(CO1)C#N,0.3019
O=C1OCC2C3CC12C3,0.2572
CC1CC2(CC#N)CN12,0.2735
c1c(c(=O)nco1)C#N,0.1977
OC1CC23NC(C2O)C13,0.2773
CCCCc1[nH]ccn1,0.2499
CC1C2N3C1CC23C#C,0.2622
CC1(CC#N)C2CCC12,0.3024
C1CC(C1)(CCC=O)O,0.2287
CCC#CCC#C,0.2901
CCC1CC1C(=O)NC,0.2748
C#CC1CC=C(C1)C#C,0.2092
CC(=O)NCC1(C)CO1,0.2775
CC1OC1(CCO)C#C,0.2835
CCc1c(ocn1)C#N,0.2118
CNc1[nH]c(=O)on1,0.2598
CC1(C)CC(C)(O1)C=O,0.2122
N=C1NC(=N)OCO1,0.2575
CCC1C2N1C1CC21O,0.2877
CC1OC2CN3CC3C12,0.3074
C1CC2(C1)OC1COC21,0.3011
CC(=O)C1CCC(=O)C1,0.2157
CCC12CC1C=CCO2,0.2335
CN(C)C1C2OCOC12,0.2882
C[NH2+]C(C)(C)CC([O-])=O,0.1592
CC1=CC2(C)OCC1O2,0.2434
O=C1CNCC11CO1,0.1832
C1C2N=CN3C=NCC123,0.2243
CC12OC1CC2C1CC1,0.3286
CC#CC1(NC1C)C=O,0.206
CCN=CN1CC1C#N,0.2485
CC12C3OC4CN1C4C23,0.2768
CC1(CC(O)CN1)C#N,0.2822
NC1=C(CO)OC(=N)N1,0.213
CC1OC11CC=C(C)C1,0.2626
C1CC2OC3C4C(C24)C13,0.3222
OC1(CNC1C#N)C#N,0.2503
Cc1c(c[nH]n1)N2CC2,0.2315
CC1C(CO)CC=C1C,0.2586
OCC12CCN1C2C=O,0.208
CC(O)C1=CC(=N)OC1,0.2116
CC1(CN(C=N1)C=O)C,0.2222
C#CCCOC1CCC1,0.3053
CCC12CC1C1CC2C1,0.3328
C1CC(=NO)C(=O)C=C1,0.1653
N=C1OC=CC(=N)C=N1,0.1637
OCC1C2CNC12C#N,0.2415
OC(C=O)C1(CC1)C=O,0.2202
N#CC12OC1C1CC2O1,0.2556
OC1C2CCC(O2)C1=O,0.2105
NC1=CNC(=N)OC1=O,0.1599
CC1CCC(=O)CC=C1,0.2147
CC1CC(C)C1C1CC1,0.3409
CC1OCC2(CC2)C=C1,0.2501
OCC1(CO1)C#CC=O,0.2014
OC1C(=O)C2(O)CC12O,0.2107
CC(=NC)N(C=N)C=O,0.2314
OC1CCC2=C1NN=C2,0.2462
COC1C(C)CC11CN1,0.307
OCC1C2NC2CC1O,0.3062
CC12CC3OC1(CO)C23,0.3085
OC12C3CC3C3C1OC23,0.3165
CC(O)C1C=CC2CN12,0.2307
CC1(CCO1)C(=O)C#N,0.18
C1CC12C(=O)C(=O)CO2,0.1379
C1COC(O1)C(=O)C#N,0.1827
OCC1CC2CC12,0.33
COC1C(CO)C1(C)O,0.3048
NC(=O)C(O)CC1CO1,0.2754
OC12C3NC(=O)C1OC23,0.2338
CCN(C=O)C(C)CO,0.2669
Cc1cc(no1)CC=O,0.2191
c1nncn1C2CC2,0.264
C#CC(=O)COCC#N,0.2094
CC1=CC(=N)N=CC=N1,0.1482
CC1CC2OC12C(C)=O,0.2215
OCCC1C2COC12,0.3079
Cc1cncncc1=O,0.1589
CC(=O)C12CC1OCC2,0.227
C1CC23CCC2OCC13,0.3288
CNc1c(cccn1)F,0.1928
OC1COC2CCOC12,0.3207
CCC1OC1C1CC1,0.3415
c1c(oc(n1)C#N)N,0.18
OCC12CCN3CC1C23,0.2986
O=CCC12CCC1CO2,0.2209
O=C1C=CC2CC1C=C2,0.1703
CN1CC2(CC2)OC1=O,0.3008
O=CC1CC1NCC#N,0.2216
c1cn(cn1)C2COC2,0.2486
CNC(=O)C1=NCCN1,0.1963
CN1C2C3OC3(C#N)C12,0.241
OC1CC23CC12CCO3,0.2863
Cc1c(c[nH]n1)CCO,0.2596
C#CCN=CNCC#N,0.2583
CC1NC(=O)C2CC1C2,0.271
O=C1CNCC(C1)C#C,0.1962
CCC1=CC2NC2C1=O,0.1795
CC1CCCC=C1C#N,0.2237
CCCC(NC=O)C#C,0.2733
CC12CC1NC=C2C=O,0.1756
C1C2CCCOC=NC12,0.2395
CCC1(C)CCN1C=O,0.2663
CCC12CC(C1C)C2C,0.3634
c1c(nc2n1CCO2)N,0.2221
COCC(C)C1(C)CO1,0.3355
c1cncc2c1noc2,0.1651
OC1CC2=CCOCC12,0.2559
CN(CC(=O)N)C(=O)N,0.2557
CC1C=CC2(O)CN1C2,0.2195
CC(=O)OC1CN=CO1,0.2661
C1C2C3CCOC1CN23,0.2989
OCC12CC(O)C1CO2,0.3049
N=C1NC=NC=NC1=O,0.1793
CCN1CC1(C)C1CO1,0.3138
Cc1cc([nH]c1)C(=O)C,0.1847
c1c(nco1)CCC=O,0.2224
NC(=O)C1CC(=O)C1O,0.2106
CC(=O)C1OC2COC12,0.2265
O=CCC(=O)C1CCO1,0.2024
CC(C)NC(CO)C#N,0.263
Cc1cnc2n1cno2,0.2004
CC(C)OC(=N)NC=O,0.2446
CC12CC1CCCO2,0.3036
CC(O)C1CC(O1)C#C,0.2773
CC1=CCc2c1onc2,0.1896
c1conc1CC=O,0.2193
CCC1(O)CC1OC,0.3071
C#CC1=CC2COC1C2,0.2021
COC(=O)NC1CCC1,0.3065
CC1OC(=O)C=C1N,0.2229
O=CC1(C#N)C2CN1C2,0.1986
CCc1ccon1,0.2552
CC1=CCC(C)(C1)C=O,0.216
O=C(C#N)C12CN(C1)C2,0.1538
CCC1(CN1)C#CC#C,0.2196
CC(=O)NC(C)(C)CO,0.2738
CC#Cc1c(n[nH]n1)C,0.2151
CC1(O)CCC=CC1=O,0.1897
OC1C2CC(C2)C1=O,0.2195
CC1(C)CCCC(O)C1,0.3312
OC1C(NC1=O)C1CN1,0.2572
CNC1C2NC2C1=O,0.1986
CC1CCCN1C(C)=O,0.2662
CC(C(N)=O)C(C)(C)O,0.2679
COc1cocc1N,0.2285
COC1(C)CC2C(O)C12,0.3103
CC1COC(=O)C(N)=N1,0.1977
CC12CN3CC1C23,0.3045
CCOC1CCC(C)=C1,0.2596
c1coc2c1oc(=O)[nH]2,0.2079
C1CC(=O)NC(=O)OC1,0.2439
CC12C3CN1C(C=O)C23,0.2113
O=CC12CC(C#C)C1N2,0.22
CCC(CO)C(C)O,0.325
CC12C(CC1=O)N2C=O,0.2109
CC(O)C1=NC=CN1,0.2514
CC(O)C1(CC1)NC=O,0.2723
OCC1COC(=N)O1,0.3087
CC#CC1(C)COCO1,0.2868
CC1CC2=C(O1)C=NO2,0.2041
OC1(CC1)C(C=O)C#C,0.2102
CC(C)(C#C)C(O)C#C,0.2804
COc1cnc(o1)O,0.2406
OC1C=CC2OCC12,0.2444
CC1CCCC(C1)C=O,0.2283
[NH3+]C(CC1CN1)C([O-])=O,0.2661
CC(=O)C1C2CC1O2,0.2109
C1C2CC11C3OC3CC21,0.3232
OCC1(O)CC=CC1=O,0.1748
CC1OC(=O)C2(C)CC12,0.2737
O=C1CC=CC2OC12,0.2095
c1nc2n(n1)C(=O)C=C2,0.1504
OC12CC3(C1)OC(=O)C23,0.2569
O=C1C2CCC2C11CO1,0.2
CCC(O)CN=COC,0.2594
CC1OC2CC1(C)CO2,0.3229
COCC(C#N)N1CC1,0.2785
CC1CCOC2CC12,0.3209
COC(CN)C#N,0.2684
CC1OC(=O)CC2CC12,0.2755
OC1C(NC1=O)C#C,0.267
CCC1C2CCOCC12,0.3201
OCC1CC2COCC12,0.3266
C1CC12C=CCC(=O)O2,0.2465
c1nc(no1)CC=O,0.221
CN1CC11CC2CC12O,0.2994
CC1C2N=CNC(=O)C12,0.2238
CC1(C#C)C(O)CC1O,0.3041
CC#CCC(=O)COC,0.2273
OC1CC2C1C2(O)C=O,0.2205
CC1=CC2C(C#C)N2C1,0.2236
c1c(nnnn1)NC=N,0.1687
C1CC1C(=O)NCC=O,0.2191
O=CCC1(CN1)C1CC1,0.2149
CC1C2CC1C(=C2)C#C,0.1923
N#CC1C2C3C2C2C3C12,0.2809
CCNc1nc(no1)O,0.2472
CC(O)C(=O)COC=O,0.2301
CC1OC1(C)C#CC=O,0.2022
O=C1NC2COC12C#C,0.2293
C#CC1C2NC1C1OC21,0.2828
OCC12CCC=C1CO2,0.2361
CCC1C(C#C)C1C#N,0.2731
COC1CC(C)(C1)OC,0.3262
Cc1c(coc1CO)N,0.2131
OC1CC2=CCCC12,0.2473
OC1C2COC3CN2C13,0.2764
C1CC12C(=O)COCO2,0.209
CCC1OC(C)C1C#N,0.2846
c1c(=O)c(=O)[nH]ncn1,0.1486
O=C1OCC2N=COC12,0.25
CC1(C)CC11CC(=O)N1,0.2723
CC(=O)C(O)C(C)(C)O,0.2378
N1C2C3OC4C=CC13C24,0.2264
CC1C(C=O)N1C=O,0.2138
CC1=CC(=O)CC1O,0.1929
O=C1CC2C3OCC3C12,0.2156
CC1C2OC(C)OC12C,0.3282
CCC1C2NC2C1=O,0.2158
COC1C2OCC=CC12,0.2329
O=C1CC(=O)C2(CO2)C1,0.1925
CCCCCC(=O)CC,0.2347
COCC1=NCC2CN12,0.2374
CC(C)C12CC3OC1C23,0.3034
CCC(O)C1OCC1C,0.3042
CNC(=O)CC#CC=O,0.183
COC12CC(C1)(C2)C#N,0.295
OC1CC2(CC12)C1CO1,0.3179
C1OC1C1C2C=CCN12,0.2257
CC12NC1C1(CC1)C2O,0.3028
CC(O)C(O)C1(C)CC1,0.3098
OC1C2C3C2C1C3O,0.3102
OCC(=O)C#CC1CN1,0.194
CCC(C)CC(N)C#N,0.2966
CC1CNC(=O)NC=N1,0.24
CC12C3CC1CC=C2C3,0.2161
Cc1ncn(n1)CC=O,0.2124
CC1C2CC3CC3C12O,0.3119
N=C1OC=CC=C1,0.167
CN1CC2(C)C3OC3C12,0.2641
CC1CC(C)(O)C1(C)O,0.3215
c1cc2n(c1)CCCN2,0.222
CC1CC=C2CCC12C,0.2451
c1c([nH]c(=O)cn1)N,0.1656
C#CC1=NCCOCO1,0.2152
CCC(C)C(C)C(C)C,0.368
COC1C(C)C1(O)C#N,0.266
C#CCC1C2C3OC1C23,0.2916
CNC1C2OC=NC12,0.2208
CCC1C2C1C1OCC21,0.3099
CC(C)c1cnno1,0.2344
CC(C)(COC=N)C=O,0.2298
CCOc1nc[nH]n1,0.2469
CC1(CC(O)C=C1)C#C,0.2511
C1C2C=C3CC=CC3C12,0.2399
CNC(=O)CC(=N)OC,0.2464
CC1CC23OC4C2OC134,0.2616
CCOC(=N)C(C)(C)C,0.2935
OC12C3C4C1C=CC2N34,0.2207
C1OC2=NCCC=CC12,0.2303
CC1OC2C1CC=C2C,0.2559
CC1CN2CC2C1(C)C,0.2985
OCC1COCC1=NO,0.2422
N=C1N=NOC=C1C=O,0.1838
CC12CC(C)(O1)C2C=O,0.2032
CC(CC=O)C(F)(F)F,0.2297
C1C2(N1)CN(C2)C=O,0.2649
Cc1nc(on1)CC=O,0.2232
C1CC2(C1)COCC2=O,0.2127
OC1CC2CC2CC1=O,0.2309
O=C1OC2CC11CCC21,0.2695
CCOC12CC(C1)C2,0.3434
OC1CC11CCCOC1,0.3199
CC1(CC2CC2C1)C=O,0.2274
COC1(C#N)C2CNC12,0.2481
OCCC(CC=O)C#N,0.2255
COCc1cnc(o1)N,0.2266
O=C1NC2(COC12)C#C,0.2409
CC1(C=O)C2CC=CC12,0.2151
c1c(c(=O)c(n[nH]1)N)N,0.1584
C(c1c(onc1O)N)O,0.2325
COCC1C(O)CC1O,0.3138
C(CN=C(C#N)N)C#N,0.222
CCC(C)(CC=O)C#C,0.2196
C1COC(O1)C#CC=O,0.2016
c1c(c(cnc1O)F)O,0.2144
c1cnnn2c1cnc2,0.1467
C1CC(=O)NCCC=C1,0.2483
CN1N=CN=C(C)C1=N,0.1596
CN1C2C1(C)CC2(C)O,0.289
CCC(C)(CO)C(C)C,0.3331
CCC1(C)CC1(N)C#N,0.2766
ON=C1CC2CCCC12,0.2469
CN1C2CC1C2C(N)=O,0.2412
CC12COC3C1C(O)C23,0.3079
CN1CCNC(C1)C#N,0.2549
CNC(C#N)C1NC1C,0.2758
CC1CCCC=CCO1,0.2462
C1Cc2c(nno2)OC1,0.1975
CC1OC2CC2C2OC12,0.3356
CC1=C(OC=N1)C1CO1,0.2274
C#CCOC=NC1CC1,0.2472
c1c(nco1)OC(=O)N,0.2434
NC(C#C)C1(CO1)C#N,0.2584
O=C1OC2CCC1C2,0.2758
N=C1OCC(NC=O)=C1,0.1944
COC1OC=NC1(C)C,0.2783
C1OC23COC12CC=C3,0.2488
COC(=O)C1(C)CC1O,0.2424
CNC(=O)C1CC(C)O1,0.2667
CCC(C)C(=O)N(C)C,0.2682
CC(O)CC(C)C(C)=O,0.23
CC1OC11C(C)OC1C,0.3233
CCC1(CC1(C)C)C#N,0.3104
OC1CC11COC(=N)C1,0.2844
CCC1(O)C2CC2C1C,0.3134
N=C1NC(=O)C=CO1,0.2073
OC1C=C2CNC2C1=O,0.2096
CC1OC1CC(O)C#N,0.3047
CCC1N2CC2C11CN1,0.3011
CCc1cccc(n1)F,0.222
CC#CCOC(C)C,0.2836
c1c(=O)nc(on1)C=O,0.1558
CCc1cnoc1CO,0.2338
CC1CNC2=C1N=CO2,0.2082
CC1OCC=CC1(C)C,0.2662
CN1CC1C(C#C)C#C,0.262
CC1(CC(=O)C1)C=O,0.2258
CC1(CN1)C(O)CC#N,0.3002
COCCn1cccn1,0.2624
ON=C1C2CC1(O2)C#N,0.24
COCC1CC1C(C)C,0.3318
O=CC1=CC(=O)NN=N1,0.1551
CN(CC1(C)CO1)C=O,0.2709
CC1(CN1)C1OC2CC12,0.3016
CCC#Cc1cn[nH]n1,0.217
CC1C=CCCC1C=O,0.2229
CCC1C2OCC2C1=O,0.2137
OCC1OCC2CC12,0.3291
CC1CNC2(CC12)C#N,0.2568
CC(C)C(=O)C(=NC)N,0.1892
CC1=CCC(=O)CNC1,0.2054
CC(=N)OC1(C)COC1,0.268
N#CC1OCC=CCO1,0.2638
CCN1CC(=CC1=O)C,0.2112
CC1CC2CC2C11CO1,0.3275
CC1CC2C3CC2(C1)O3,0.3014
CC1OCOCC2NC12,0.3125
Cc1[nH]c(cn1)C(=O)N,0.2051
CC(C#N)C1=CC=NN1,0.2578
Cc1c(ncn1C)C#C,0.2167
NC1(CC#N)C2CC1O2,0.2736
O=C1COC2CC2C1=O,0.1524
CC1CC(C2CC2)C1=O,0.2155
O=C1CCCN2CC2C1,0.2158
OC1(C=CC2CC12)C#C,0.2353
OCC1CCOC2CC12,0.3129
OC1(COC11CC1)C#C,0.2541
CCC1(CCOCC1)O,0.3012
CC1=COC(=N)N=C1O,0.1789
CN1CC11CCC1=O,0.2025
CC(CC#CC#C)C#C,0.2283
c1c(coc1CO)C#N,0.2161
CCC12COC(=N)C1N2,0.2688
CC1(CCCOCO1)C,0.3268
CC1(O)CN2CC12C#C,0.2506
c1c[nH]cc1C2COC2,0.2431
CC1CC2(C)NC12CO,0.2707
COc1cnc([nH]1)CO,0.2287
CC12CC(O1)C2CC=O,0.2251
COCC1(CN1C)C#C,0.2755
CC1OC(=O)CN=C1N,0.2477
CC1(CN2CC12)C#N,0.2828
NC1=NNC(=N1)C1CN1,0.2231
CC(=O)n1cnc(n1)N,0.1849
CCN1CC(O)C1=O,0.2669
CN=COC(=O)CC#N,0.2404
C1C2CC1C21COCO1,0.3444
C1CC23OC2CCC3=C1,0.2471
NC12C3N=CN(C13)C2=O,0.204
c1c(c(c(=O)[nH]n1)F)N,0.1792
NC1C2(O)CNC12C#N,0.2313
C#CC12NCC1C2C#N,0.2374
CCC1(O)C2C3CC1C23,0.3102
CC1CC11CCOC1C,0.3353
CCN1C=CCNC1=O,0.2167
CC12C3N1CC3=CC2=O,0.1538
CCC(C=O)C1(C)CO1,0.2208
CCc1c(nno1)CO,0.2235
O=CC1CC(N1)C=O,0.2029
NC(=O)C12CC1C(=O)N2,0.2347
CC(N(C)C)C(=O)C#C,0.1599
OCC12COC1CC2O,0.3004
CC1CC2C(CC=O)N12,0.2051
OC1C=CC(=O)C1C#N,0.1907
C(C=O)c1nc(no1)O,0.217
CC1C2CC(=O)C12CO,0.2274
N=C1OC=NC=C1C#C,0.159
CC(C)N=C1NCC1O,0.2578
N=COC1COC1,0.2769
C[NH+]1CCC(=C1)C([O-])=O,0.1536
C1C(=O)N(C=N1)C(=N)N,0.22
CCN1C(C)C1(C)C#C,0.2689
CCc1[nH]c(cn1)C#N,0.2121
Cc1[nH]c2c[nH]cc2n1,0.1986
CCC(=O)CC1CN1,0.2268
C1OCC2C=CC3C1N23,0.2243
NC1=CC(=N)N=CN=C1,0.145
CN1C2CC1(C=O)C2=O,0.2068
Cc1cc([nH]c1O)CO,0.2226
CC1C2OCC2(C)N1C,0.2638
CC#CC1CCC=C1,0.2589
CC1CC1(C[NH3+])C([O-])=O,0.2787
COC1(C)CCC1O,0.3217
CC(=NO)C12CCC1O2,0.2291
CC1(CO1)C(CO)C#N,0.3016
CC12CC3C(C=C1)C23O,0.2395
COc1ccoc(=O)n1,0.2045
c1c(c2cnoc2[nH]1)O,0.2018
CN1CC1C1(O)CCC1,0.2783
OC12CC(O)(C1)C2C#C,0.2962
CC1C2CC3COC1C23,0.3125
CC1OCC2(CO2)C1=O,0.1988
CC12C3CN1C1C3C21O,0.2789
CCC1OC1C(O)C#C,0.2822
N1C2C1C1OC2C=C1,0.2482
CC1OC2C1CC2=NO,0.2372
CC(=O)C1CC1(O)C=O,0.2021
C[NH+]=C1[CH-]C(=O)C=CN1,0.2026
CC(O)C1=NNC(O)=C1,0.2589
CN=C1OC2C3NC2C13,0.2539
NC1=C(C=O)C2CN2C1,0.1734
c1c[nH]c(c(c1=O)F)N,0.1978
CC12OC1C1OC(=O)C21,0.2678
CC1C2CCOC1C=C2,0.2464
C#Cc1c(c(no1)N)N,0.1848
NC1COC1=NCCO,0.2584
c1c2n(c(=O)o1)CCO2,0.247
CC1(CC1)C1CC2OC12,0.326
C1CC(=O)C(=O)C1,0.1434
C1CC2OC1CN=CO2,0.2656
COC1(OCC=C1)C#N,0.2572
CN=C1OCOC1C,0.2757
Cc1ccc(cc1C)F,0.2267
NC12CC(O)C1OC2=N,0.2651
CCC(C)(C)C1COC1,0.3094
N=C1NN=C(C=C1)C#C,0.1492
CC1C2CN2C1CC#N,0.2799
COC(CC#C)C(C)O,0.2947
CC1=NC2(CCC2)CO1,0.2642
OCC12OCC3C1OC23,0.304
c1ncn(n1)CC=O,0.218
C#CC(=O)C1(CCC1)O,0.1852
CC1(O)C2COC12C=O,0.2117
C1CN2C(=O)CNC2=N1,0.2315
CC1OC1C1=NCCN1,0.234
CC(O)CCNCC#N,0.2683
CCN(C)c1n[nH]nn1,0.196
Cc1[nH]c2c(n1)[nH]nn2,0.2074
Cn1ccc(c1)C#N,0.2273
OC12C3CC1C(C3)C2=O,0.2281
CC1CCN(C1)C=O,0.2658
CN1C2COC(=O)C12,0.2446
CC1C2C[NH2+]C12C([O-])=O,0.2548
C1CC=C(C1)C2COC2,0.2528
CC1CNC(=O)CC=C1,0.2435
C1OC1C12COC1CO2,0.2936
CC(C#N)N(C)CC=O,0.2049
N=C1OCC2C3OC2C13,0.2653
C1COC(OC1)C(=N)N,0.2648
COC(C)CCN1CC1,0.3105
O=CC1OC2CC2C1=O,0.1976
CCC(C=O)(C=O)C#N,0.1977
C1OC2C1C1OCC2O1,0.3218
CC1CC2(C)COC12C,0.3137
O=C1CC2CCCC2O1,0.2788
CC1CC=CC(C)C1O,0.2635
O=CC1OC11CC(=O)C1,0.2045
C#CCOC1CCC=C1,0.2609
CC(CO)CC(C)=O,0.2345
N#CC1C2NC1C1CC21,0.2843
C1CC1(CCC=O)CO,0.2284
O=CC12CC3NC3C1O2,0.2122
CC12C3C4CN1C4C23O,0.2829
NC1=COC=C(F)C1=N,0.1732
OCC1C2N1CC21CC1,0.3044
c1cc([nH]c1)NC=O,0.1972
O=C1CC2(CO2)CCN1,0.2698
CC1OC2(CC12N)C#N,0.239
CCC12CC(COC1)O2,0.3156
NC(=O)C12CC(C1)CC2,0.27
COC1CCOC1,0.3261
CCNCc1nc[nH]n1,0.2201
OC12CC3C1CCC23O,0.3163
CN1CCOC(=N)C1=O,0.2176
C[NH2+]C(CN)CC([O-])=O,0.2786
N=C1OCOCC11CC1,0.2711
CCC12CN1CC(O)C2,0.2898
CCNC1=CC(=O)OC1,0.218
C1COC(=O)COCO1,0.2556
c1cc(oc1)CC=O,0.1957
CC1=CC(CO)OC1=O,0.2268
CC1C=CC2C3CC3C12,0.2594
CCn1c(ccc1N)C,0.2281
CCC(CC)CCOC,0.3378
C(C(=O)N)NCC(=O)N,0.2414
c1(c(nc([nH]1)N)O)N,0.2267
CC12CC3C(C1O)N23,0.3134
CCC1C(O)C(=O)N1C,0.2682
CC(C)(CC#C)COC,0.306
C1CC2OC1C=CC=C2,0.1871
c1c2c(c[nH]1)ocn2,0.2022
CCN(C=NC)C(=O)N,0.2446
OC1C2NC2C1=O,0.202
OCC1(O)CC(=O)C=C1,0.1926
O=C1CC2(CC3OC23)C1,0.2208
O=C1CCC(C1)N1CC1,0.2226
COC1C(O)COC1=N,0.2678
c1cc-2ccnc2[nH]c1,0.1512
CC(=NCCC=O)OC,0.2221
CCC(CO)C1CC1C,0.333
c1n[nH]c2n1cnn2,0.2108
CC1C2CC2(C)C1C=O,0.2128
COC12CC1C(=O)OC2,0.2701
CC#CC12CC=CC1N2,0.2263
C#CC1C2C3C=CC1N23,0.2168
CC1(C)C2C3C1CC23O,0.3065
Cc1c(non1)C(=O)C,0.1955
CC1=CC2NC2C1(C)O,0.2437
CN=COCCCO,0.2728
CCC(CC)COC=O,0.2863
OC1CC2NC2(C1)C#N,0.2768
N#CC1C2C1C1CC2C1,0.3086
CC(=O)C1CCC=C1C,0.2162
CCC1(C)CNC1C#N,0.2644
CN=CNc1n[nH]nn1,0.2036
CC12NC1C=CC21CO1,0.234
CC1N2CCOCC12C,0.3018
c1ccc(c(c1)C#N)O,0.193
CC1(CC1)c2ncco2,0.2354
C(C1CC1)C1OC2CC12,0.3193
c1c(nn2c1OCC2)N,0.2372
CC1C=CCC1CC#N,0.2639
CC(C)C1(CCC1)C#N,0.3332
COC1C2C(C)C1C2O,0.318
CC1=CC(O)COC1,0.2494
N=COC1CCC(=N)O1,0.2816
CC(=O)C12CC(O1)C=C2,0.2176
CCOC1C(C)OC1=N,0.2701
O=CC1=CCC2NC12,0.186
CN(C)Cc1[nH]ncn1,0.2481
C1C=CC=C(CO1)C#N,0.1671
OCC1=CC2NC2C1,0.2426
CN1C(=N)OC=NC1=N,0.1995
CC1NC1C1=NC=NO1,0.2385
CCC(CC)OC1CC1,0.3109
COC1C2COCOC12,0.3117
COC1CC2(C)OCC12,0.3111
OCCC1NC1CC#N,0.3027
C1CC23COCCC12N3,0.3143
CC1C(C=CC1=O)C#N,0.1903
CC1N=COC2(C)CC12,0.2687
CC12CN1C(=N)NC2=O,0.2381
NC(=O)C#CC1CO1,0.2292
OC1=NNC(=N)N1,0.2431
CN1C(=N)C2OCC12C,0.2452
CCC#CC(CO)CO,0.2924
CC1OCC11OC1C=O,0.2144
C1CC11CCC2CC12,0.3313
C#CC1CC11CC=CC1,0.2635
CCC(=O)C(O)C=O,0.2051
CC1C2C3C2N(C=O)C13,0.2525
CC(CO)CNC(C)=O,0.2786
CC(O)CC1=CN=NN1,0.2548
CC1(O)C=C2CC3C2C13,0.1796
O=CC1C2CC1N2C=O,0.1981
OCC1=CC(=N)ON=N1,0.1641
CC(C)COCC(C)C,0.3347
CCC1(C)CCC1(C)C,0.3456
c1c(cc(cc1N)N)N,0.221
CC12CC(CC=O)(C1)O2,0.2157
Cc1c(non1)C,0.2576
CNC(=O)C1(CO)CO1,0.2538
O=CC12CC3C1CCN23,0.2059
c1nc2c(o1)C=CCN2,0.1536
OC1(CC2CC1C2)C#C,0.2908
N=C1OCC1CN1CC1,0.2724
CC1CC(O)C1(C)CO,0.3087
OC12C3C4C1N4C(=O)C23,0.2223
C1CC11CC2OC2C=C1,0.2346
CCC#Cc1cnno1,0.1959
OC(CC=O)(C=O)C#N,0.1908
COCC12CC1OCO2,0.3063
CC1C(C)C2COCC12,0.318
COCC1C2NC2C1C,0.3082
C(COC(=O)N)C#N,0.3089
N=C(OC(=O)C=O)C#N,0.177
OC12CN3C(C13)C2C=O,0.1956
Cc1cnn(c1)C=O,0.2112
C1NC1C1NC2COC12,0.2966
OC1CC1C1=NC=NO1,0.2261
CC1COC2=CN=CN12,0.2362
CC1CC2(O)CC2C1=O,0.2213
C#CC1COCC11CO1,0.2901
COC1CC1(C)N1CC1,0.3083
C#CCCOCCC#C,0.3103
OCC1OCC(CO)=C1,0.2466
OC12C=CC3C1C2C3=O,0.205
CC1=CCOC1CC#N,0.2488
NC1(C#N)C2CC1C2,0.2934
OC1CC=C2CCC12O,0.239
CCCC1OC2CC1C2,0.3296
c1c(c[nH]c1O)CO,0.2404
NC1(C#N)C2CC2C1O,0.2773
N=C1OCC(=O)C11CC1,0.2206
CC(O)C1=NCC(=O)N1,0.229
OCC12C3C(O)C1CN23,0.293
O=C1C2OC2C2OC12,0.1909
C1CC2(COC1)COC2,0.3171
CC(C#N)C(C)=NO,0.2542
CCC1CN1C(C)C#C,0.2786
OC(C#C)C1C2CC1O2,0.2634
CC1(CC1O)OCCO,0.3237
C#CC1CCCCCC1,0.3147
NC1=COC(=N)C(=O)O1,0.1812
O=C1CC2C3CC3C12,0.2071
CCn1cc(c(c1)N)C,0.2264
N#CC1CC2CCN2C1,0.2499
CCCC1CCC(=O)C1,0.2226
OC(C=O)C1CC(=O)O1,0.2321
CC1CC(O)C(CO)=C1,0.2582
CC1=CCC2COC1C2,0.2492
CN1CC1C1(CC1)C#N,0.26
c1c(n[nH]n1)CCC#N,0.2577
CC1CN1CC(O)C#N,0.2536
CCCC1C2CC=CC12,0.2454
CC1CCC1C1CC1,0.3447
CC(C)(COC)COC,0.3269
CN1CC1C(=O)CO,0.203
C1CN=COCC#CC1,0.2494
CC(C)N=C1OCC1N,0.262
CC12CC3C1N3C2C#N,0.2652
CC(=O)N1C2CC1CC2,0.2537
CN1CCNC=CC1=O,0.2049
C1OC2C3CC12OC=N3,0.2432
CC12OC3CC(C=C1)C23,0.2345
OC(CCC=O)C#N,0.2292
CC1(OCOC1=N)C#C,0.2734
c1c[nH]cc1C(=O)C#N,0.1733
CC1=CC2NC2(C)C1,0.2409
CC(CCCO)C1CO1,0.342
CC1C=C(CC1=O)C#C,0.2079
O=CC1COCCC1=O,0.2143
CC1=CNN=C(C)C1=N,0.1777
C1CC1C(=O)C(=O)CO,0.158
CC(O)(C=O)C(O)C#C,0.2211
CC12NC(=O)NC1C2O,0.285
CC1CN1C1COC1=N,0.249
CC1CC(NC1=O)C=O,0.2071
Cc1cc(ncn1)C#N,0.1918
CC1=CC=CC(=CC1)C,0.1827
Cn1c(cc(n1)O)O,0.2535
OC1CC2(O)CCC1C2,0.316
CCCCOCCC,0.3381
CC(C=O)C(C)(C)C#C,0.2197
COC(C)C(C)CC=O,0.2287
CC[NH2+]CCC([O-])=O,0.2767
C(CO)O,0.3179
CC1C=C(CO)C2CN12,0.2341
CC1C(O)C1(C)CC#C,0.2984
OCC12CC1C1CC2C1,0.3252
CC1COC(=N)CN1,0.2496
OC(C#C)C(=O)N1CC1,0.2487
OC1CC=C2CN3C1C23,0.2134
OC12C3CC4C1C4(O)C23,0.2944
N=C1OC(C#C)C2CN12,0.2692
CC(C=O)C(O)C#C,0.2204
CC12OC1C(O)C21CO1,0.31
OCC1COCC(=O)N1,0.2644
CC(N)(C(N)=[NH2+])C([O-])=O,0.1994
CC12CC1OC(=N)CO2,0.2575
CC1COC(=N)C(C)O1,0.2704
C[NH2+]C1C(N)C1C([O-])=O,0.2608
NC1=NCC(=O)C11CO1,0.1882
CCC12CC(O1)C(=O)C2,0.2139
CC1C2CC(C)C1(C)O2,0.3161
CCNC(=O)C(O)C#N,0.274
C1COC(=O)C1=O,0.1722
C#CC12COC1C=CC2,0.2508
OC1C(O)C2OCOC12,0.2931
N#CCC1OC2CC2O1,0.2956
CC(C)C(=O)N(C)C=O,0.2326
CCc1c(onn1)CO,0.2215
c1c(nc(o1)CC=O)N,0.1764
CC12OC(C3OC13)C2=O,0.2402
O=C1C2CCNC1CN2,0.1973
CC(OC=N)C(N)=O,0.2555
C1CC23C4CC2(C4)CN13,0.2642
OC1CCNC1C#N,0.2683
c1ccnc(c1)N2CC2,0.2019
CC12NC1C1CC2(O)C1,0.2909
NC(=O)CC1OCC1O,0.2717
c1c(c(n[nH]1)N)C2CC2,0.2326
OC1C2NC(=O)C(O)C12,0.2532
CC1CCCC1(O)C#N,0.3149
OC12C3CC1(CC2=O)N3,0.1955
C#CCOCC(=O)C#C,0.205
NC1(CCCOC1)C#N,0.2771
CC#CCN1CCC1=O,0.2744
OCC12CC1C1C(O)C21,0.2752
C1CC23CCN4C2C1C34,0.3148
C1C2C3CC4(COC24)C13,0.3175
c1cnc(=O)n(c1)C=O,0.1727
CC1CC2(O)CCC12C,0.322
CC(N)C(=O)OC1CC1,0.2479
OC1(CC#C)CC2OC12,0.2891
CC(C)(C)CN=COC,0.2688
COC12C(O)C3C1CC23,0.3096
COCC1(CNC1)C#N,0.2732
C1OCC#CCN=CO1,0.2409
OC1C(=O)OC2CC12O,0.2621
O=CC1C2NC(=O)NC12,0.2175
CC1(C#C)C2CCOC12,0.2758
CC12OC3C4OC(C14)C23,0.2901
CC1CC2C(C1)C2(C)C,0.3331
O=CN1CCC2CC12,0.2586
O=C1CC2C(O1)C1CN21,0.2582
CCC1(C)CCC=C1C,0.2595
COCC1C2CC1O2,0.3166
CNc1cc(co1)C#C,0.1902
CCC(CO)(OC)C#C,0.2925
CC(CO)(OC=N)C=O,0.2059
C#CC1CC(=O)C1,0.2209
OC1C2NCC(=O)C12,0.2104
C1C2OC22C=CC3C2N13,0.2026
O=C1COC(C1)C1CC1,0.2213
OC1=CN=C(N1)C1CO1,0.224
CCC12OC1CC2C#N,0.2936
C1C2OCC3OCC3C12,0.3103
CCCC1(CC1)C2CC2,0.3331
Cn1c(nc(n1)CN)O,0.2548
CC12CC3C(N3C1)C2=O,0.2172
COc1cnc(o1)OC,0.2381
NC1C(=O)OC11CC1O,0.2552
CC1=C(N)C(=N)ON=C1,0.1644
NC1CCN(C=O)C1=O,0.2033
O=CC#CC1CC(=O)O1,0.2026
CC1=C(C)C2C3CC2C13,0.2225
C1CC2COCC2C1,0.3187
COCC1COC(N)=N1,0.2803
OC1C2OC2C1OC=O,0.2716
C1CC2(COC2)OC1,0.3116
CCOc1c(non1)N,0.218
OC12CC(C=C1)C1OC21,0.2521
C1C2CC3C4OC3C2C14,0.3178
CC1C2CC1(CO)C2O,0.3159
C#CC(=O)C=O,0.1491
CN1CC=CCCC1=O,0.2326
CC(O)CC1=CNC=N1,0.2497
CCC(=O)C(=O)C(=O)N,0.1562
OC1(C2CN2)C2CC1C2,0.305
CCC1C2CC1C(C)O2,0.3212
CC1(CNC(=O)O1)C,0.3149
CC1(C)C2NC3C2OC13,0.2954
OC1C2OC(C=O)C12,0.1991
O=C1OC2CCN3C2C13,0.2466
CCC1CCC(OC)=N1,0.2792
CCc1c(c(c[nH]1)C)C,0.2398
c1c(c(c[nH]c1=O)N)F,0.1615
CC(C=O)C1CC(C)O1,0.2175
O=CC12CCC=CC1N2,0.2063
c1c(c(nc(n1)O)O)F,0.2066
CNc1ncc(o1)C#C,0.1864
C1C2NC2C2N=COC12,0.2676
C#CC12C3CN=C1NC23,0.1642
Cc1nc(on1)C(=N)N,0.2017
OC1=CC(=N)C(F)=NN1,0.179
CC1C2NC2C(C)C1=O,0.225
CC1OC1(C)C#N,0.3017
CC12OC1CCC2CO,0.3303
CCC12CC3C1CC23C,0.3609
CC12CN1C(CO)C2,0.3115
CC1OC11CC2CC12C,0.3351
CC1(C)OC2CN3C2C13,0.3071
N#CC1CC2(CC2)C=C1,0.2448
Cc1c2c(n[nH]1)CC=C2,0.2035
CC(O)C1=C(N)N=NO1,0.1863
OCC(O)COCC#C,0.2814
c1nc2n(n1)CC(=O)N2,0.2179
CC(C)N1C2C3CC3C12,0.2793
c1cnc(c(=O)[nH]1)N,0.1701
CC1(CC#C)CC(O)C1,0.3051
CC1(CC1O)C#C,0.2902
NC(=O)CCOC=N,0.2786
CC1(C)C2CC1(O)C=C2,0.2363
OC1=CC(=N)C=NN1,0.1741
CNc1[nH]cc(n1)O,0.2304
CCC(C=O)C#CC#N,0.2087
OCCC1(O)COC1=N,0.2688
CCC1(C)COC(=O)N1,0.31
CC1=CCC2OC1C2O,0.239
CNc1ccncn1,0.2086
NC(=NCC#N)C1CO1,0.2528
OCC12CC1N1CC1C2,0.2954
C(CO)COCC(=O)N,0.2732
CC(CO)OC(=N)CO,0.2907
CC1C(CC#C)N1C=O,0.2538
COCC1CC1(O)C#C,0.2771
Cc1cnc(nn1)CO,0.1662
O=C1C2CC1(CO2)C#C,0.2036
CC12CC(C1)C1NC21,0.3103
C1NC11C2CC1C21CO1,0.3221
c1c(ncnn1)NC=N,0.1721
CC1(CC(C1)(C)C#C)C,0.309
CN1CC(O)(C=O)C1=N,0.2019
N=C1OC2C1C21COC1,0.2643
C1OC2C3C2N2C1C32,0.2763
O=C1CCC2CC2C1=O,0.1669
CC1(O)CCC(=N)OC1,0.2768
CC1OCC2N=COC12,0.2731
C1C=CCC(=O)C1=O,0.1602
C#CC1C2CC3C2N13,0.2681
OC12CC1(NC2=O)C=O,0.2033
COC1(C)CC1C,0.3312
C1COC(O1)(CO)C=O,0.2065
CCCOC(=O)CNC,0.2405
CC1CC2(O)C(C#N)C12,0.2922
N=C1NN=NN1CC=O,0.188
CC12CC(C)(O)CC1N2,0.2893
CCC1C(OC)C1C#C,0.2762
c1c(coc(=O)n1)C=O,0.1814
Cc1ccc(cn1)C#C,0.1978
CC12CC(O)C=CC1O2,0.2348
CC1C2CC(N12)C(N)=O,0.2688
Cc1cccc(=O)cn1,0.1547
CC1OCC1CCO,0.3167
CCC(C)C(=O)CC=O,0.2057
O=C1CCC2(OC12)C#N,0.208
CN1CC1C1=CCOC1,0.2364
CC1CC2C(CC12)C#C,0.2996
N=C1CC2=C(N1)C=CO2,0.1959
OC1COC1COC=O,0.2785
C1C2CC3=C(NC=C3)C12,0.2326
C(C(=O)NC=O)N,0.2135
CC1(C2(CC2)OC=N1)C,0.2599
CC(=O)C12CN1CC2,0.2165
O=C1CC23CC4C2C1C34,0.2224
CC#CCC1CC=CC1,0.2627
CC1CCC11OCC1C,0.3102
N=C1CC2=CCOC2O1,0.244
Cc1ccco1,0.2363
c1c2c(on1)COC2=O,0.2417
CCCCNC(=O)C=O,0.1771
Cc1c(cco1)C#N,0.2178
CC1C2C3OC1C1C3N21,0.3167
N=C1OC=NC(=N1)C#C,0.1673
CC1C(O)C1(C#N)C#N,0.2735
C#CC12C3CC1OCC23,0.2705
CC1=NCC(N)C(=O)O1,0.2252
OCC1C(C=O)C1C#N,0.2221
CN1CC11C2C3OC2C13,0.3065
NCC1(OC1CO)C#N,0.264
CC1OC(=N)C=C1C#N,0.1836
c1cnoc1N2CC2,0.2256
O=CC1(COC1)C1CN1,0.2189
CC(O)C(C=O)C=O,0.1994
C1CN=C(C1=O)N2CC2,0.1823
CCC1C2C3C4C1C2N34,0.3016
CNC(=O)c1ccno1,0.2113
CC(=NO)C#C,0.2068
CC12COC3CCC1C23,0.3217
O=C1C(CC#N)C2CN12,0.2328
OC1CC2(CC2C#N)C1,0.2968
CC1(CC#C)COCO1,0.3
CCC1(CCOC1)CC,0.3206
CC(CO)OC(N)=O,0.3213
c1cnc(cn1)N2CC2,0.1881
OC1C2CC3OC1C2O3,0.321
N#CC1CC(C1)C1CO1,0.3114
O=CC1C2CC1(O2)C=O,0.1925
CC1(CC1)C1(CO1)C=O,0.2164
CC1NC1C1(C)CN1,0.3039
ON=C1C2NC3C2NC13,0.2269
CC1OCC=C2CCC12,0.2561
COC1CCC(C)C1C,0.3188
Cn1cc(nc1OC)O,0.2338
N=C1OC2(CC1C2)C#N,0.2763
[NH3+]CC1OC(=O)[N-]C1=O,0.248
CC1COC(=N1)C#N,0.2188
CC1C2OC2C2CCC12,0.3333
O=COC(C#C)C1CO1,0.2725
CC1OC=NCC11CN1,0.2684
CCc1c(nc(o1)N)O,0.2206
NC(=O)C1CC(C1)C#C,0.2696
CC1CCOC1C(C)=O,0.2117
CC1C2C(C1C)C2(C)O,0.3136
N#CCC1CNC1C#N,0.262
OC1COC=NC2CC12,0.253
NC(=O)C12CC3C1CN23,0.2621
CC(O)C1C2N1CC2=O,0.2198
CC12NC1CC2OC=O,0.2578
OC1(CC(C1)C#N)C#C,0.2857
CC1COC1CC#C,0.2974
OC12CC3COC1C23O,0.2829
CC(C)C#CCCOC,0.3002
CC1=CC2C3CC2C13O,0.2257
CCC(C)(O)CCC#C,0.3105
OC1CC11CCCC1O,0.3296
CC1C(C)C1NCC#N,0.2499
C#CCOC1CC2NC12,0.2675
CN1C2C(O)C1C21CO1,0.3139
CC1CCC=C(C1)C#N,0.2249
NC1=NC(=NO1)C1CN1,0.2344
CC1=CC2CC1C2C#C,0.228
Cc1c(ocn1)CO,0.2344
CC(CC#C)C(=O)CO,0.2308
CCCN=c1onno1,0.2044
C1CC1(C#N)NCCO,0.2665
CC1OC(C=O)C1O,0.209
CC(=O)CNC=O,0.2192
CC(O)C12COC1C2O,0.2935
CCC12CC(O)C1(C)N2,0.2932
OCCC12CN3C1CC23,0.3029
c1c2c([nH]n1)C(=O)OC2,0.2252
CC#CCNC(=N)C#N,0.2105
CC1C2C3OCC1C23C,0.311
N#CC#CC1CCCO1,0.2273
CC(C=O)C(C)(C)C=O,0.2178
OC1CC2(NC12)C#N,0.2656
CC1(CCCOC1)C#N,0.3035
CNC1CN=C(N)C1=O,0.1679
CC1(CN1)C1(CN1)C#N,0.2826
CNC(=O)C(C)CC#C,0.2722
C1COC(=O)N1CCO,0.2973
CN1C2C3CC2(CO)C13,0.2725
OC1C2C3CC2C13O,0.3085
CCC1C2N1CC2=NO,0.2295
OC1CN2C1CC21CC1,0.2839
OC1C2OCC2C1=O,0.1978
CC(=O)C12CC1(C)CC2,0.2236
O1C2C3C4C=CC2C1C34,0.2454
CCn1cc(nc1)OC,0.2244
Cc1ncc(nn1)C#N,0.1588
CC(C)C(C)CC1CO1,0.3435
CC1CC(=O)CN2CC12,0.2002
C[NH2+]CC1=CN[CH-]C1=O,0.229
NC1=CC(=O)C2CC1N2,0.1931
CCCC(C)(C)CO,0.335
CC(C)C(C)(C)C#N,0.3525
C(C#CC=O)NC=O,0.1996
CC1(CC2(CC2)O1)C#C,0.2609
OC1C2(O)C3CC2C13O,0.2947
CNC(=O)C(=O)NC=O,0.1869
C1C2OC3C1OC23,0.3127
NC1=NC2C3NC2C13O,0.2347
CCc1cc(no1)O,0.2467
CC12C3N4C1CC4C23O,0.2826
CN1CC1C1C(O)C1O,0.278
NC(=O)C1C2CCC1O2,0.2557
OCC(=O)C1CC(=N)O1,0.2264
OC(C=O)C12CN1CC2,0.2049
OCC1CC11COC=N1,0.2508
CC1(C)CCOC2CC12,0.3171
CC1CCC(=O)C(=O)N1,0.1795
OCC1CC(O)CO1,0.3056
NC1=COC(=N)C(N)=C1,0.1534
CC1COC11CC1C#C,0.2707
CC1N=C(OC1=O)C=O,0.1821
COC(C)(CC=O)C=O,0.2078
N#CC12C3C1C1OC3C21,0.2827
c1cc(nc(c1O)N)O,0.1843
c1nc([nH]n1)C2COC2,0.2616
CC1CCC1(O)C=O,0.2201
CC1C(C)C11CNC1=O,0.2789
CC1(CN1CC#N)C#C,0.2681
C(C1CC1)C1C2CC1O2,0.3183
OC1COCC=CC=C1,0.2073
CC12CN3CC1(C)C23C,0.2889
CC1CC(=O)C=C1C#N,0.1672
C1CC1OC(=O)CC=O,0.2264
CC(=O)C1CC2OC12C,0.2237
OCC1C2C3CC1CC23,0.3364
CC12C3C4C3C1(C)N24,0.2825
CC1(CO1)C(O)C=O,0.2236
O=CN1CC(=O)C2CC12,0.2102
C1CC12CCOC2,0.3336
CCC1C2CC(O)C12O,0.3186
COC1C2NC2C11CO1,0.2981
CC12OCC1C2(O)C#N,0.2582
CCOC(C)C(C)C#C,0.3057
OC12CC3C1C1OC1C23,0.3215
CC12C3OC11CCN2C31,0.2828
CC(CC=O)OCC=O,0.2156
CN1N=CC(=N)C(N)=N1,0.1623
OC1C=CC(O)C2OC12,0.2593
OCC1C2CN1C2C#C,0.2587
CC12CC(C1O)C(=O)N2,0.2617
CCC1COCC=C1C,0.2595
c1c-2ncnoc2cn1,0.1064
CC12CCC3CC1C2C3,0.3283
C1CC1(C#N)NCC#N,0.2661
CN=C1OC=CN=C1F,0.1684
CCOC(=N)C1CN1C,0.2477
Cc1c(cc2n1CC2)N,0.2183
CC(C#N)C1=CCOC1,0.2364
OCC1C2CC(C#N)C12,0.2943
C(C1CO1)C1CCO1,0.3234
CCC(C)C1OCC1O,0.3039
CN(C)Cc1cn[nH]n1,0.2081
CC(C)C12CC(C1)C2O,0.3196
CC1COCCC=C1C,0.2505
COc1ccnc(c1)O,0.2233
Cn1cc(nc1)N2CC2,0.2422
c1c2n(nn1)C=CC2=O,0.161
CCC1(CCO)CC1O,0.3041
C(CO)N=COC(=O)N,0.2496
O=CC1C2CC1C2=O,0.2107
CC12OC1C1(NC21)C#C,0.2356
N=C1OC2C3CCC3C12,0.2819
OC12CCC(C1)OC2=N,0.2851
CCC1CCN1C(N)=O,0.2879
C1C2C1C1OC3C2OC13,0.2983
N=COCC1CC1C#C,0.2758
CC1CC(=O)CC2CC12,0.2227
C1C=CC(=NO)CC1=O,0.1862
CC1CCC(O1)C(N)=O,0.2631
CC#CCCCC#N,0.2806
COC1(CCC1C)C=O,0.2109
CCC(CC)(CC)O,0.3247
CC1CC2OC(=O)C2C1,0.2792
CC1N2CC2COC1=N,0.2593
Cc1c(n(c(n1)O)C)O,0.24
CC1(C)C2OC1C21CO1,0.3138
Cc1c(ccc(n1)N)F,0.1893
OCC1NCC1=O,0.2163
CC1C2(CO2)CC11CO1,0.3147
N#CC1=CCN2CC1C2,0.1838
CCC1(CC1)C(C)(C)O,0.3223
c1cn2c(n1)CC23CC3,0.2557
c1ccc(c(=O)cc1)N,0.1487
CN(CC=O)C(=N)C=O,0.1644
CC(C)N(C)C=O,0.2731
O=C1NC2CC2C2CN12,0.2721
CC1C2C3N1C(C)C23C,0.308
c1c2n(c(n1)O)CC2,0.2542
c1c(nnc(n1)F)CO,0.1678
COCC(C)C1CC1O,0.3264
CC1=CC2(C)C3OC2C13,0.2235
N#CC12CC(O1)C1CC21,0.2749
CC12CCC1C21CCO1,0.298
CC(C)C(C)(C=O)C#C,0.2179
C#CCN=C(C#N)N,0.223
COC1C=CC2C(C)C12,0.2381
O=C1CNC=NC1C#C,0.1961
C1CCCCCC1,0.3757
CN1CC(CO)CC1=O,0.272
CC(C)(CCC(=O)N)O,0.2808
CC(C(N)=O)C(C)=NO,0.2529
COC1(CCC1)C1CO1,0.3259
N=C1NC=NC(=C1)C#C,0.1619
N#CC1C=CC2CCN12,0.229
CC1CC(O)(C#N)C1C,0.2965
N=C1CC(OCO1)C#N,0.266
CC(C)C(=NO)C1CC1,0.2455
OCC12CN1CCC=C2,0.2353
CC1OC1C1OC1C=O,0.2145
CC(C#C)C(=O)N1CC1,0.2458
C1CC(=O)C(=O)COC1,0.1575
CN(C=O)C(=N)CC#C,0.233
OCC1NCCOC1=O,0.2447
CC12C3CC3C1(O)C2O,0.2907
CC1CC(C)C11CCO1,0.3072
Cn1c2cocc2nn1,0.1694
c1cn(c(=O)[nH]1)C=O,0.1915
CNC1C(=O)OC11CC1,0.2342
Cc1cnc(c(n1)O)O,0.1875
CC(CCCC#C)C#C,0.3085
O=C1C2C3C2N2C3C12,0.2102
OC12CC1OC2=N,0.2767
CN=C1NN=C(F)N=C1,0.143
CCCn1c(=O)[nH]nn1,0.2253
C#CC1=NCCN=CN1,0.1988
C1OC2COCC22NC12,0.3033
c1c(c2c([nH]1)[nH]cn2)N,0.2087
O=C1OCC(C=C1)C#N,0.2138
C(#N)c1nc(no1)O,0.201
O=C1OCC2C3CN3C12,0.2461
CCC1OC(C)C1C=O,0.2167
OC12C3C4C1OC4C23O,0.2669
ON=C1CCOC2CC12,0.2368
CC(C)CC#CC#N,0.2455
CNC1=CN=NNC1=N,0.1666
CN=C1CC2(CC2O)O1,0.2715
C1OC2C1C1C3CC2N13,0.2981
CCC1C=CC2(C)OC12,0.2446
CNc1c(nno1)O,0.1838
CCC12CCC1C(C)O2,0.3113
C1CCC(CC1)NC=O,0.2831
CN1CC(O)C=CC1=O,0.1988
CCOC(=N)COC=N,0.2789
CC1C2C3CC3(O)C12O,0.306
OCC12CN1C=CC2=O,0.1874
CCC12CC3CC1OC23,0.3172
OC12CC3CC(CC1)C23,0.3227
CCC1=C(CCC1)C=O,0.1918
C#CC(=O)C(=N)NC=N,0.1436
CCC(O)C1CC1OC,0.3075
N#CC12NC1CC21CN1,0.2527
CCC1CC1C(C)(C)C,0.3379
C1CC23CC(N=CO2)C13,0.2432
C1C2OCCCOC12,0.3201
O=CC1CNC(=N1)C#N,0.1901
CCC12COC1C(C)C2,0.3055
COC(CC1CO1)=NC,0.2621
CC1C(CC#N)C1(C)O,0.2943
C#Cc1c(cn[nH]1)O,0.1971
CC12CC3(CCOC13)O2,0.2972
CCOC1COC1=N,0.2699
OC1C2CC1CC2,0.3169
CNC1C(OC1=N)C#N,0.2365
CC(O)C1CNC1=O,0.2771
Cc1c(oc(=O)cn1)F,0.1623
N=C1CCC(CC#N)O1,0.2852
CC1(O)CCC(O)C=C1,0.2508
OCC1(CO1)C(=O)C=O,0.1492
CC(C)C12NC3C1OC23,0.2913
C1CC2COC1OC=N2,0.2698
N=CN1C(=N)CNC1=O,0.2307
Cc1cc(n(c1N)C)C,0.2371
C(CCC(=O)N)CCO,0.2788
Cc1cnc(nc1N)N,0.2034
CCN1C2CC2(O)C1=N,0.2349
CCC1C2OC1C2=NO,0.2554
c1c(=O)cnoc1F,0.1863
COC1CC2OCC12,0.3112
CC1=NC2(CC2O1)C#N,0.2619
CC1C2C=CC1C2=NO,0.2338
c1coc2c1nccn2,0.1877
CC1NCC1(C#N)C#N,0.2509
CC1CNCC(=O)OC1,0.2357
CC(C)C1CN(C1)C=O,0.266
CC1=C2C(O)CC2CC1,0.2366
N#CC12COC1CCO2,0.2831
Cc1cnc([nH]1)O,0.2474
CC(=O)CCC(=O)NC,0.2356
O=C1NCCC2CC12,0.2585
CC1(CC=CC1)OC=O,0.2594
[NH3+]CC(OC=O)C([O-])=O,0.1653
CN=CN1C=NCC1=N,0.2135
CCC1C=CCN1C=O,0.2398
C1CCc2c(n[nH]n2)C1,0.2462
CCC1OCC1(O)CC,0.2993
CC1C2CN3C2C3C1=O,0.2133
CCc1cnn2c1CC2,0.2579
CC1=NC=NOC1=N,0.171
OCCCC1C2CCC12,0.3296
OC12C3CN4CC1C4C23,0.286
CC1(CO1)C1=COC=C1,0.2389
CC1NC(=O)C(=C1)C#N,0.1957
C(C=O)NC(=N)NC=O,0.2061
CC1OCC23CC12OC3,0.287
CC(O)C1=CN=CC=N1,0.1992
CN=C1CCOC(C)O1,0.2645
OC1C2CC1N(C2)C=O,0.265
CC(C)(O)C1CC(=O)N1,0.2759
Cn1c(cnc1C=O)O,0.1713
O=CC1(CC#C)CO1,0.218
C1CC1CCC=O,0.2284
CC#CC1NC1C(C)O,0.2692
CCOC1=NCC(C)C1,0.2801
c1c2cocc2ncn1,0.1528
c1c(oc(=O)[nH]1)CO,0.2371
C#CCc1c[nH]nc1N,0.2297
C1CC(OC1)(C#N)C#N,0.2747
CC1OCC(=O)C1=NO,0.16
CC1(CC=CCO1)C,0.2667
C1C=CC=CC=CCO1,0.1565
OCC12CC3C1N3C2=O,0.2466
OC1=NC(=N)N=CC=N1,0.1457
C1C=C(CC(=O)N1)CO,0.2582
C#CC1CC2(C1)CCC2,0.3033
CC(C)Nc1cnoc1,0.2036
CC1CC(C)(C1)C(C)=O,0.2296
CC1(NC1(C)C#N)C#C,0.2637
CCC1C2C3OC1C23O,0.295
Cc1c(nno1)NC,0.1842
COC1OCCCC1O,0.3331
Cc1c(nccn1)NC,0.1831
CC(=Nc1cnco1)N,0.1805
CN1CC1(C)CCO,0.3037
C1OC11C2OC2C2OC12,0.3015
CC(=O)OCCC(=O)N,0.2712
C1CC2OC2C1,0.3533
c1c2c([nH]c1O)ocn2,0.203
CC1CC2NC12C#C,0.2533
CC1CN(C)C(=O)N1C,0.2864
N#CC12C3CC1=CCC23,0.1784
CC1CC11CCC11CO1,0.3201
CC1OCCC1N1CC1,0.3141
c1cn(nc1N)CC#N,0.2182
CC1=CC2OC1CC=C2,0.2286
CC1(CC(CO)C1)C#N,0.3144
COC(C)C1CC1C,0.3255
Cn1nc(nn1)N,0.2182
CCN1C(CO)C1C#C,0.2558
OC1=COC(=N)C(O)=C1,0.1609
CC1OC1C(=N)NC=O,0.2268
c1(c(oc(=O)o1)O)N,0.2573
c1c(cn(n1)C(=O)N)N,0.1935
CN=C1CN(C(=O)N1)C,0.241
Cc1ccc(c(n1)F)F,0.2153
Cc1ccc(o1)C,0.2289
OCCC1C2C3CN1C23,0.3048
CC(O)C1=NC=C(N)O1,0.2159
OC1CC2OC(C1)C=C2,0.2459
CC1(C)C2C3CC3(O)C12,0.3201
N=C1NCC11OC1C#C,0.2395
CC1(COC12CCC2)C,0.3075
CC1(CC(CO)N1)C#N,0.2666
CNC(C#N)C1(N)CC1,0.2694
N=C1OCC(CC=O)O1,0.2246
c1c2n(cn1)C(=O)NC2,0.2211
OC12C3CC1OC=NC23,0.2426
O=COC1CC2CC1C2,0.2861
C1OCC2NC2C2NC12,0.301
OC1C2NC3C2OC13,0.2842
C1CC=C(C1)C=O,0.1944
c1c[nH]c2c1[nH]c(c2)N,0.2001
CC1=C(C)CC(=N)OC1,0.2508
CC(=[NH2+])N[C-](C#N)C#N,0.136
CC1(O)CC2CC2C1O,0.3155
NC=[NH+]C1=COC(=N)[N-]1,0.0812
CCC1CC1NC(N)=O,0.2949
CCCC(C)(O)COC,0.3308
CCCN1C(C)CC1=O,0.2759
CN1C=CC2OC2C1=O,0.2019
C#Cc1cnc(cn1)F,0.1884
CCC(=O)NC(=NC)C,0.2321
CC1C2CC(C2O)C1C,0.3143
CC1CNC1(C=O)C#N,0.2072
OC1C2COC1CCC2,0.3208
c1c(ncc(n1)N)C#N,0.1798
CCC1OCC=CCO1,0.2634
c1c(nc([nH]1)C(=O)N)O,0.1864
N#CCC1(CC1)C1CO1,0.3101
NC1=C(O)OC(=N)O1,0.248
OCC1(CC2CC2)CO1,0.3417
CC1CC2(C)OCOC12,0.3258
CC1N2CC2(C)C1(C)C,0.2977
O=CCC12CC1OCC2,0.2082
C1CC1C2(CC2)C=O,0.2256
C#Cc1cccc(c1)O,0.1936
C1C2CC3C4OC2C1C34,0.3073
CN1C(CCO)C1C=O,0.1953
CCC1CC=CC1=O,0.1896
N#CC12OC3C4C(C14)C23,0.2676
CC1CC(C)C1(N)C#N,0.2954
O=C1NC2C3CN1C23,0.2542
NC(=O)C1C2C3CC3N12,0.2516
NC(=O)C1CC2CC1O2,0.2746
CCc1c[nH]cc1CO,0.249
OCC1N=COC1C=O,0.215
CC1C(C=O)C(=O)N1C,0.2188
NC(=O)NC(=O)C1CO1,0.2333
CNC(=O)NC(=O)C#C,0.2116
C#CC12CC3C(C1)N23,0.2634
CC(C)C1(CN1)C#N,0.294
COCC(=NO)C1CC1,0.2414
CN1N=NC(=N)C=C1C,0.165
CC1C2C1C1(C)C2N1C,0.2726
O=CC1CC=C(C1)C#N,0.2125
c1c(c(no1)N)C#N,0.2111
CC1COC2CC12C#N,0.2815
OC1C2OC2C1CC#N,0.3071
Cc1cc2c([nH]1)cc[nH]2,0.2027
CC(=O)Cc1cnc[nH]1,0.1837
CC1CC(CCO)C1=O,0.218
OC12CCC3(O)C1CC23,0.3281
COCC12C3CC1CN23,0.3154
NC(=O)CC1C2CN1C2,0.2751
CC1(C#N)C2CC1C2=O,0.2467
CCCCOCC(=O)N,0.2737
CCCOC1C(C)C1O,0.2945
N=C1OCC2OCC=C12,0.2119
CC(C)CCC(C)C,0.379
CC1C2C3CN2CC1O3,0.2919
OCC#CCOC=N,0.2741
OC1CC2C3C=CC1C23,0.2398
CC(=O)OC1C2CCC12,0.2777
CCC#CC1(C)OC1C,0.2779
CC(O)C(C)(O)C1CC1,0.3148
N=COC1=CON=C1,0.2303
CCN1C2C(O)C1C2=O,0.2346
c1ncn(n1)CCC#N,0.268
COC(C)CC(=N)OC,0.2702
O=C1C2NC3CC2NC13,0.211
N#CC1=CC2OC3C2C13,0.1964
CC1(NC=CC1=O)C#C,0.1875
O=C1CNC2CC1C=C2,0.1869
O=CC1C=CC2CCN12,0.1969
CCCNc1n[nH]nn1,0.2059
OC12CC1CCOC2=N,0.2505
COC(C)C1C2COC12,0.3112
CC#CCOCC(=O)C,0.2228
O=CCC1COC1=O,0.2255
N#CC1CC2CC2N1,0.2613
OC(C#N)C1CCC1=O,0.2191
COCC1=CC2OC2C1,0.2413
CC1NCC(=O)C1C#N,0.2065
CC12OCC3C(C13)C2O,0.3336
Cc1c(c[nH]c1N)C=O,0.1883
CN=C1OCCC1C=O,0.2164
O=CC1C2OC3C2OC13,0.2284
C1C2C3NC3C3(CC3)N12,0.2891
OC1CC2(CC1C2)C#C,0.2979
NC(=O)C1CC2NC12,0.2619
O=C1CC2(CN2)C2CN12,0.2394
O=CCC1OCC11CO1,0.223
CCC(C)CC#CC,0.3011
CC1(CN1CCCO)C,0.3006
CC1CN1CCOC=O,0.2514
C1OC2OC1C1NC21,0.3148
CC1=CCOC1(C)C#C,0.2518
CC12CC1C1(C)CC21,0.2929
CC1(C)CC2OC12CO,0.3315
CC1(O)CNC1CC#N,0.2794
OCC1OC2CC1C2,0.3257
O=CC1CC2OCC12,0.2162
OC1CC2(O)CC2(O)C1,0.2957
OC12CC3C(CCC1)C23,0.315
c1c(nc(o1)O)N,0.2299
CC1(CC1)C1CCOC1,0.3148
Cc1ccoc1C(=O)N,0.2068
CC(=NO)C1CCC1,0.2545
c1c2n(c(n1)O)C=CC2,0.1915
O=CNC1=NCC2OC12,0.2137
C(C(=N)NC=O)O,0.2336
CC1=CN(CC1)C(=O)N,0.2114
CC(C)(C=O)C(C)(C)O,0.2281
C#CC12CC1CCO2,0.2642
Cc1cc(on1)C(=O)N,0.2164
CC1(CC(=O)O1)C#C,0.2797
CCC(CC)(CC#N)O,0.3111
CCCc1c[nH]cc1O,0.2371
CC#CC#CC(O)C#N,0.2134
OCC12CC3(O)CN1C23,0.3023
CCN1CC(C1)OC=O,0.234
CCOC(C)C1(O)CC1,0.3213
CC(=O)C1CNC1=O,0.2277
CCOC(C)CCCO,0.3288
CCC1C2C3CCC2C13,0.3793
CC12C3CC1C(O3)C2O,0.2973
CCC12CCC1(C)CC2,0.3285
CCOC12CC1(C)OC2,0.3062
O=CC12CC1CC1CN21,0.2191
CC1CC2CCC3C1C23,0.3317
C1C2CC1C1CC2C=C1,0.2458
CC1OC(=O)C(=C1)C#N,0.2065
Cn1c(ccn1)CC=O,0.2013
NC(=O)C1C2NC2C1O,0.2698
CC(C)(C)N=C(C=O)N,0.1848
C1C23CCOC12COC3,0.3143
CCC1CCCC=CC1,0.2568
CC1C(O)C2OC(=O)C12,0.2678
CC1(O)CN=C(N)C1=O,0.1785
CNC1C2CC1(N2)C#N,0.2428
CC1=NOC=C(N)C1=N,0.1712
CCC1(CC1)C2(CC2)C,0.3267
COC1C2CC2C1CO,0.3109
N=C1CC2=CCCC2O1,0.2505
CC12NCC1NCC2=O,0.1895
CC1(O)C2NC1C2(C)O,0.305
CN1C2C3C(CO)C2C13,0.2824
CC12CN3C1C(N2)C3=O,0.2077
OC1CCC11CC2CC12,0.3083
CC(O)C1C(O)C1C#N,0.2945
OC12CC(C1)C2(O)C#N,0.2897
Cn1cnc(cc1=O)O,0.1966
CC1OC(=N)C1C1CC1,0.2868
O=C1C2CC1CC(=O)C2,0.2033
CCC1CC(C)(O)C1,0.3255
CC1=CC2OC2(C)C1O,0.2375
COC(C1CC1)C1CN1,0.3112
OCC1(O)C2C3CC1N23,0.2886
OC1C(C#N)C11CCC1,0.2912
OCC(=O)C(O)C1CN1,0.2075
O=CCC1=CCC2NC12,0.2027
OC1(CCC=CC1)C#C,0.2674
c1nncn1C(=O)C#N,0.1724
Cc1cc([nH]n1)C(=O)N,0.2189
CCC12C3CC1(O)CC23,0.3029
OC1CC2OCOC12,0.3169
N=C1OCC=C1,0.216
OC12CC3C1CCC23,0.3342
CC1COC(=N)CN1C,0.2502
CC12COC1CCC2=O,0.2177
OCC1C2NC(C#N)C12,0.2502
OC(C=O)C1CNC1=O,0.219
OC1C2OCC12CC#C,0.2778
CC1CC2(C)OC12C#N,0.2685
OC(C1CO1)C(=O)C#C,0.1902
C1C(CO1)(C(=O)N)N,0.2625
CC1(O)CC(O)(CO)C1,0.2983
COC1CC1(O)C1CO1,0.2947
C1C=C(C(=O)CN1)CO,0.1812
O=C1C2CC3OCC2C13,0.2322
CC1C2CN2C1(C)C#N,0.277
c1c(nno1)N2CC2,0.221
O=C(C#N)C(=O)C1CO1,0.1432
O=C1CC2OC1C(=O)O2,0.2004
O=CC(=O)OCC1CO1,0.1809
N#CCCC1C2CC1O2,0.2798
OC1C=CN2N=CN=C12,0.1945
C1c2c([nH]c(=O)[nH]2)CO1,0.234
C1C2CC3CN=COC123,0.2611
C(c1c(non1)N)N,0.2123
Cc1cccnc1NC,0.1954
CC12CCC1(C)C(=O)N2,0.2692
c1c(c(c(o1)O)N)N,0.2252
CC12CC3(CN3)C1CO2,0.309
CC#CC#CC1CCC1,0.2218
O=C1C2CC1C1CN1C2,0.2174
CC#CCOC(C)C=O,0.2224
C#CCC(=O)C#CC#N,0.1742
CC12CN1CC2OC=O,0.2554
CC1=CC2OC11COC21,0.2222
O=C1COCC11CCO1,0.1913
NC(=O)NC12CC(C1)C2,0.2962
CN1CCCCOC1=O,0.2779
CC1C2C3COC2C13O,0.2995
N#CC1C2OC2C11CN1,0.2763
CC1(COCCO1)C#C,0.2792
CC1CC2C(=O)OC12C,0.2779
CNC(=O)c1cnon1,0.2013
C(=N)NC(=O)NC=O,0.2221
CCC1CC(=O)C11CN1,0.2072
CC1OC(=O)CC1C#C,0.2715
CC1(O)CCC1OC=N,0.2776
C1C2COCCCCN12,0.2995
CC(=O)C(CO)C(N)=O,0.2278
CC12CC1(O)C(C)(C)O2,0.291
O=C1C=CC2CN2C1=O,0.1548
NC12C(O)C1NC2C#N,0.2394
c1nc2[nH]nnn2n1,0.2235
OC1C(O)C(C=O)C1O,0.2218
C1C(CO1)(C#N)C#N,0.2694
C1OC11CC2C3CN2C13,0.3081
CC(=O)C1CN1C(C)=O,0.2122
C1C=CC=C(C=C1)C=O,0.1622
CC1=CC2CC(C1)C=C2,0.2302
CC1OC2(CC2)C11CN1,0.2931
CC(C=O)C1=NCCO1,0.2269
COCc1cc(n[nH]1)O,0.2385
CNc1ccoc1O,0.2101
CC12CC(C1)CC1CC21,0.338
COc1c([nH]cn1)N,0.2268
CC1(CO)OC2CCC12,0.312
OC1C2C3C4OC1C4N23,0.2884
CC1OCOC11CC1,0.3331
C1NC1C1=CCCCC1,0.2464
OC12CC1C(=O)C2C#N,0.2279
O=C1COC11CN2CC12,0.1933
CNC(CC#N)C(N)=O,0.2541
CC(C)(C)C(O)C#N,0.3074
C1OC2CCC3OC2C13,0.3133
CCC#Cc1cocn1,0.2134
CC1(C)C2C3C=CC2C13,0.2254
C1CC2C1C2C1COC1,0.3237
CC12CCC3(O)C(O1)C23,0.2855
OC1=COC(=N)N=C1O,0.1685
COC1(C)CCN2CC12,0.3103
CNC1C(NC)C1C#N,0.2315
CC1(OCCO1)C=O,0.2117
CC1CN(CC=O)C1C,0.2036
CN(C=O)C(=N)C1CO1,0.228
CC(C)(c1ccco1)O,0.2362
N#CC12OC3C=CC1C23,0.2136
CC(=N)OCCC1CO1,0.2986
C1NC11C2COC1CO2,0.3061
CC1OC1C1=CON=N1,0.2217
O=CCC12CC3C1CN23,0.2128
FC1=COC(=N)NC1=N,0.2044
CC1CC2C(C)(O)C12C,0.3022
c1c-2ncnc2nn[nH]1,0.1892
N=C1CN2C=CN=C2N1,0.2025
CC1C2C3CC3(O)C12,0.3239
CC(=O)OCC(C)(C)C,0.2848
CN1CC2C1C2(O)C#N,0.2542
CCC(=NO)C1CCO1,0.2522
CC1=CC(=O)C2CC12,0.1895
COC1OC2CC2C1=O,0.2135
CN1C(=N)COC1=O,0.254
CCC(C#N)C(C)(C)O,0.3068
O=CC1C2CN1C2C#N,0.2136
CC1(NC1C#C)C#N,0.2627
CC1(C)OCC(O1)C=O,0.2145
CC(C)CC1CN1C,0.3031
OC1=CC(=N)N=C(O)N1,0.2124
NC(C#N)C1OC1CO,0.2865
Cc1c(ccnc1O)N,0.2242
OC1C2OC1(C#N)C2O,0.2517
OCC1=CCCOC1=N,0.219
CCOC(C)(CN)C#N,0.2665
C1CN1C(=O)CO,0.2548
CCC1C(O)C1N1CC1,0.3031
CCc1cnc([nH]1)CO,0.2359
CCC(C)(C)C(=O)C=O,0.1535
CC(C#N)C1OCC1C,0.2922
OC12COC3C1NC23,0.3095
CCC1(C)CC(C1)C#C,0.3041
C1C(=O)CC1(C=O)C#N,0.2089
N=C1ON=C(OC=O)O1,0.2151
Cc1c2c(on1)CCO2,0.2077
CC(=O)n1ccc(c1)O,0.1779
OC1CCC(=O)C(=O)C1,0.1614
CC1CC2C3NC3C2O1,0.3023
CN1CC(CC1=O)C=O,0.2151
CC1OC1C(C#C)C#N,0.2873
Cc1coc(c1N)C#N,0.1927
OC1COCC2NC2C1,0.314
CC12COCC1C2C#N,0.2925
FC(F)(F)C1COC1=O,0.2845
c1cnc([nH]1)CCCO,0.2497
COC1C(CO)C1C#C,0.2756
C1COc2c1[nH]c(n2)O,0.2212
c1nc(=O)c(=O)nco1,0.178
OC1CC2(CCC12)C#N,0.2944
COCCCC1CC1O,0.3277
OCC1OC2(CO)CC12,0.3034
COC1CC1CC#CC,0.3034
COC(C)C1OC1C#N,0.2654
CCC1(CN1C)C(N)=O,0.258
CC1(CC#N)COC=N1,0.2716
OC1C2C3COC1OC23,0.3171
CC(C#C)C1OCC1C,0.2938
CC1(C#N)C2NCC12O,0.2499
N#CCC1CN1C1CC1,0.2738
C1OCC23C=CCN2C13,0.2185
CCC1OC1(CC)C=O,0.2188
C(C1C2CC1C2)N1CC1,0.3197
CNC=[NH+]CCC([O-])=O,0.0787
CCCC(C)(C=O)C=O,0.2124
OC12CC1(O)C(C2)C#N,0.2734
C(C=O)C(CC=O)C#N,0.2117
CC1CC(CO)=CCO1,0.2619
CCC(OC)C(C)C#N,0.3
OC12CC3CCC1C23,0.3249
C1C2C1C1CC2CCC1,0.3279
C(COC(=O)C#N)O,0.2174
COC(CO)C1(C)CC1,0.3168
CC1=NC(=N)C(N)=NO1,0.1924
C#CC12CC3C1CCC23,0.2956
CC(OC(=O)C#C)C=O,0.2145
CC(C)C12COCC1O2,0.3265
CC12CC(C1O2)N1CC1,0.3255
CCN1C(C)C1C1CO1,0.2935
CCC(CO)C(C)(C)C,0.3352
CN=C1OCC1CC#C,0.2734
CCC#CCCC(C)O,0.3
N=C1OC23CNC2C1C3,0.2578
CC1=C(C[NH3+])OC([O-])=N1,0.1795
CN1CC(CC1=O)C#C,0.2687
OCCCC1NCC1=O,0.2182
OC1CC11C=CC2OC12,0.236
Cc1cnoc1NC=O,0.2056
CC1=CC2CC(C2)CC1,0.2471
OCC1=CC2OC2CC1,0.2373
O=C1C2OC2CC1C#C,0.202
CC1(C)C2CC=CC12C,0.2437
CC12CCC1N=COC2,0.2627
OCCC1CN1CC=O,0.2179
CC1CN(C)C(=O)C=C1,0.2015
Cc1cnc(=O)oc1O,0.1771
CC1C2C1C1(CC1)C2C,0.3338
OC12CC3NC(=O)C1C23,0.2562
Cc1cc(oc1)OC,0.2321
OCC1(O)CCOC1=N,0.2704
O=C1COC(C1)C1CO1,0.2221
CC1C2CC1C2C#N,0.33
CCC12CC3CCC1C23,0.3313
CC12CN3C1C(C#N)C23,0.2717
Cc1nc2[nH]ccn2n1,0.2358
O=COC1CCN=CO1,0.2589
CC12C(CO)C1OC2=O,0.266
OC12CCC1(NC2)C=O,0.1954
O=CC(=O)N1C2CC1C2,0.1671
CCOc1cnoc1N,0.2176
NC(=O)C1OCC1C#C,0.2527
CC#CCOCCO,0.2834
CCCC1(COC1)CO,0.305
CC(N)C(C#N)N(C)C,0.2577
OC1C(O)C2(CC2)C1=O,0.2095
CC(C)OC(=O)C=O,0.1807
CC1(O)CN(C=O)C1=O,0.2086
OC1CC1OCCC=O,0.2191
C1CC1OC(=O)N,0.3212
CC12OC(=O)C1C1CC21,0.2613
O=CC1OC2CC1CO2,0.2167
OCC12CC(N1)C2=O,0.2443
OC12C3OC1C(C=O)C23,0.2143
CC1(CC1CC#C)C#C,0.2834
C1OC1C1CCN=CO1,0.273
C1C(=O)CC(=O)C=C1N,0.1981
O=CC1CC2CCN12,0.1897
O=CC1CN2CC2CO1,0.1956
C1OC23CC4CC12OC34,0.2976
C1C(=NO)CN1C=O,0.2317
CCC(=O)NC(=O)C,0.2237
OC12CC1NC(=N)C2=O,0.1814
CC12CC(O1)C=C2C#N,0.1971
c1cnc-2c[nH]nnc12,0.1696
O=CC1C2CN1C2,0.2044
COC(CO)C(=N)OC,0.248
OCC1C(O)C1O,0.276
NC1(C#N)C2NC2C1O,0.2637
CC1CC(C)=CN1C=O,0.2072
CC12C3C=C4CN1C4C23,0.1769
CCC1C2NC2CC1=O,0.2223
Cc1cc([nH]c1N)C,0.2388
CNC(CN)(C#C)C#N,0.2501
OC12CCC3CC1C23,0.321
CC1CCCC1(O)C=O,0.2245
C1CC1C#CC#CC#N,0.1809
CC(=O)C1=CC(=O)CC1,0.1579
Cc1c[nH]c2c1onc2,0.2048
C#CC1NC(C=C1)C#N,0.2369
c1cc(nccc1=O)O,0.1598
C1OC2C3OC3C12,0.2962
OC12CC(C1)C=C2,0.2394
CCN1C(=N)ON=C1C,0.2291
CC1C(O)COC1=O,0.2788
CC12CC3C1CC=CC23,0.2475
C1C2NC3=CON=C3C12,0.2068
CCC(C)C1=CON=C1,0.2455
Cc1ncnc(n1)C=O,0.1708
COCCC1CO1,0.3461
CC1C2OC(=O)C1C=C2,0.2249
[NH3+]CCCC([O-])=O,0.2737
CC1CC(=O)C(O)C1C,0.2246
CN1CC1(C#N)C1CO1,0.2697
CC(C)(O)C1CC2CN12,0.2863
c1cnc-2[nH]ccnc12,0.1454
C#CC(CO)(CO)CO,0.2823
CCC1CC(CC=O)O1,0.2233
OC12CC3COCC1C23,0.3119
CCCC(N)C#N,0.2977
CNC1=CC(=O)NC1C,0.2164
CCN1CCC=CC1=O,0.2038
C#Cc1cncc(=O)o1,0.1526
OCCC1CCC=C1,0.2631
CC1(C)C2CC(=O)CC12,0.2239
c1cc2cncn2nc1,0.1539
CC12C3COC1C(=O)N23,0.2253
CC12CC1(OCO2)C=O,0.2084
CC1C(O)C1C1CO1,0.3057
CC1(O)C2C(=O)OC12C,0.2692
CN(CC#N)C(=O)C=O,0.1782
CCOCCNCC#N,0.2708
CC1C2C(OC12C)C#C,0.2622
c1(c(nc(=O)on1)O)N,0.1701
CCc1cnccn1,0.1966
CC(O)C(C)(C)C#N,0.3158
Cc1c[nH]cc1C,0.2512
CC#Cc1c[nH]c(=O)o1,0.1908
CC12C3C4C3N1C4C2O,0.2916
CC1(CC1CC#N)C#C,0.2799
NC(=O)CC(O)C#N,0.2754
C1OCC2COCC1N2,0.278
CCC12C3CN(C13)C2=O,0.2419
CC1(CC1)CCCC#C,0.3133
C1C(CO1)(CO)OC=O,0.2575
CCC(=O)NC,0.28
CNC1(C)CCOC1=O,0.2454
OC1C2OCC3(CO3)C12,0.309
N#CC1CCCC11CC1,0.3184
CC1OC2CC12C(N)=O,0.2622
[O-]C(=O)CC12CC(C1)[NH2+]2,0.2785
c1c(n2c(n1)CC2)CO,0.2435
CCNC=[NH+]CC([O-])=O,0.2404
CC1C2CNC12C#N,0.2416
C1C2NC2C2=C1OC=N2,0.2285
CC1(COCC#C)CN1,0.2772
CC1OCCOC1C#C,0.2743
CC12CC(O)C(O)C1O2,0.3253
OC12CC1OC(=N)C2,0.2705
OCC1(NCC1=O)C#C,0.2063
CC1CC=CC2(CN2)C1,0.2394
COCCC(C)CC#C,0.3056
O=C1COC1(C#C)C#N,0.2125
CC(C=O)C1=COC=N1,0.2167
NC(=N)C(=O)OC=N,0.1972
CC1(C)C2OC2C1CO,0.3143
OCCC1CC(O1)C#N,0.2748
NC(=N)C(O)(CO)C#N,0.2521
c1cnn(n1)CCO,0.2572
OC1C2C3C1CCN23,0.3066
COCC12CC1C(=O)C2,0.232
c1cn(nc1N)CCO,0.2289
CC1(CCCCO)CO1,0.339
C1C2C3CC4CC2C13O4,0.3287
N=CN1C=CC(=O)C1=N,0.1502
N=C1CC2(CC2C#N)O1,0.2803
OCC12CC(C1)C21CO1,0.3209
CCC1NC1C1NC1C,0.3076
CC12CC1C1(CC1)C2,0.3323
CC1(O)CC1OC(N)=O,0.3067
CC12CC1CCC2C#C,0.3082
c1cc2ncnn2nc1,0.1901
OC1(CC1(O)C=O)C=O,0.1972
COCC1CCC(=O)O1,0.2787
OC1C2C(=O)NC12C#C,0.2359
CC1C(C)C2(CN12)C#C,0.2531
CC1(CC(N)=O)CO1,0.2696
O=C1CC2OC2(C1)C#N,0.2278
CC12NC1C(C)(C)C=C2,0.245
CC1OC(CC#C)C=C1,0.2434
COC(CO)C1(C)CN1,0.3053
CC#CC(C)NC=O,0.2717
CC1OC2C1C=CC2=O,0.1757
OC1C2CC1C(=O)OC2,0.2735
CN1C=NOC(=O)C1=N,0.1928
CCC(C)C1NC1C#N,0.2898
N#CC1CCN1C1CC1,0.2573
C1CC1N(C=O)C(=N)N,0.235
c1c(ncn1CC=O)O,0.1631
CC1C2CC2(C#N)C1O,0.29
FC1=CC(=N)N=C(F)O1,0.2205
CC1CCC1(C)CC#N,0.3288
CC1CC(=N)N(C)C1=O,0.2497
COC(=O)C#CC#C,0.1949
C1CC(=C(C1)C#N)C#N,0.189
c1c(c(noc1=O)O)N,0.1801
Cc1nc(no1)OC,0.2462
CC1(CCOC1=N)C#C,0.2727
[NH2+]=C1O[C-](C=O)C=C1,0.1678
CC1OC(C)C2OC12,0.3421
C#CC1C2CN3C2CC13,0.2762
CC1CC(C1O)N1CC1,0.2964
C1CC(=O)CCC1=O,0.2159
C1C2C3COCC1N23,0.3186
CCC1CC1OC1CC1,0.3175
c1[nH]c2c(n1)[nH]nc2O,0.2128
Cc1c(c[nH]n1)N(C)C,0.2233
C1COC(=N1)CCO,0.2722
O=CN1CC2CN2C1=O,0.2277
OC1C2OCC2=CC1=O,0.1795
CN=C1OC=CN=C1C,0.1641
C#Cc1c(cc[nH]1)N,0.1888
CC(O)C1(C)OC1(C)C,0.3168
C1C2CC1C1=C2ON=N1,0.1648
COC1CCC2C1N2C,0.298
C(CC(=O)CO)C=O,0.2218
CCCC12CC3C(C1)N23,0.3132
CCC1CCC11OC1C,0.3297
COC=NCCCO,0.2719
CC(C)(CCCO)C#C,0.3193
CC1CCC=CCC1C,0.2566
CC(C(N)C#N)N(C)C,0.2562
CCC(C)(C)C=O,0.2283
CC1C=CCC1C(N)=O,0.2601
CNC(C=O)(C#C)C#C,0.2094
CC1(NCCC1=O)C#N,0.2154
CN(C)C=[NH+]CC([O-])=O,0.237
c1cc(nc(c1F)F)F,0.2132
CC(CO)C(C)CC#N,0.3118
CC#CC(CC#N)C=O,0.2148
CC1C2NC2(C)C1=NO,0.2384
OC12CC(C1)(C=O)C2=O,0.211
CC(C)(C#C)N=COC,0.2626
c1c2n(c(n1)CO)CC2,0.2402
COC1CC2NC12C#N,0.2571
CCC(=O)C1=NCCO1,0.1976
OCC1OC1C(F)(F)F,0.3385
CCC1C(O)C2CN12,0.2921
c1cc(oc1)C(=O)C=O,0.1474
OC12CC(C1)OC2C#C,0.2752
CC12CCCN1C2C=O,0.2086
CC(CC(O)C#C)C#C,0.2893
CCN=C1OCC1C,0.2773
CC(C#N)C1(O)CCC1,0.3081
CCC12CCC1C2C#N,0.3082
OCC1CCC2(CO2)C1,0.3277
CC(C#N)N(C)CC#N,0.2496
OC(C#C)C1=CC=NN1,0.2455
N#CC#CC1C2CN1C2,0.2001
O=CC12OC3C1C(=O)C23,0.1954
CC1CC(CCO1)C=O,0.2193
c1nc([nH]n1)CCCO,0.2676
CC12C3C4CC1C2(C)C34,0.3053
Cc1cc(c(o1)C)C=O,0.1874
OC1CC1(O)CCC#C,0.2983
CC1CC(CO)C1C=O,0.2206
CC1CC2OC1C2C#N,0.2963
C1CNC1=O,0.288
CC1C(CO)C1(N)C#N,0.2933
O=C1NCCCN2CC12,0.248
CC1C(CCO)C1(C)C,0.3305
CN1C(CO)C1(C)CO,0.2865
CC12C3CN1CC(=O)C23,0.2049
C#CC#Cc1cnc[nH]1,0.174
CC1=C(C)C(=O)C(O)C1,0.1968
OC1C2C3C1NC23C#N,0.245
C1OC23CCC4C(C24)C13,0.314
CC1NC1(CO)C=O,0.2217
CCOc1c[nH]c(n1)N,0.2239
CCN1C2C3CC2(C)C13,0.2937
CN=CNC(=O)N1CC1,0.2388
O=C1CNC1C1CCO1,0.2176
OC12CC1OCC(=O)C2,0.2109
CC1C2CC1(C)OCO2,0.3228
OC1CC2CC=CC1O2,0.258
C(C#N)C(=O)C#CCO,0.2122
COCC(OC)C(C)=O,0.2224
CC1C2OC1C2(C)O,0.3285
C#CC1C2NC3C2OC13,0.2786
COCC(C)C(O)CO,0.3167
CC(C)(C1COC1)OC,0.3018
Cc1ccc(=O)oc1,0.175
CC12CCC3C(C13)C2=O,0.2339
C1C2CN3C4C3C2C14,0.3128
CN=C1NC(C)C11CO1,0.2426
CC(C#C)C(=O)C(C)=O,0.1531
O=C(C#N)C1NCC=C1,0.1607
CN1CC2C1C2(C)C#N,0.2564
CC12C3CC1C(C#C)N23,0.2759
OCC1(O)COC(=O)C1,0.277
COC1COCC=C1C,0.2558
C1C2CCOC3CCC123,0.319
N=C1NCC2=C1OC=C2,0.2025
CN1C(=N)NCC1=O,0.2443
Cc1ccnc(n1)N,0.199
CC1(COC(N)=O)CO1,0.317
FC(F)(F)C1COC1=N,0.288
CC1(O)C2CC(C2)C1O,0.3213
CC#CC1(CC#N)CN1,0.269
COC1CC(=O)C2OC12,0.2143
CC12CC1CC1CC1O2,0.3279
CC(=O)C12CC=CC1N2,0.2166
OCC1CC11OCC=C1,0.2256
CC1C(C#C)N1C=O,0.253
CC(=N)NC(=O)CC#C,0.2333
OCC1CCCC(=O)N1,0.2674
CC12CN3CC(O1)C23C,0.2769
CC(CC#N)C1CCC1,0.3379
CCOc1cncnn1,0.169
CCc1cc([nH]c1C)N,0.228
CC(O)C1=CN=NN1C,0.2494
[NH3+]C(C1CO1)C([O-])=O,0.2684
CC1=CCOCCC1,0.2493
COC1C2OCC12CO,0.2872
c1c(ncc(=O)[nH]1)C=O,0.1759
OC1CCCC=CCC1,0.2578
CC1(C#N)C(N)C1O,0.2787
COC(C)(C=O)C#N,0.2209
C1C2C=C3COC3CN12,0.2258
OCC1(O)CC1C=O,0.2239
COC(=O)C12CCC1N2,0.2635
CCC(C)(C)OC(C)C,0.3138
CCC1CC2CC2(C)C1,0.331
CC1CCCC=C1CO,0.2586
CC(C=O)C(=O)C1CN1,0.2006
COC(C)CC1(O)CC1,0.3196
O=C1C=CC2COC12,0.1764
CC(O)C1CCOC1,0.3006
CC12CC1N1C(C#N)C21,0.2422
CCC1(OCC1=O)C=O,0.1936
C1CC23OCOC2CC13,0.3243
N=C1CNCC(=O)O1,0.2274
CN=C(CO)OC1CC1,0.2669
N=C1OCC2(COC2)O1,0.3024
CCC(C)C(=O)NC=N,0.238
COC1COC=NC1,0.269
OCCC1=CC(O)CC1,0.2561
CCC1CC2CCC2O1,0.3136
C(C1CN1)C1=CC=CO1,0.2354
CCN(C)CC(=O)CO,0.2039
O=CCC1C2C3OC1C23,0.2211
CCC(O)C1=CC=CO1,0.2353
c1(nnn(n1)C(=O)N)N,0.1914
O=C1NC2C(CC12)C#N,0.2724
CC1OC2CC1N1CC21,0.3321
CC1N(C)C1(CO)C#N,0.2657
CC1CCC(CO)=C1C,0.2479
OCC1CC(C1)C#N,0.3088
Cn1c(=O)cncc1F,0.1704
O=C1CCC23CN(C2)C13,0.1981
CC1C(O)C1(N)CC#N,0.2597
CNC(=[NH2+])C(O)C([O-])=O,0.2001
CCOC1(C)C(C)C1C,0.3116
C1CC1C(=O)C(=N)N,0.1845
CC(=O)C1CC2(C)NC12,0.2194
CCC(OC)C(F)(F)F,0.3482
O=C1C2CC3CCN2C13,0.2318
CC12COC3CC1(O)C23,0.3058
CCOC(=N)CC1CO1,0.2887
CC(O)C1=CN=C(N)O1,0.2296
C1C2C1C1OCC2O1,0.3355
COCC(CCO)C#C,0.3064
C1CC2C1CC1OCC21,0.3128
OC1C=CC2NC(=O)C12,0.2371
CC1(COC(=N)C1)C#N,0.2793
Cc1c[nH]c(=NC)o1,0.2181
CC(=O)NC(=O)CC#N,0.2244
CC1(C)COC2CC2C1,0.2971
CC12CCC1C(=O)CO2,0.2103
CCOCC1CC=CC1,0.2646
OC1CC1C1CC2NC12,0.3057
O=C1CNCCC1C#C,0.1914
CC1=CC(=O)C2CCC12,0.1903
CC1OCC(CC#C)O1,0.3085
O=C1COC2CC3C2C13,0.2096
OC1C2C1N1CC1C2O,0.2804
CC(=O)c1cc(on1)N,0.1776
CC1C2C(O)C2C1O,0.2936
CC12COCC1=CCO2,0.2413
O=C1CC2(CO2)C11CO1,0.1963
O=C1C2CCC1OCC2,0.2056
CN=C1OCCC1CO,0.2666
CCOC(=N)C1COC1,0.2737
CCc1[nH]c(=O)n(n1)C,0.2328
COC1CCC2CC12,0.3257
CCC1CC1C(=O)C=O,0.1561
OC1CC1(C#C)C1CN1,0.2711
CCCC(C)NC=O,0.2827
CC#CC1(CO1)C(C)=O,0.2189
O=C1OC23CCC12OC3,0.2484
O=C1CN2CC(C2)N1,0.2393
CCCCc1conn1,0.2304
c1nc2c(o1)nc(o2)N,0.1956
N#CC1C2OC=NC12,0.2568
CN=C1C=NOC(N)=C1,0.1585
OCC1COCC1C=O,0.2209
COC(N)=NC(C)C=O,0.1983
OCC12CC(O)CC1O2,0.3272
COCC12CC3CC1C23,0.3249
CC1(C)CCC1(O)C#N,0.3039
N#CC1CC=C2CCC12,0.2441
C1CN1C1C2CCCC12,0.3123
CC1C2N=COC12C=O,0.2192
c1c(c(cnc1N)O)F,0.1878
CC12NC1C1CC2C1=O,0.2364
O=C1CC2(OCC12)C#N,0.2185
C1C2OC2C11CCCC1,0.3263
O=C1OCC2NC12C#N,0.2437
CC(C)N(C)C(=O)C,0.2682
O=C1CC2C=CC(=O)N12,0.2014
Cc1cc(=O)cc(o1)C,0.1978
CC1CC2(CO2)C11CC1,0.3265
N=C1OC(C#N)C2CN12,0.2668
C1C(=CC(=O)CN1)C#N,0.141
CN1C2CC3C(O)C2C13,0.278
Cc1ccn2c1OCC2,0.2295
CC(=O)CC1CC2CC12,0.2317
N#CC1=CCC2NC12,0.2097
CC1C2CC1(O)C1CN21,0.2889
CCC1C2C(O)C(C)N12,0.2822
CC1CN1CC(=O)CO,0.22
CC1CC2C(OC12)C#C,0.2753
COC(C)C1=NC=CN1,0.2496
CC1OC(=NC1C)C#C,0.2158
C1CC(N1)C1=NON=N1,0.1789
CC1=CC2C3C4C3C1C24,0.2443
CCC1C2C3N2CC13C,0.3124
CCC1(CC1C#N)OC,0.2931
CC1CCC(CO)=CC1,0.2615
CC1(C)C2CCC1C=C2,0.2549
COCc1cnn[nH]1,0.2516
C#CC1OCC11COC1,0.2646
O=CC1C2NC2CC1=O,0.2066
COC(C(C)C)C(C)O,0.3221
CC12CC3(CC3)C1(C)O2,0.3204
CC(O)C1(O)CC1(C)O,0.2974
O=CC(NC1CC1)C#N,0.1854
CCC1C2N3CC1C23C,0.3132
CC12COC11CC(C1)C2,0.3266
CC1(C2CC2)C2CC1C2,0.3596
OC1CC(C#N)N2CC12,0.2747
CCCCC(CO)C=O,0.2278
O=CC1CC=CC2CC12,0.2159
C1C2C1C1OCOC21,0.3366
N=C1OC=CC=CC1=N,0.1608
CC1C2OCC22CCN12,0.2765
C(C(CO)(C#N)N)O,0.2921
CC1NC11C2CC1C2O,0.3201
NC(=N)C1(O)COC1=O,0.237
CN1CC1C1CC=CC1,0.2472
Cn1nc(c(n1)N)C=O,0.1814
CCCC(C)(C=O)C#N,0.2297
CC(O)C1=NON=N1,0.2204
N=CN1C=CCCC1=O,0.2058
CN1CC(O)C1C=O,0.2018
C#CC12COC1=NCC2,0.2532
OCC1OCC1(O)C=O,0.2065
OC1=CC(=N)C=NC=C1,0.1444
O=C1CCCCNC=C1,0.1802
OCC1CC11CCCO1,0.305
CCOCC1(C)CN1,0.3162
C1CCC2(C1)COC=N2,0.2689
OC1C2CC3(CC3)C12,0.3177
O1C2C3C=CC1C23,0.226
CCC(O)C1CN1CC,0.2946
C(CO)C#CC(=O)N,0.2351
OC(CC1COC1)C=O,0.1982
COCC1(C)NC1CO,0.3191
C1CNCCC(=O)C1=O,0.1915
CC(=NO)CNC(=O)C,0.2477
CC1C2(C)OC(=N)C12N,0.2571
CC1CC(=O)OCC=C1,0.2545
CC(C)C(=O)C1NC1C,0.2188
CC(O)C12CC(C)(C1)O2,0.3199
CNc1cc(n(n1)C)N,0.2248
CCC1C(C)C1C#N,0.3112
Cc1c(cn[nH]1)NC,0.2163
CC1(CCNC(=O)C1)C,0.2678
CCC(=O)C1CC=CC1,0.2306
CC(O)C1CN1CC#N,0.2812
c1cc(n2c1C=CC2)N,0.1624
CN(C)C(=O)CCC#N,0.2666
OCC1(CO1)C#CC#N,0.2276
CC(=O)OCCOC=N,0.2718
CCOc1cc(no1)O,0.2479
CC1CC2(CC1C2)C#C,0.3009
CC1(C(=O)COC1=O)C,0.2113
C1OC1C1=NC=NC=N1,0.2152
COC(C)C1CC2NC12,0.3074
CC1C2COC(C2)C1=O,0.2086
C1CCC(=O)C(=O)C1,0.1631
CN1CC(C1)(CC#N)N,0.2542
CC12CC3N(C1)C23C=O,0.2092
O=CC12CC(C1)C=C2,0.2139
CC1(CCO)C2CCN12,0.3085
C1C(=O)NC(=O)OC=N1,0.2432
O=C1CCCCC2NC12,0.2178
CC#CC12OC3C1OC23,0.2504
C#CC#Cc1cn[nH]n1,0.189
CC1(CC1)COC=NC,0.2733
N=C1CNC(=O)C(=N)N1,0.2015
CCC(CC)(CC)CO,0.3278
CC12C=CC3(C)C1CC23,0.2252
CC(O)C1C(O)C1C=O,0.2252
COC1(C)CCC(=O)O1,0.2777
NC1=C(NC=C1)OC=N,0.2018
OCC12C3NC(C13)C2=O,0.2275
CC(C1CO1)N(C)C=O,0.2714
c1c(c(oc1N)N)O,0.2194
CC1C2OC1C21CC1,0.3208
N=COCCC1CO1,0.2843
CC1OC(C)C2(C)CC12,0.3341
C#CC12CC1OC2C#N,0.2456
CCC1C=CNC1=O,0.214
OC12CNC1C(=N)OC2,0.2539
c1(n[nH]c(=O)o1)N,0.2539
ON=C1CC=CC1C#C,0.2475
CC(C1CO1)C1(C)CO1,0.3443
N#CC1COC1C1CN1,0.2658
c1c(c(on1)C=O)CO,0.1885
CC1C=C(C)C2NC12,0.246
CC12CN1CC1OC21C,0.2948
CC(O)C1OCC(C)=C1,0.2465
CC12C3C4C(N14)C(=O)C23,0.2085
CC1OC2CCCOC12,0.3301
OC1CCN2CC2C1=O,0.2014
OC12CC1(O)COCC2,0.2944
CC(C#C)C1=CN=NO1,0.2331
C1CC2CCCC1C=C2,0.2591
CC1=CC(CC1)NC=O,0.2501
CC1OC2CC3C2C13,0.3243
[NH3+]CCC1=C([O-])ON=N1,0.2166
O=CC12CCC1(N2)C=O,0.1996
C(c1c([nH]c(n1)O)N)O,0.2272
c1coc(c1C#N)C=O,0.1792
COCC1OC(=O)C1N,0.2511
C1c2c(n[nH]n2)CO1,0.2316
Cc1c([nH]nc1NC)N,0.2332
CC1CCC(O)C1C#N,0.2977
CC(C)(C#N)OC(=O)N,0.3
OC1CNC(=O)OC1=N,0.2575
CCC#CCC(O)CO,0.2943
OCC1(CC=O)CN1,0.2113
CC1(C)C2CC3CC3C12,0.314
CC#CC12CC1N=CO2,0.243
CCc1nc(no1)C#N,0.236
CN1CC(C)(O)C1C#C,0.2541
CC(C)c1cc[nH]c1N,0.2466
OCCOCC(O)C#N,0.2707
CC1CCCOC(C)C1,0.3211
c1cc(oc1)OCC#N,0.2185
CCC1CC=CCO1,0.2675
CCC#CCN1CC1C,0.2672
NC1(CCNC1=O)C#N,0.2448
Cc1cnnoc1=O,0.1744
OCCC1CC1(O)C#N,0.2884
CC12C3CC(N13)C21CC1,0.3134
OC1CC2CCC(=O)C12,0.2173
c1c(c(c([nH]1)N)O)C#N,0.2056
COC(=N)C(CO)C#N,0.2854
COC12CC(C1)C1OC21,0.3345
CCCC1(CO1)C(C)=O,0.2224
O=CCC1CCOCO1,0.2233
CC1(C)OC(=N)C(=O)C1,0.1894
O=CC#CC1C2CC1C2,0.2022
CCC1CNCC(=O)N1,0.246
CC12NC1C=CC2=NO,0.1887
CC1OC(C2CO2)C1O,0.3235
OC(C#C)C(O)C#C,0.2735
CC1(CN(C1)C(=O)N)O,0.2887
CC1C(C)C1OCC=O,0.2201
CC1CC2CC3(CO3)C12,0.3197
CCCC(=O)C1CO1,0.2239
CC1=C(C=CO1)C1CO1,0.2307
CN=C(c1ncno1)N,0.1922
OC1CC(=O)C(O)C1O,0.22
OC12CC1(CCC2)C#C,0.2756
CC1C(C=CC1=O)C#C,0.1899
Cc1nn(c(=O)n1C)C,0.2324
COC(CO)(C#N)C#N,0.2761
c1cn2c(n1)C=CCC2,0.1806
O=CC1CNC(=O)OC1,0.2088
CC12CCC1=CCCC2,0.2567
OCC1CC2(NC12)C=O,0.2122
O=C1NCC2CC12C#N,0.263
COC1C2NC1(C)C2O,0.3039
COCC1CC(O)C=C1,0.2594
CCC1(COC1)C#C,0.2922
OC1CNCC(=O)C1=O,0.1543
CC1C2CC(=O)C=CC12,0.1849
CNC(=O)C1C(O)C1O,0.2356
CNC(=N)C(=O)CC#N,0.1651
CCC1COC1CC,0.3213
CC(=O)N1CC1C=O,0.2024
OC1CC2(C1)C1CCC21,0.3237
CC(C)C(C)(CO)C#N,0.3112
C(C(CO)OC=O)O,0.2684
N=C1NN=CC(=C1)C#N,0.1427
CC#CC(CC=O)C#N,0.2205
c1c[nH]nc1O,0.2478
OCCCC(O)C1CN1,0.3165
C(COCC#N)C=O,0.228
CC1(C=CC2(O1)CC2)C,0.2266
CC12COCC1CO2,0.3255
C1NC1C12CC=CC1N2,0.2349
C#CC1=CCC2CC1O2,0.1985
CC(C1CC1)C1CC1C,0.3507
CC(C(N)C#N)C(N)=O,0.2587
CC1CN=CN1C=O,0.2228
CC12CCN1CC2=NO,0.2215
CC1C2C3CC3(O)C12C,0.3161
CC(=O)CC#CC#C,0.2134
CCC1(CC2OC12)C#N,0.3005
CC1(C)OC2CCCC12,0.3185
C1CC12C(=CCO2)C=O,0.1574
CC1=CCc2c1con2,0.205
OC12COC(C1)C1OC21,0.3106
COc1cnc([nH]1)C=O,0.1705
COC1OC2(C)CC1C2,0.3379
CCC1OC11CC(=O)C1,0.2167
O=CC1CC2NC2CO1,0.2242
CC12OC1C(=O)NC=C2,0.2067
c1c[nH]ccc1=O,0.2043
CC#CC12CC1CO2,0.2447
CC12C3C4C3C1=CCC24,0.1618
CCC(=O)N1CCC1=N,0.2353
CC1COC(=O)CN1C,0.2466
Cc1nc(co1)CC#C,0.2417
CCCC#CC1CCO1,0.2717
NC1=CN=C(N1)C1CO1,0.219
CC#CC(C)(CO)C#C,0.285
O=COC=NCC1CN1,0.2415
C1C2CCC11COCC21,0.3261
CCC1C2N3CC2(O)C13,0.3126
CC1CC23CC12CCC3,0.3019
CC1C(O)C1(C#C)C#C,0.2601
O=CC12CC1NC2C#N,0.2097
CC1(C)CC2C3OC3C12,0.3204
CCc1c(ccn1C)C,0.2361
CCn1c(ncn1)NC,0.2419
O=C1NC2=NCC3C1N23,0.2141
C1C=CC(=O)C(=O)N1,0.1646
C1C2NC3=CC=CN3C12,0.2256
CN1CC1(C)C1COC1,0.3048
N=C1OC2C3NC(=C1)C23,0.1734
OC1CC2CCC=CC12,0.2544
C1C=C2C=CCC22OC12,0.1915
CCC(C)C1CC(=O)O1,0.2853
OC1C2C3OC3C1C2O,0.3158
CC1CCC(C1)=NO,0.2513
CN1CC(CC=O)C1=O,0.2236
C1CC2(C1C2)C1COC1,0.3246
CC1CC(=NO)C(=N)O1,0.2076
CCOCC(CO)OC,0.3214
CC1C=CC2NC2C1O,0.2415
CC1CC1(CO)C#N,0.3056
CC1C(O)C=C(C)C1=O,0.19
OC12C3CC1NC23C=O,0.2137
CC1C2C1C(=O)N2C=N,0.223
CC1COC(=NC1)C#C,0.2272
NC1=C(N)C(=N)ON=N1,0.1429
COC1CC2CC(O)C12,0.3046
CC1C(C)C1(O)CC#C,0.2847
c1c(c(n[nH]1)C2CC2)N,0.2232
CC12CC1C1(C)CC1O2,0.3137
CCOC(C)(CC)CO,0.3211
OC1C2CC3CC2CC13,0.3313
C1C(CN1C=O)NC=O,0.2629
CC1NC(=N)N(C)C1=O,0.2425
CC(C)OC1CCC1O,0.3152
C#CCC1COCOC1,0.3086
OC1C2COC1C(=N)O2,0.2676
O=C1NCC=C2CNC12,0.2218
CC(C#C)C1(C)CN1C,0.2726
CC#CC1CC(=O)O1,0.2734
CC1(CO)C2CC(O)C12,0.3179
CC12CC1C=C(C2)C#C,0.1985
N=C1ON=C2CC=CN12,0.1904
[NH3+]C1CC(C1)C([O-])=O,0.1138
CC1(CC#C)OCC1=O,0.2183
CCc1c(c(on1)C)N,0.2139
OC12CC1(OC2=N)C#C,0.2269
O=CC12CCC1C2C#N,0.2165
CC1C(CO)CC11CC1,0.3361
CC(=O)NC1CC1C#C,0.2655
C#Cc1c(oc(n1)O)N,0.1982
Cc1c([nH]cn1)CC#N,0.2437
OC12CCC1(O)C(=O)C2,0.2115
Cn1c(=O)c(ncn1)N,0.1792
CCC(C)N1CC1C#N,0.2682
CCC1(CN=CO1)OC,0.2767
CC1=NCCC(CO)O1,0.2711
Cn1ccc(c1)N,0.2244
N#CCC1CC2CCC12,0.3181
O=C1CC2NC12C#N,0.2207
N#CC12C3C4CC(C14)N23,0.2542
CC1C2C3CC1C(C)C23,0.349
CC1C=CC23CC(O2)C13,0.223
CC1(O)CNC1=O,0.2684
NC(=[NH2+])C1=N[N-]C(=N)O1,0.1272
OCC12CC(O)C1N2,0.3132
C1CC2(C1)C(=O)OC=N2,0.238
NC(=O)C1OC2COC12,0.2469
CC12OC3C1C1CN1C23,0.3076
CCC1COC2CN1C2,0.2918
N=C1CNC2CC(C2)O1,0.2431
CC1CCC2CC12C=O,0.2253
CC1C(NC1=O)C1CO1,0.2776
CC1(C(O1)(C)C)C,0.3359
OC1CC2CC12N1CC1,0.2907
CCN=C(C#N)N,0.219
C#CC#CC12CN1CC2,0.2005
OC1C(=O)CC=CC1=O,0.1738
CCOC(C)CC(N)=O,0.2734
CC(C)C1(C)CC(O)C1,0.3266
c1nc([nH]c(=O)n1)N,0.2117
OC1C2C3N2CC13O,0.3021
N=C1COC2(CC2)CO1,0.2722
c1c2c(on1)COCO2,0.2172
N#CC1CNCCCO1,0.2515
CC(C=O)N1C2CC1C2,0.2084
CC1NCC2=C1NN=N2,0.2235
NC1C2(N)CCC12C#N,0.2502
CC(=O)Nc1cn[nH]n1,0.2256
CCOC(C)C1(C)CC1,0.3312
COCCOCC1CO1,0.3321
c1c2c(n[nH]1)NCC2,0.2209
C(=O)c1c(oc(=O)o1)N,0.184
c1cncc2c1C=CC2,0.2006
CCCCCCCO,0.3427
CC1(C)CC([NH2+]1)C([O-])=O,0.2643
NCC(CO)(C#C)C#N,0.2776
COCC([NH3+])CC([O-])=O,0.2786
CCN(C)C(=O)C(=O)C,0.181
C(CC(=O)NC=O)C#N,0.2215
N=COC(C#C)C#C,0.265
C#CCNC(C#C)C#C,0.254
CCNc1ccccc1,0.2013
COC1C2OC1(C)C2C,0.3162
c1c(cn[nH]1)C2COC2,0.2574
CC12C3CC1(C)C(=O)C23,0.2422
CC1C(C#C)C1(O)C#N,0.2661
CC1=C(N)C2NC2C1=O,0.1867
CC1(CO)OC1CC=O,0.2245
CC1(CO)C(O)C1C=O,0.2215
COc1c([nH]c(n1)O)O,0.2381
CC12CC1(C)C1(C)OC21,0.328
CC1OCC1C1COC1,0.3161
CC1C2C3COC1C23,0.3245
CNc1cc(c([nH]1)O)N,0.2087
CCC12CC(C1C)C2O,0.319
CC1(COC(=O)N1)C=O,0.2112
OC1=C(OC=N)C=NN1,0.193
CCCOC1COC1=O,0.2515
CN1CC1C1CC1C#N,0.2565
CC12CC1C(=O)CCC2,0.2244
CC1N=CN2C=NCC12,0.2343
CC(CO)C1CO1,0.3389
CC1OC2C1NCC2=O,0.1953
CC1C2COC(C#C)C12,0.2887
N#CC1NC2CC12,0.2536
CC(=O)Oc1cc[nH]c1,0.2162
CC(=O)OC1CCC1=O,0.2174
OC1C2CC3OCC1C23,0.2963
OCC1CC2OC1C2=O,0.2343
CCC(C)C(C)(C)C#N,0.3515
OC1C2C3N2C(=O)C13O,0.2479
CC(CC=O)NC(N)=O,0.2269
COCC1(O)CC2CC12,0.3193
OC1CC(C1)C#CC#C,0.2269
CC#Cc1cccnc1,0.1966
OC12C3CC1NC2=NC3,0.1938
NC1CNC(=O)NC1=O,0.239
CCCCC#CC1CO1,0.2753
CC1CC(CO)N1C=O,0.2622
CCC1COC1C=O,0.2142
C1C2C3C4OCCC13C24,0.3304
CCC(C)OCCC#C,0.3091
OC1CC=C2CC3C1C23,0.2174
NC(COC=O)C#N,0.2849
O=CCC1COC(=O)C1,0.2232
Cc1cccnc1OC,0.2114
CCCC1CCC11CC1,0.3479
O=CN1CCC1CC#C,0.2636
C1CC(=O)OC2(C1)CC2,0.2684
CN=COC1CC2OC12,0.2702
CCC#CC(F)(F)F,0.3022
OC1C(COC1=O)C=O,0.2273
CC1OC(C=O)C11CO1,0.2156
OC1C2OC2C1C=O,0.2145
CC1OC=NC2CNC12,0.257
OC12C=CC3C1CCC23,0.2309
COC(=O)C1NCC1=O,0.2136
CC(C1CC1)C1CO1,0.3493
C1OC2=NCC3OC1C23,0.241
Cn1cc([nH]c1=O)C#C,0.1817
C1CC12CCC23CC3,0.3314
OC1CNC1(C#N)C#N,0.2518
CN1CC2(CC2O)C1=O,0.2725
CC1C2C1C1C3CC1C23,0.3518
NC1=C(C=NN1)C1CO1,0.2412
CCC1(OCCCO1)C,0.3367
CC1OC(=O)C=C1C,0.2258
CCc1ncc(nn1)F,0.1659
CC1OC2C3OC1(C)C23,0.2886
CCC1CC2OC=NC12,0.2613
CC1C2OCC3(CC3)C12,0.3174
OCC1NC11CC2CC12,0.3113
CC(C)n1c(ncn1)N,0.2517
CC1(OC(=O)C=C1)C=O,0.1991
C1CC11C2C3C1CCN23,0.3242
CC1(COC1)CCCO,0.315
OC1=CC(=N)OC(F)=N1,0.188
COC(C)C(N)C#N,0.278
NC(=O)C(O)CCCO,0.2776
CNc1cc(=O)nn[nH]1,0.1717
OCCC1CCC(=O)O1,0.2788
CCCC(C)(C)OCC,0.3249
NC1(CO)CC1C#N,0.2815
CC1=CCC2CCC12O,0.2606
CCC1OCC1CO,0.3099
O=C1CCC(C1)C#N,0.2222
C(CC=O)CC(=O)C=O,0.1504
CC(C)(O)CC(O)C=O,0.2092
Cc1c(c(n[nH]1)O)C#C,0.2182
Cc1c(ncnc1N)C,0.2165
CC1CC2NCC12C#N,0.2581
CC(C#C)C1CC1C=O,0.2281
COC1(C)CC(O)C1=O,0.1991
CCC1CCCC2CC12,0.3382
c1cc(nc(c1)N)C=O,0.1632
CC(C=O)C1OC1C=O,0.2112
OC1=CNC=C1C1CN1,0.2304
CC(C)CC(CO)C#C,0.3033
COC(C)C1=CN=CN1,0.2483
CC12CC3C4C(C13)N4C2,0.3127
OCC(O)C1(O)CC1,0.3037
c1c(c(nc(=O)[nH]1)N)F,0.188
CC(O)CC(C)(O)C#N,0.3155
O=CC12CN3C1C=CC23,0.1711
O1N=NC2=CC=CC2=N1,0.1448
CC1C2CCC1(C)CO2,0.3055
OC1C2C3CC3C1C2=O,0.2285
CC#CCOCC(=O)N,0.2666
CC#CC(C)C1CCO1,0.292
CC1C2CC3(CC3O)N12,0.2917
C1OC1C#CC1CCO1,0.2558
OC1CCCOC1C=O,0.2284
OC1(COC=N)CCC1,0.2759
CC(=N)OC1COC1=N,0.2802
CCCCCOCC#C,0.2889
CC1=CC(=O)NC12CC2,0.2078
N=C1NC(=O)NC=N1,0.2077
CCC1OC(=O)C(C)=C1,0.2303
c1c(con1)C(=N)N,0.2203
[NH2+]=C1NN=C([N-]1)N(=O)=O,0.1818
CCC1(CC)OC1C#C,0.2779
CC1CC2(O)C(O)C12C,0.2968
CC1CC2(CC(O)C2)O1,0.3132
CC1C2CC(CO2)C1O,0.3072
CC1(C)OC(C#C)C1=O,0.2114
CC1CC=CC(O1)C#N,0.2643
CC1C2COCCN12,0.3039
CC(C#C)C1C2CC1O2,0.287
C1OCC1C1CCOC1,0.314
CCC(=O)CC#CCO,0.2284
CC(C)N=C1NCCO1,0.2802
CN1C(C(C)=O)C1(C)C,0.2007
O=CC(=O)C1CC1C#C,0.1547
C#CC1(CCCN1)C#N,0.2557
COC1C=CC(=O)C1=O,0.1328
CCC12OCC1CC2O,0.2955
c1cc(n(c1)CCO)N,0.2316
OCC1CC1C#C,0.29
C1C(CO1)NCCC#N,0.2748
OC12C3CC1OC2=NC3,0.202
OCC1OCC11CN1,0.2967
CC12CC(C1)C1CC1O2,0.3105
Cc1cncnc1C#C,0.1918
CCCCCC#CC#N,0.2461
COc1c([nH]nn1)C#C,0.1901
CC1=CCCC2CC12C,0.2509
Cc1c(nc([nH]1)C=O)C,0.1751
C(C(=O)CO)NC(=O)N,0.2214
OC1CC2C3NC3C12,0.2918
OCC1CC=CC(=O)C1,0.1897
C(CO)c1[nH]c(=O)[nH]n1,0.2429
O=C1CC2OC=NCC12,0.2179
CN1C2CN3C2C1C3=O,0.2033
c1cc(c(cc1F)O)O,0.2085
CC1=CCC(C1)C1CC1,0.2609
O=C1C2C3CC(C23)C1=O,0.1492
CNC(=N)N(C=O)C=O,0.2109
N=C1OCC2OC2C1=O,0.1939
CNc1c(c([nH]n1)O)N,0.2482
CC1(O)CC2C1C1CN21,0.2817
C1C2OC3=NC1C1C2N31,0.1565
CCC12CC1C(C2)C#C,0.2968
CC1CC11OC(C)C=C1,0.2239
C#CC1=CC2NC2CC1,0.1971
CCC12CC(O1)C2C=O,0.2053
CCC1CC1C1CO1,0.3491
CC1OC(=N)OC1CO,0.3072
OCC1C2CN2CC1O,0.281
O=CCC1(CN1)C#C,0.2169
CC12CC=C3CC1C23,0.178
CC(COC(N)=O)C=O,0.225
C1CC12C=CCOC2=O,0.2503
CC#CC12CC1(C)OC2,0.2571
Cc1cc(=O)occ1C,0.1777
O=CNC(C#C)C1CO1,0.2746
CCC1C2C3CN2C13C,0.3068
N=C1ON=C(NC=O)O1,0.2116
CC(CC#CC#N)C=O,0.2258
CNC=[NH+]C1=CC=N[N-]1,0.1295
CC1N2C3C2C1(C)C3O,0.2951
Cn1ccnc1C#N,0.2094
CC1C2CC1(C2)C1CC1,0.3529
N=C1CN2N=CC=C2O1,0.2191
C#CC1=NC2C3CN1C23,0.1875
CC1CC(C)(C)C=C1,0.2633
N=C1OC=C(O1)C#C,0.1891
CCOC(C)C,0.3333
Cn1c(n[nH]c1=O)C=O,0.16
c1c([nH]c(n1)CC#N)N,0.2265
NC(=O)C(=N)OC1CC1,0.2184
Cn1nc(nn1)N(C)C,0.1981
CNC1COC(=N)C1=O,0.1709
CCC1CC(C)O1,0.3312
OC12CC(C1)C2CC#N,0.3151
OC1(COC1=N)C#C,0.2669
OC1CC11CC(=O)C1O,0.2144
CC12CC1(OCC2)C#N,0.2663
CC(C)C1CC1C1CO1,0.3437
CC1OC1(C)C(F)(F)F,0.3611
NC1=NOC(=O)NC1=N,0.1894
CCC(O)C1CN2CC12,0.2914
CCC1=COC(=N)C=C1,0.1645
CC(C)c1nc(co1)O,0.2227
CC12C3CC(C13)C2C#N,0.2901
C1OCC1N1C2CC1C2,0.2988
CC(=O)C1(CO1)C1CN1,0.2201
CC1(CO1)C1=NON=C1,0.2386
OC12CC3C1CC2C3=O,0.2282
OCCC1C2CC1OC2,0.3107
C1CC23C1CC21CC3O1,0.2943
C1CC11C2COCC1O2,0.3123
O=CC1(CCCN1)C#N,0.1953
CC1C(=O)NCC11CO1,0.271
CC1NC1C(O)C=O,0.2181
CC1(C)C2OC1C2(C)C,0.3142
Cc1c(cc(cn1)F)F,0.2161
OC12CC3CC1C2C3,0.3196
COc1ccoc1CO,0.2184
C1C2CC3OC(C2)OC13,0.3304
CC(=O)N1CCC1(C)C,0.2668
CC1(CC2CC12O)C#C,0.2758
CC1OC(=O)C1(N)C#C,0.2374
C#CC12C3C4OC1C4N23,0.2579
Cn1cc(c(n1)O)C#N,0.2236
CN1CC1C1(CO)CN1,0.302
COC12C(O)C1C1NC21,0.2805
Cc1cc(oc1)C=O,0.1852
CN=C1NCC2(C)OC12,0.2436
CN1CC1C1OC1CO,0.3069
O=C1C=NON=NC1=O,0.1335
CN1C2C3CC1COC23,0.2802
CC1OCC2(C)OC12,0.3424
C1COC1=NC2COC2,0.2516
C(CO)C(=O)CC#N,0.237
CC(C)CC(O)C(C)O,0.3177
CC#CCCOC(=O)C,0.2664
O=CCN1CCC1C#C,0.2099
[NH3+]CC1=C([O-])C=NN1,0.2217
OC1C2CC1(CC#C)C2,0.3039
OC1CC(O)(C#C)C1=O,0.1949
CNc1ccc(cn1)O,0.1737
NC1=CN=C(F)C(=N)O1,0.1569
OC12CNC1COC2=O,0.2446
CN1C=NC(=N)C(N)=N1,0.184
CC1C(OC1=N)C1CN1,0.2729
c1c(c[nH]c1O)C#N,0.2094
CCC(C)C1C2CC1C2,0.3729
C#CCCC1CC=CC1,0.2651
COC1(C)C2C3C1CN23,0.3175
CC1(CNC(=O)N1)C#N,0.2788
CC1C2(O)CC1(C2)C#N,0.3043
CCN=COC1CC1C,0.2705
N=C1CNCC(=O)CO1,0.2032
CC(C)(CO)OCCO,0.3232
OC1C(CC1=O)C1CO1,0.2245
CC1CC2=C(C)N=NN12,0.251
CC1(C(O)C1O)N1CC1,0.2779
COC(=O)C12CC1CC2,0.2693
N=C1OC2C=CCC12,0.2516
COC1CCC2CC2C1,0.3208
NC1=NC(=N)N=CO1,0.2066
CC1CC11COC1C,0.3175
c1cn[nH]c1CC2CC2,0.2568
OC1CC1CC1(O)CC1,0.3202
CN1C2C1C(=NO)C2O,0.2309
CC1COC1C#CC=O,0.2012
CCCC,0.4107
CC1C2OCC2C1(C)O,0.3104
C[NH2+]C1(CCC1)C([O-])=O,0.2628
CC(C)CC1CCC1C,0.3538
OC1C2OC1C2C#C,0.2868
CCC1=NNC(=N)C=N1,0.1485
CN1CCOCC1=O,0.2632
C1CC12C3(CC3)OCO2,0.3153
CC1CC(C#C)C1=O,0.2134
CC12CC1CCC(=O)N2,0.2679
CCOc1conn1,0.2018
CCCOC(=O)NCC,0.3125
NC1=NC(OC=N)=CO1,0.2228
CC1=CCN2C(C=O)C12,0.1958
C#CC1(OCCO1)C=O,0.2186
NC(C#C)C(=O)N1CC1,0.2365
CC1OC(C)C(C)C=C1,0.2636
CC(O)CC(C)O,0.3271
CCc1ccnc(n1)C,0.209
CN(CC([O-])=O)C=[NH2+],0.2461
c1c(nnnn1)OC=O,0.1679
CC1CCC=C1C1CN1,0.2438
Cc1nc2c(o1)OCO2,0.1918
O=COC12CC1CC2,0.2686
CC(O)C12C3CN1CC23,0.2935
C1OC11C2C3C2C2C3C12,0.2989
CC12NC1CC21CN1,0.2936
CCc1c(non1)CO,0.2488
C#CCC(=O)CC#N,0.2314
CC(C1OC1C)C(C)=O,0.2292
CC1CC(C)(C1)C#N,0.3401
CC1=CC(=N)N=C(O)N1,0.1994
OC12C3C1C1CC2CC31,0.317
C1CNC2=C1C(=O)OC2,0.2029
COC1C2CC=CCC12,0.2657
CN1C2C3OC3C12C=O,0.198
CCC1CC1(O)C(C)O,0.3096
CC1CC(=O)C1C(C)=O,0.205
OCC1CCOCOC1,0.3214
CC12CN1C(=O)C=CC2,0.2012
CC1(O)CCCC1C#C,0.3102
CCC(C)(O)CC(C)O,0.2999
CC(C)(C)OC(=O)N,0.3175
CC12CC1C(=O)C(O)C2,0.2116
CC1NC11CC(C)C1=O,0.21
CC(=NC)NC(=O)C#C,0.203
COC12CC3C(C1)OC23,0.3152
COC(CO)CCCO,0.3232
CC12CCC=C1CCO2,0.2531
CC1C(CO)OC1C=O,0.2111
CC(C)(C)C1(CN1)C#N,0.2947
CCC12CN1C(C2)C#N,0.2694
C1C2CC34CC(O3)C1C24,0.2902
O=C1NC(C=C1)C1CN1,0.2126
O=CCC1CC2NC12,0.2225
O=C1OCOC1C#N,0.2693
CC(CC=O)(C#C)C#N,0.2219
NC1=NC2=C(C1)N=NO2,0.1678
CC1C=C(C#C)C2CC12,0.2011
CN1CC1(C=O)C1CN1,0.1947
CC1(C)C2NC2C1=NO,0.238
c1coc2c1occ2,0.2008
CC(CC=O)OCC#N,0.2248
CC1CC(C)(C=O)C1C,0.2245
CC1=CC2OC1C=C2,0.2012
C1C2C1C1CC2C=C1,0.2556
C1CN1C12CC(C1)CC2,0.3098
O=C1CC2C(CC#C)N12,0.2338
COC(C)C(=O)C(C)=O,0.1593
c1c(c(cnc1N)O)O,0.1959
CC1C2CCC1(C)CC2,0.3529
C(=O)n1c(=O)[nH]c(n1)N,0.2088
CC1(C)C2NC(=N)C12O,0.2437
C1CC1(C(=O)C=O)O,0.147
OC1C2(O)CC1(O)C2=O,0.228
CC(=NO)C1(COC1)C,0.2517
C1OC1C1=NC=CN1,0.2381
CC1CC11CNC(=O)N1,0.2918
OC12C3C1C1C3C21C=O,0.2005
C1C2CCC3=CCC1C23,0.2447
c1cc(oc1C=O)C=O,0.1693
CC(O)(C#N)C#CC=O,0.2015
C1OC11C2C3CC1OC23,0.3223
CC(C#C)C1CC1C#N,0.2955
CNc1cn(c(n1)O)C,0.2298
CCC12CC1(NC2)C#N,0.2373
CN=C1OC2C(N)C12N,0.2454
Cc1cc(c([nH]1)C)OC,0.2175
c1c(nc([nH]1)C=O)N,0.155
OC1C2CC2NC1C#N,0.2542
C1CN1C2=CC(=O)OC2,0.2161
O=C1OC2CNC1C=C2,0.2153
OC12CC(C1)C2CC#C,0.3148
CCC(O)(C[NH3+])C([O-])=O,0.261
CCCC1(C)NC1CO,0.3129
C1C2CC1C21CCC=C1,0.2539
OC12C3CC1OC2CC3,0.3024
CC1CC(OC1=N)C#N,0.2848
CC1CC2(CC2)OC1=N,0.2731
CC(O)CC1=COC=N1,0.2443
CC(=O)C1OC1C#N,0.2174
C1OC2C3C4C1C4C23,0.291
C1NC1C12CC1N=CO2,0.2597
c1c(c([nH]c(=O)n1)N)O,0.1735
CC1=CN=C(N1)C1CO1,0.2298
CC12CN1C(C)(C2)C#C,0.2761
CCc1c(nno1)N,0.1967
C1CC1C2CC2,0.3399
N=C1NC(C=O)=CCO1,0.1546
COCCc1cn[nH]n1,0.2514
CCN(C)c1ncco1,0.2255
CC1C2NC2C1O,0.3113
CCC1C2CC1O2,0.316
CC1CCC(O)CC1=O,0.2254
OC12CC34C=CC(C13)C24,0.2175
CCn1c(cnc1O)C,0.2434
CC12OCC1C1CC2C1,0.3293
OCC1(CC1C#N)C#N,0.2785
C(C#N)N=COC=O,0.2609
C#CC1C2OC(C#N)C12,0.2481
CC1C2OC(CC#N)C12,0.2816
N#CC12CC3NC1C23,0.2567
CC1NC(=O)NC1C,0.3042
NC(=O)C(CO)CC#N,0.2676
CC1C2C(O)C2C11CO1,0.3127
C#CC#Cc1ncon1,0.1882
CC12CCC3OC1C3O2,0.306
c1c2c([nH]c1O)CCN2,0.2164
CC1CC(C)=CNC1=O,0.2097
NC1=NC(CO)COC1,0.2511
CCc1c(nno1)OC,0.1964
CCC(=NO)C1(C)CN1,0.2374
c1[nH]c(c(n1)N)O,0.2385
CC(=N)Nc1c[nH]nn1,0.2051
c1c(c(=O)nc(o1)O)N,0.1906
NC1CCCNC1C#N,0.25
c1(c(n[nH]c(=O)n1)O)O,0.1722
O=C1CCC2C3OC3C12,0.2134
N=C(NC=O)C1CN1,0.2213
O=CC12CC(C1)C21CC1,0.2157
OCC1CC(O)C1O,0.3051
OC1CC(O)C1=O,0.2196
CC1C(O)C(O)C1(C)O,0.2793
CC(C#C)C1=NC=NN1,0.2698
O=CC12OCC1N1CC21,0.1924
OCC12CCC1C1CN21,0.2948
CC1(C#C)C2CC1C2,0.3001
CC(C#C)N1C=CC=N1,0.2609
OCC1=CCOC1C#C,0.2535
CC12CC3C1CCCC23,0.3606
CNc1nc(on1)C=O,0.1516
CCCNc1ccoc1,0.2206
C1C2C=CC3C=CCC123,0.24
C1OC11CCC2COC12,0.3056
CCC1C2CC1C2CC,0.3787
OC12C3CC1C(O3)C2=O,0.209
OC12CC1C(C#C)C2=O,0.2148
Cc1c(c[nH]c(=O)n1)F,0.1721
Cc1nc(co1)OC=O,0.2287
NC1(C#N)C(O)C1C#N,0.2593
CC1(O)COCC=CC1,0.2584
OC1C2CC1C(=O)C2O,0.2167
CC1OC2CC(C2)O1,0.3332
OC1COC1CCC#C,0.3003
c1(noc(=O)o1)C(=N)N,0.1969
CC1OC2(CNC12)C#C,0.25
COC1CCOC11CC1,0.304
CCCN=C1OCC1N,0.2635
N#CC12CC(CNC1)O2,0.2425
OCCC(C=O)C1CN1,0.2082
CC1NC1(C=O)C1CO1,0.2192
C1OC2C1N1C=NCC21,0.2335
CCN1C(C)C1C#N,0.2616
OC1CC2C3NC3C12O,0.2829
CC#CCCCOC=O,0.2599
CCC(C)(O)C(=O)NC,0.2684
C1CC23CC1C=CC2O3,0.2424
CCN1C(=N)COC1=O,0.2524
ON=C1C=CC(=O)C1O,0.1664
COC(=O)c1cn[nH]n1,0.2413
O=CC1C2C3C1CCN23,0.2227
CCC12CN1C1CC2C1,0.3188
CCC1COC1C1CO1,0.3162
N=COCC#C,0.2834
CC12OCC=C3CC1C23,0.2089
C(C=O)OCC(=O)CO,0.2232
CC(O)C1(O)CC1C=O,0.2234
CC(CO)(CO)OC,0.3165
O=C1CC2(CN12)C#N,0.2329
c1[nH]nc(n1)CN2CC2,0.2379
C(CO)n1nnnn1,0.2531
c1nc(nc(n1)F)F,0.2387
OCC1(CN1)C#CC=O,0.2004
CCC1OC(=O)C1C,0.2812
CN=C1OC(F)=CC=N1,0.1711
C1CCC(C1)CC(=O)N,0.2785
OC12C3C1C1=CCC3C21,0.1593
O=CN1CC2CC2C=C1,0.2059
N1C2C3NC4C1C4OC23,0.2334
O=C1CC23OCC2NC13,0.185
CN(C=O)c1ccoc1,0.2209
CC(=N)N(C)C(=O)OC,0.2533
COC(C#C)C(C)O,0.301
OC1C=CCC(=O)C1O,0.2183
N=C1N=CON=NC1=O,0.1846
CC1C=CC(O)C1C#N,0.2597
C#CC12C3NC1C1C3N21,0.2453
NC(=O)C1CC2(CO2)C1,0.2745
N=COC1CC2(CC2)C1,0.2809
CC1CC(C)(O)C1O,0.3004
CCC(=O)CCC(C)C,0.235
CC(C)(O)C(C=O)C#N,0.218
O=CC1(OC2CC12)C#N,0.2147
c1c(oc(=O)[nH]1)N2CC2,0.2336
CCC12OC3CC1C2O3,0.3284
CC1CC2C3CCC12O3,0.2932
c1c(nno1)CC2CC2,0.2303
C(OC1COC1)C1CN1,0.3126
CC#Cc1cc(on1)C,0.2179
CC12CC(C1)C=CCO2,0.2493
CN1CCC1C(=O)C#C,0.1629
NC12CC1C(=O)NC2=O,0.2229
COC12CC3OC1C23C,0.2929
COC1CN(C1)CCO,0.2798
C1C2C3C=CC2N13,0.2086
CCc1ccn(n1)C,0.2576
COC1=NC(=N)N=NN1,0.1832
O=COCC1C2CCC12,0.2769
CC(=O)C1=NCCCN1,0.1753
OC1CC11COC(=O)O1,0.3154
CC1CC2(C)CC12C#N,0.2802
C(C#CC#CC=O)O,0.1795
C#CC1(CO1)C#N,0.2617
Cc1c(oc(n1)C#N)N,0.174
CC(O)(C#C)C1CN1,0.2683
CC1NC1C1(CO)CN1,0.302
C1COCCC2OC2C1,0.3289
CC1(O)C(=N)OCC1=O,0.2102
C1COc2c1n[nH]c2N,0.2245
C#CCC#CC1COC1,0.2825
OCC12COC1CC2=O,0.2157
CC1(CC(CO)C1)C#C,0.3091
COC1C2CC2C1=O,0.2073
C1CC1(C=O)NCC=O,0.2057
COC1(C)CCC2NC12,0.3115
ON=C1CN2C3CC1C23,0.2492
O=CC1COC1CC#N,0.2212
CC1=CC2CC2(C)C1=O,0.1896
CC(C)(CC(=O)N)OC,0.2709
O=CC1C2CCC12C=O,0.2059
Cc1c([nH]c(=O)o1)OC,0.2415
c1[nH]c2c(n1)C(=NC2)N,0.2201
COC(C)C(C)C,0.3314
C1OCC23OC12C1OC31,0.3015
CCC(C)(C#N)C1CO1,0.3132
c12[nH]nc(n1nnn2)O,0.2175
CC12C3N1CC=C3C2O,0.1677
c1coc(c1CO)C#N,0.2024
COC(C)C1=NNN=C1,0.2524
c1ccc(cc1)NC=O,0.2091
COC1C2CN2C11CC1,0.3085
CC1OCC1C(O)C=O,0.2068
CC12CN1CCC2CO,0.3007
CC1C(CC1(C)O)=NO,0.2512
CC12OC1C(=O)OC2=N,0.237
O=CNC12CC1N1CC21,0.251
CC1(O)C2CC2C2NC12,0.3048
CNc1cc(n(c1)C)N,0.2147
OC1CCCCC1C#N,0.3039
C1N2C3C4C5OC1(C35)C24,0.2711
CC12OC1C(N)=CC2=O,0.186
CN(C)CC(C)(O)C#N,0.2458
CC(=O)NC(=N)CCO,0.23
CC(O)CCC(=O)C#C,0.2087
COCC1(CCO)CO1,0.3354
CCOC12CC1CC=C2,0.2472
C1C=Cc2c1n[nH]c2N,0.1967
OC1CCC2(CC12)C=O,0.2312
OC(C=O)C1=NCCN1,0.1831
COCC1(CC1)C#C,0.2959
N=C1CC=C(CO1)C=O,0.1915
CC1C2C3C2C1(C)C3O,0.3222
CC1C2OC(=O)N(C)C12,0.2916
CC(C)(C(=N)NC=O)O,0.2256
CN1CC=CCC1C#N,0.2479
CC1C2CC2C2(O)CC12,0.3183
CC(=O)C1C=CC2OC12,0.2231
O=C1ON=NC=C1C#C,0.1586
OC1CCN2CC12,0.2964
OC12CN(C1)C2C#N,0.273
CCc1c[nH]nc1C#N,0.2347
CC1OC11C2NC1C2O,0.3162
CC12OC1C1(C)CC2O1,0.3124
CCC12OCC1OC2=N,0.2666
COC12COC1C2C#N,0.2842
Cc1c(cc(o1)C#C)N,0.1761
C1C=C2COCC3C2N13,0.2259
Cn1cc2c(n1)nc[nH]2,0.2116
CC(O)C1=CC2CC1O2,0.2331
OCC12CC(O)C1C2O,0.2951
OC1(C#N)C2CC1C2,0.3058
CC(=O)C1CCC(=O)N1,0.214
Cc1cn2cnnc2[nH]1,0.22
O=C1C2OC2C1C1CO1,0.2118
CC#CC(C)(O)C#N,0.275
COCC1(C)CC=CC1,0.2637
CCOCC(C)C(C)O,0.3184
C1OC11CC2CCC1O2,0.3236
CCC1CO1,0.3599
CC1CN2N=CC=C2C1,0.2604
CC12CN1CC2CC#N,0.2767
NC(=O)C1(O)CC1O,0.2483
CC1NC(=O)C11CO1,0.2586
CC(C#C)C1(C)CO1,0.3046
Cc1c(c(cn1C)N)N,0.217
Cc1cc(ccn1)F,0.2403
CC1CN=COC1C,0.2753
C1OC2C3CC1C=CC23,0.2319
C1OC2C1C1COC21,0.2814
CCC1(CCC1=O)C#N,0.2141
CC1CC1C(O)CC#N,0.3102
OC12CCC1N=COC2,0.265
OCC#CC1COC1=O,0.2588
CC1CN2C(C#C)C12,0.2606
CCC(C)OC1CCC1,0.3225
CC1CC1(CC=O)C=O,0.2104
CC1C(NC11CC1)C#N,0.2509
CCOC1CC2CC1O2,0.3273
CC1CCC1C(O)C#N,0.3001
CC1C2CC(C)(C2)C1=O,0.2249
CC1OCC1(C)C#C,0.2921
CC#CC1CCC1CO,0.2922
OCC12CC(C#C)C1O2,0.2925
CC1OC2CNC(=O)C12,0.2657
CC1CCC(C)=CC1=O,0.1902
Cc1c(oc(n1)N)C#N,0.1969
CCC#CC1OCC1O,0.2705
COC(C=O)C(=O)C=O,0.1443
C1CC2(C1)CC(=NO)C2,0.2474
CC(C)(CO)C(O)CO,0.3151
CCCC(OC=O)C#C,0.2759
COC1CCC1C,0.3265
CC(C)NC1=NCCO1,0.2787
CC1C(O)COCC1=O,0.2124
CC1NC1(C)C#CC=O,0.1911
Cc1c(c(c[nH]1)C=O)N,0.1661
C1OC2OC1CC1OC21,0.3295
O=C1CC2C3NC3CN12,0.2624
c1c([nH]nc1OC=O)N,0.2247
CCC1(C)CC2C(C)C12,0.326
CC1(CC2CC12)C#N,0.3135
CCC1(O)CC(=O)C1O,0.2192
C#CC1C2C3C=CC1C23,0.2347
CNc1c(nco1)N,0.2126
CCCC(C)(C#C)C#N,0.2959
O=CC1CCC=CC1=O,0.1811
C(=N)NC(=N)C#N,0.1952
c1coc(n1)CO,0.2447
C1CC2(C1)CC(=O)CO2,0.2178
c1cnc(nc1)NC=N,0.188
NC(=O)N1C=NCC1=N,0.2282
Cc1c[nH]c2c1[nH]cc2,0.208
CC12C3C1N1C3C21CO,0.2742
COCC1CC2COC12,0.3133
c1coc2c1CC(=O)N2,0.1985
CC1(O)C2OC2C1O,0.3083
CCC(CC)CCC#C,0.3157
CC(CO)CC#CC=O,0.2054
N=C1OCC(O1)C1CO1,0.3101
CCC1C2OC2C11CN1,0.3165
CCOc1cnn(c1)C,0.2284
CC1(O)C2OC1C2C=O,0.2242
O=CC1NC(=O)C1C#C,0.2119
CC1CN(C1)C(=O)CO,0.2684
O=CC1C2CC(C#N)N12,0.2116
NC(C#C)C(=O)NC=N,0.2177
N=C1CCCOC(=O)O1,0.2683
NC1=[NH+]C2C(O)[C-]1C2=O,0.1547
OC1CC11NC(=O)C1O,0.2593
CC1N2CC1(CC#N)C2,0.2704
OC(CC=O)C(=O)C#C,0.1692
CC1OCC1(CO)CO,0.2944
CC12OC3C1CC(O)C23,0.2924
O=C1C2C3C2N1C3C#N,0.2404
C1CC11C2NC2C2OC12,0.3053
c1[nH]nc(n1)COC=O,0.2611
CC#CC1OC1C1CO1,0.2719
O=C1OC2CN3C2CC13,0.2336
CCN(C)C(C=O)C#C,0.1943
O=CNCC1NC1C#C,0.2719
OC12C3NC3C1NC2=O,0.2466
C#CC1=CC2(CC1)CC2,0.1981
CC(C)N1C2C3OC3C12,0.2618
CC1(C)NC11CNC1=O,0.2686
CCC1CC2CC(O)C12,0.3134
COC12CC(C=C1)C2O,0.2388
CC1C(CC#N)OC1=N,0.2887
NC1CN(C=O)C1C#N,0.2613
CCn1ncc(n1)O,0.2314
COC12CC1CC2C#N,0.2901
OCC1CCOC(=O)C1,0.2712
C1=CC2C=CC3C1N23,0.2108
CC#CCC(C)C1CC1,0.3023
COC(=O)N1CC1CO,0.2854
OCC1COC(=N)C1,0.2856
C1C23CCOC12C1NC31,0.2652
CCc1ccccc1C,0.2357
CC(O)C#CC(O)C#C,0.2667
CC1CC1OCC#N,0.2775
Cc1nnc2n1nno2,0.1856
N=C1NCC11CO1,0.2518
COC(=O)CO,0.2737
CC(O)C1(CC1C)C#C,0.2886
CC1C2C3CC1(C#N)C23,0.2885
CC1CC2C3C(O)C1N23,0.2924
CCCCC(=O)CC=O,0.2106
CC1COC(=O)C=C1,0.2161
C#CCC12COC1CO2,0.2856
CC1CC2(CO2)C1C=O,0.2213
CC1CC11CCC1=NO,0.234
O=C1CCC(=O)C2OC12,0.2096
C1C2CC11C=CCCC21,0.2539
CN(C=O)c1conn1,0.1932
CC1(CO)OCC(=N)O1,0.2801
C1CC(C1)(CO)OC=O,0.2747
CCn1c(=NC)ocn1,0.2092
CC1=CCOC1,0.2501
OC1CCC1CN1CC1,0.2976
CCc1nn(c(=O)o1)C,0.2383
CCCC(C)C(=O)C=O,0.1539
OCCCC(O)CC#N,0.3012
Cc1cn(c(n1)O)C,0.247
O=C1CC2(NC12)C#C,0.2092
N=COC1OCC2CC12,0.289
COc1cnc(cn1)O,0.1747
C1C2COC3OCCC123,0.3359
CC(O)C1=CNC(N)=C1,0.2351
CCC1(CCN1C)C#N,0.2576
CN=C1C2(CC2)CO1,0.2714
CCC12NC1C(C)C2=O,0.2158
CCOC1CC1(N)C#N,0.2697
COC1OCC=C1,0.2621
CCCCC1=NCCO1,0.273
OC1CC1C#CC1CC1,0.2693
CC1CCOC(C1)C=O,0.2121
CCC#CC1CC1C,0.2781
CC1(C)OC2COC1C2,0.3251
CC12CCC1C2O,0.317
Cc1cc(=O)c(n[nH]1)N,0.179
OC1(CC2CN2C1)C=O,0.1905
OC1C=CCC11CO1,0.2498
C1CC23OC2CNC3=N1,0.2422
CN1C=CCC(=O)C1=N,0.1452
CCCCC(=O)C(C)O,0.2366
CC1=C2COC2COC1,0.2464
CC12CC1C1CC21C=O,0.1977
CC12C3CC1C1OC3C21,0.2952
COC1(CC1)C(O)C#C,0.2785
N#CC1CC2C3CN2C13,0.2783
CCC(=O)N1C2CC1C2,0.2482
CC1CC23CC1C2CO3,0.2946
OC1C2CCC3OC2C13,0.294
CN1C2CC2NCC1=O,0.2359
CN1CC1(C=O)C(N)=O,0.1874
C1OC2OC3C4C2N4C13,0.3175
CC1N2CC2C11CN1,0.3018
OC1CC1C(=O)N1CC1,0.231
C1CC2OC=NCC2=C1,0.2514
O=C1OCC1C1CCO1,0.2624
C1CC2(C1)C1COC21,0.3058
ON=C1C=CCC2CC12,0.1902
CCCNc1[nH]ncn1,0.2506
CC1C(O)C2OC12CO,0.3139
CCNc1coc(n1)N,0.2231
C(=O)C(=O)C(=O)C=O,0.0983
CC1=CCC2CC12CO,0.2494
CN(CC1CC1)C(=O)N,0.2897
CC12OC3C1CC23O,0.2972
CNC(=O)NCCO,0.2997
COC1C2C3NC1C23O,0.2786
CC1NC1C1(CC1)C#N,0.2908
CC1(CN=C(O1)C#C)C,0.2177
CCN1C2CC2C1=O,0.249
CN(C)c1nc([nH]n1)N,0.2266
CC(O)C1=NC=CC=N1,0.2022
CCC12CC1CO2,0.309
O=CC12CN1C(=O)CC2,0.2195
C1C2CC3C=CC2C13,0.2479
OC1C2CC2(O)C1O,0.3015
COCC(C)CC(C)C,0.3308
OC12CN(C1)C21COC1,0.3101
C1NC1C12CC3CN1C23,0.3063
Cc1c(nno1)C2CC2,0.2106
CC1C2C1C(C)(O)C2C,0.3091
C1C=CCOC(=O)C=C1,0.2224
OC1C2OC2C1N1CC1,0.2965
O=C1OC2CC3CC2C13,0.2654
C1C=CN(C1=O)CC=O,0.1835
OCC12NC(C1O)C2O,0.3033
CC1NC(C=O)C1(C)O,0.2082
c1c(c2c(o1)COC2)N,0.2227
NC(=O)CC1CC(O)C1,0.2776
c1cc(c(nc1)F)N,0.1985
COCCC(=O)C1CO1,0.2166
c1(=O)c(=O)onc(o1)O,0.1903
CCC1(CC=CC1)C#C,0.2656
CC(=O)C1COC(=O)N1,0.2215
CC(OCCO)C#N,0.2758
Cc1c(nc(o1)CN)N,0.2031
CC1C2OCC12C=O,0.2213
CC1CC1(C)C(C)(C)O,0.3198
O=CC1C2CC1OC2,0.2124
CC([NH3+])C1=NON=C1[O-],0.2237
CC(C)C(=O)C#C,0.2046
O=C1NC=NCC2NC12,0.2191
CC1(CC1O)C1CCC1,0.3285
c1c(n2cnnc2o1)N,0.2215
Cc1cc(c(n1C)C)N,0.2179
N=C1NC=CN1C=O,0.1785
CCC(CC#C)C1CO1,0.3136
CCC(C=O)C#CC=O,0.1956
OCC12CC(O1)C1NC21,0.3011
CCC1CC1C#CC=O,0.2037
OC12CCC3OC1C23O,0.2761
NC1(C#N)C2C3NC3C12,0.2432
C1CC(C1)C(=O)C(=O)N,0.1758
C#CC1C2CC1(O2)C#C,0.2538
COC1C2NC2C11CN1,0.2982
C#CC1C2C3C2N2C3C12,0.2797
CCC1(C)C2CC1O2,0.319
c1cocn1,0.2519
OC1C2CN2CC11CO1,0.2869
CC(C=O)C1NC1C#C,0.2264
O=C1C2CCOC1CO2,0.2016
Cc1c(oc(c1O)N)C,0.2139
Cc1c2n(c(n1)O)CC2,0.2521
CC(CO)C1CC(C)O1,0.3194
CC1(COC1)C#CCO,0.2758
OCC1C2C3NC3C12,0.279
c1nc(no1)C(=O)C#N,0.1954
CC1C2CC1C1CC1C2,0.3398
O=CC1CCC(C1)C#C,0.2275
c1c2n(nc1O)CCC2,0.2417
C1C2OC34COC3C2C14,0.2933
N#CC12CCN1CC=C2,0.2317
CC(C)(C)c1ncco1,0.2454
CC(O)(CCO)CC=O,0.2215
CC12C(O)C1CC2CO,0.3057
O=C1CC2(C1)C1CN2C1,0.215
C1CNc2c(non2)N1,0.2047
CC#CC1CCC1O,0.2887
c1cnc(cc1N)C=O,0.1788
Cn1cnc(c1O)OC,0.2163
CC(O)C12COC1CO2,0.298
CC1(COC1)COC,0.3202
OC12CC1CC(=C2)C#C,0.1994
CC1OCC2(CO)CC12,0.3172
C(=O)C(=O)C=O,0.1151
CC12NC3C(NC13)C2=O,0.1954
CC1=NOC(=N)N=C1N,0.1647
CC12OC(=N)C3OC1C23,0.2408
CC1N=C2OC3C1C23,0.1618
O=CCC12CC1CC2,0.2195
C#CC12CC(C1)OCC2,0.2864
C1OC11C2OC3CC2C13,0.3084
C1CC23OC4(CNC24)C13,0.2019
c1c(c(nc(n1)F)N)O,0.1996
CCC(CC#N)N1CC1,0.2786
c1cnc(nc1O)N,0.2096
CC1OC(C)(C)C1(C)O,0.3026
CCC(=O)CCN1CC1,0.2241
C#CC(=N)N(C=N)C=N,0.1979
CNc1c(c(c[nH]1)O)O,0.221
CCC(O)(CO)CC#C,0.3001
CC1C(O)C1(CO)C=O,0.2245
OC1CC2COC(C2)C1,0.3171
C1C2OC3CNC2C1O3,0.2858
OCC1OC(=N)CC1=O,0.2148
CC1N(C)C11COC1=N,0.2541
CC(=O)C12CC(C1)CO2,0.226
CC1C=CC2=CC=NN12,0.1901
CC1C=C(C)C2CC1O2,0.241
N#CC1OCCCC=C1,0.2475
OCC1C2CCC(=O)C12,0.223
N#CCN1C2C3CC3C12,0.2626
O=C1C(CC11CN1)C#C,0.2044
CCN1C(CO)C1C=O,0.1909
CCc1c(c[nH]n1)OC,0.2367
CC(C)OC(C)C1CO1,0.3235
CCC(C1CN1)C(N)=O,0.2663
C1C2C3COC4C1C2C34,0.3131
O=CCC12OC1C1NC21,0.1959
NC(=O)C(=O)C(O)CO,0.1629
CC(C)CC(C)O,0.3329
OCC1=CCCC1C=O,0.2046
CC(O)(C#N)C(=O)C#N,0.1922
C1C2C3OCCN1C23,0.284
N#CC1(CC2CO2)CC1,0.3072
C1CCC(C1)C#CCO,0.2741
C1C=C(C(=O)CO1)C=O,0.1537
OCC(CC1CC1)C=O,0.2273
COC12CN3C1C(C)C23,0.3207
NC(=O)C1(N)C2CC1N2,0.2485
OC(CNC=O)CC=O,0.2244
CC1C2CC1(O)C1OC21,0.3148
CCCC(=O)C(C)C#N,0.2319
CC1C23CC=CC12CO3,0.2299
CC12NC1CC2O,0.3068
CN1C2C3CC1(C)C23C,0.2897
CC(CO)N1C=NC=N1,0.268
CC1N(C)C(=N)C11CO1,0.2461
COCC1NC11COC1,0.3027
OC1CCOC1=O,0.2745
CCc1ncc(o1)CO,0.2351
OC1C2CCC3CC3C12,0.3067
O=C1CCN2CCC12,0.1916
CC1C=CC(C)(O)C1O,0.2617
O=CNC1C2C3CC3C12,0.2445
CCC(C)C1CN=CO1,0.271
OCC1OC2=NCCC12,0.2629
C1OC1C12CCC1O2,0.3188
CC1OCC2(CC12)C#C,0.2875
CC1C2C3N2C(C)C13O,0.2943
CC(CO)(C#C)C1CC1,0.2985
CN1C2CC1(CO)C=C2,0.2235
CC12CN1C(=NC2)C#C,0.2053
Cc1cc(ncn1)C,0.2132
Cc1cc(co1)C(=O)C,0.1941
OC1=CC(=N)NC=N1,0.1755
O=C1OCC1C1CC1,0.2752
O=C1C2CC3N2C13C#C,0.2273
[NH2+]=C1NC[C-](C=O)C1=O,0.1393
CC(=O)CN(C)C(=O)N,0.216
CC12CC3(C#C)C(O1)C23,0.2614
NC(=O)C#CCOC=N,0.2298
CC1C=CC(C#N)C1=O,0.2211
OCCC1CC(O1)C#C,0.2774
CC12OC1CC1COC21,0.305
NC(=O)C1CC(CO)O1,0.2645
CC1(C)NC1(C#C)C#N,0.2549
CC1C2CC(C)=CC12C,0.2417
CNC(=O)C(C)C(N)=O,0.2498
OCC1(CC1C#C)C=O,0.2188
OC1CC2C3NC3C2=C1,0.2335
CCOC(C)C(C)(C)O,0.317
C1C=CN(C(=O)O1)C=O,0.228
CC1CC23CC(CC12)O3,0.3249
CC1(O)COC1C#C,0.2648
CC1(CO1)C(O)C1CO1,0.3425
CC1C2CC2OC1C#N,0.2728
Cc1ccc(nc1C)O,0.2064
C1CNC(=O)OC=NC1,0.2532
CC1C2NC2COC1=N,0.2782
CC1COC11CC2OC12,0.31
CCc1c(coc1N)N,0.2187
CC12COC(C1)C(O)C2,0.3136
CC12CC1OCC(=O)N2,0.2563
CC1(N)C2NC(=N)C12O,0.2273
CN1CC1(C=O)C1CO1,0.1944
N#CC1(CN1)C1CCC1,0.2853
CCC1(C)COC1CO,0.3081
CC(=O)N1CC1C#C,0.2532
O=C1CN=C(O1)C1CN1,0.2338
CC1C2CC1C2C,0.3921
O=C1CC2NC12C#C,0.2147
OCC1C2COC1C2=O,0.2078
O=C1C2NC1C1CC2O1,0.2351
CNC(=O)C(=O)C1CN1,0.1762
CC1CC(C)C(=O)C=C1,0.1886
OCC(O)C1(CO1)C#C,0.2664
C#CCNc1ccno1,0.2233
CC1CC2CC12CC=O,0.2189
CCC1CC(O1)C1CO1,0.3221
c1c(nno1)CCO,0.2241
CC(C)C1(C)CCC1O,0.3264
CC1OC(C)=NCC=C1,0.2293
O=C1CCC(O1)C1CN1,0.2577
N=COC1C2OC=NC12,0.2555
CC12CN1CC2=O,0.2236
CC1CCC2(CO2)C1C,0.3251
CCc1cc(n[nH]1)CO,0.2565
CNc1cnc(o1)NC,0.2258
CN(C)C1=NOC(=N)N1,0.2419
CN=c1[nH]c(=O)nn[nH]1,0.176
O=CC1N=C2CC3C1N23,0.1857
CC1CN2CC2C11CO1,0.3005
CC(=O)C1COC1C#N,0.2288
OC1C2CC=CN2C1=N,0.2193
CN1N=CC=C(C)C1=N,0.1615
CC(O)COC(C)=O,0.2657
OCC1COC(C1)C#N,0.297
OC(C1CO1)C1COC1,0.3122
N#CC1OC=NC11CC1,0.2491
CN(C=O)C1CC1C#N,0.2632
CC1=C(C=O)C2CN2C1,0.1705
CCC#CC1CC1C#N,0.2637
CN(C)C(C#N)C1CN1,0.2668
CC1(C)CC2CC2C=C1,0.2521
OC12CC3NC1(C=O)C23,0.2005
c1c([nH]c(=O)cn1)C=O,0.1437
CC12C3OC(C13)C21CC1,0.3035
C#CC1NC11CN2CC12,0.2563
NC(C#N)C1CCCC1,0.2834
CC(C)(C)N=COC,0.2706
C1C2CC3OCOC1C23,0.315
CC1C2COC(=O)N12,0.2828
Cc1[nH]c(cn1)OC=O,0.2128
CC(O)C(=O)C1CN1,0.2258
CNC1(CNC1=N)C#N,0.2498
CC12CCC1C(O)C2O,0.2931
C1CC12CC=CC2=O,0.1952
CCC#CCC(N)C#N,0.276
CC1CC2CC1(O)CO2,0.3047
OCC1CC1(O)CC#C,0.2911
C(C#CCOC(=O)N)O,0.2839
OCC1COC(CO)C1,0.3119
C#CCc1ccncc1,0.2294
CC12CC1CC1CC21O,0.3128
O=C1COCC2OC2C1,0.2072
CC12CN(C1)C(C2)C=O,0.2116
CCOc1c(nc[nH]1)O,0.2245
CNc1c(cno1)CO,0.2172
c1c2c([nH]n1)OCOC2,0.2484
C#CCn1nccn1,0.2567
OC1C2C3C4N3C1C24O,0.2701
O=C1NC2CC(C#C)C12,0.2681
C1N2CC11CCOCC21,0.2972
CC(C)Nc1ccc[nH]1,0.2274
CCC1(COC1)C#N,0.2894
N=C1NN=CC=N1,0.1473
COc1conc1OC,0.2326
COc1c(non1)CO,0.2284
C1CN1C1C2C3CC2C13,0.3165
OC1C(O)C1OC=N,0.2352
c1cc(cc(c1)O)C=O,0.1753
CC1NC1C1(C)CC1O,0.3125
C#CC12CCC=CC1O2,0.2327
COCC(=N)OC=O,0.2403
OC1C2C(C#C)C2C1O,0.2811
CC(C)C(CC#N)C=O,0.2236
CC1COC2CN3C2C13,0.3102
CC1CC11C=CC2NC12,0.2355
O=C1C2C3C1C(=O)CN23,0.2054
N=C1OCC11CCC1,0.2831
OCCCC1OCC=C1,0.2481
CC1(CO1)C(O)C(N)=O,0.2664
C1C2C3C4OC1CC2C34,0.3046
c12c(n[nH]c1[nH]nn2)N,0.2007
CC1(CN1)C(=O)C(N)=O,0.1851
CC(CCO)CCCO,0.3417
C1CN(C=C1C#N)C=O,0.1809
CN=c1ocno1,0.2319
CC(O)C1CCC11CN1,0.2927
ON=C1C2CC1(O)CC2,0.2606
CCOc1ncc(o1)N,0.2404
CCC12COC(C1)OC2,0.3175
COC(CO)CCC=O,0.227
CC1C2C3C1OC23C#N,0.2477
C#CC(C1CC1)C1CO1,0.3064
CC(C)C1C2OC2C1C,0.3261
FC(F)(F)C(=O)C1CN1,0.2116
CCCCC1C2COC12,0.3105
OC1(CCOC1)C1CN1,0.303
CC1OC(=N)OC1(C)C,0.309
CC1(O)CC11CCCC1,0.3207
CCOC(=O)C(C)O,0.2702
O=CC12CC3C1C=CC23,0.1867
Cc1conc1C#N,0.224
CCC12CCC3C1OC23,0.3061
CC(C)C(F)(F)F,0.4298
CN1C(=N)C2CC2C1=O,0.2375
C1C2CC=C3CC=C1C23,0.2017
CCN1CC1C1CO1,0.3134
C1CC(C1)CNC=O,0.2825
CCC(=O)COC1CC1,0.2157
Cc1cc(n(c1)C)C#N,0.2041
CC(=N)N(C)C(=O)C#N,0.2043
CC1=NOC(=N)C(F)=N1,0.1759
CCC1CCC=CC1=O,0.1888
NC1=C2C3CC3N2N=N1,0.1951
OC(C#N)C1(O)COC1,0.2857
CCOC1C(C)C1C,0.3127
OC1CC1(CC=O)C#N,0.1947
OCCCC1C2CCN12,0.302
Cc1cn(nc1N)C=O,0.1916
CC1CC(C1)C#C,0.3049
CC12OC1CC1OC21C,0.3238
c1cnccc1CO,0.2301
CC#CCCOC1CC1,0.3035
CC1=C(O)N=CC(=N)N1,0.129
COCC1CCOC=N1,0.2646
CC1CN1C(=O)NC=N,0.2477
O=CC12CC1COCO2,0.2286
OC1COC(=O)CC1=O,0.2281
Cc1ccnc(c1N)C,0.2013
CC(C)C1(O)CC1(C)C,0.3143
COC1(C)CC1OC=N,0.2797
NC(C=O)=NCC1CN1,0.1849
CC1(OCC11CN1)C=O,0.2086
CN=C(C(=O)C#N)N,0.1612
CC(C1CN1C)C(C)=O,0.2032
C#CC1CC2CC2C=C1,0.2491
CC(O)C1=NC=CN=C1,0.1992
CC(C)(C)OC(=O)NC,0.3133
CC(CC(N)=O)C#N,0.2783
CC(C)N(C)C(=N)C=O,0.159
OC1CC1(C#N)C#N,0.2761
CC(C)C1=NC(C)CO1,0.27
OC1COC1CN1CC1,0.2845
CC1(OCCC1O)C=O,0.2089
CC1CN1C12CC1CC2,0.3002
C1CC1C(C#N)C2CC2,0.3261
c1c2c(no1)OCC2,0.2402
CC1=NC2C(O)C2O1,0.2552
CC#CC1CC1O,0.2819
c1c(coc1C2CC2)N,0.2137
CC12NC1C(=O)C2C=O,0.2011
N=C1NN=NN1C1CC1,0.1934
OC12C=CCC3CC1C23,0.2435
COCC1C2CCC12O,0.3244
N=COCC1OCC=C1,0.2402
c1nc(no1)CCC=O,0.2251
CC(CO)OC(=O)C#N,0.2183
CC1CC2(CCC=C2)O1,0.251
c1c(non1)C(=O)C#N,0.1969
CN=C1NC(=O)NC=C1,0.1969
CCC12CC1(O)CCO2,0.2974
CC1CCC(=N)NC1=O,0.2447
C1CC2(CC2)C=CC=C1,0.185
CCCc1c[nH]nc1C,0.2583
CC1=CCC2CCC2C1,0.2574
C1CC1(C#N)OC=O,0.2735
CC1CC(CC2CC2)C1,0.3555
COC1CC1CC1CC1,0.3302
c1n[nH]c2n1nnn2,0.2229
CCC1C2OC3CN1C23,0.2786
COC(=N)NC(=N)OC,0.2656
C#Cc1nnc(o1)C#C,0.189
CC1N=C(C)OC1=O,0.2472
OC12C3OC1COC23,0.2801
CC12CC=CC(=O)C1O2,0.1874
C1C2COC3OCC1C23,0.3121
CCOCC=O,0.2294
OCC1OC(=O)CC=C1,0.2581
C1CC(O1)C1=NNC=C1,0.2556
C1C2OC3CC12N=CO3,0.2366
CNc1cocc1C=O,0.1633
CCCOCC1NC1C,0.3246
CCNC(=O)C(=O)N,0.2112
COC12CC(C)(C1)C2C,0.3351
CC(=O)CCCOC,0.2352
O=C1C2CN2CC1C#C,0.2092
N=C1OC=CC(=C1)C#C,0.1499
FC(F)(F)C(=N)N1CC1,0.2465
CC12CC3C(C1)C23O,0.299
CC(=O)CN=COC=O,0.2291
CCCOCCC(=O)N,0.279
CCC1=CCC(C1)C#N,0.2589
CCCC12CC1C(C)O2,0.3135
NC(=O)N1C2CC(=O)C12,0.2115
N=COC12CC1OC2=N,0.2676
CC1COC(=O)OC1=N,0.2739
CC12CC1OCCO2,0.3098
c1ccc2c(c1)non2,0.1634
CC(O)C1=C(C)N=CN1,0.2387
O=CC1=CNCC2NC12,0.1853
NC1CC(=O)NC1=O,0.2264
O=C1COCCC2CC12,0.2091
C#CC#CCCCC=O,0.2151
C#CC1(COC=N1)C#C,0.267
N=C1N=NN2CCC2=N1,0.1784
OC12CC1C1CCC21,0.3121
CC1CC2C(OC12)C=O,0.2106
COC1(C#N)C2COC12,0.2574
COc1cc(oc1O)N,0.2122
CCC1COC1C(C)C,0.3181
CC1C2C(=O)NCC12O,0.2644
OC1C2CC3C4C1C2N34,0.2984
ON=C1C2CC(O)C1N2,0.2445
CC1=CCCCC11CN1,0.2406
OC1C2C3CCC2C13,0.3277
CCC12C3C4C1C4(C)N23,0.2816
CCC1CC(C1)=NO,0.2496
O=C1CC2COC12C#C,0.1963
COCC1CC2C(C)C12,0.3327
N=C1NCC=CNC1=O,0.1896
C#CC#CCC1CCC1,0.2303
O=C1OC2C3CC=C1C23,0.1954
CC1C2CC1C(O2)C=O,0.2132
CC1(CCCC1O)C=O,0.2269
CC1C2CCC1(CO)O2,0.3208
CC1CN2CC2C1C#N,0.2769
N#CC12C3C4C3N1CC24,0.2418
Cc1c(nc[nH]1)C#N,0.2285
CC1OC11C2CN2C1C,0.3066
CC(=O)C(=O)C1CC1,0.1584
CC1(C)C2CC1C2O,0.3322
OC12CC1C1N=COC21,0.2642
CCC1(CC(C)C1)C#N,0.3354
CC12CN=CN1C2C=O,0.2006
CC1CCCOCC=C1,0.2468
O=C1C2CC11OCC1C2,0.212
OC12CC1CC2OC=N,0.2786
CC1C2CCC(O)CC12,0.3233
C1C2CC1OCC2,0.319
CCN1CC1CC(N)=O,0.2682
O=C1C2C3CC4C(C23)N14,0.2372
CC(=O)c1coc(=O)[nH]1,0.1714
CCCC(=O)C#CC=O,0.1947
O=C1NC2CCC1C=C2,0.2267
CC#CCCCCC#C,0.2988
C1OCC11C2C3OC1C23,0.3097
CC1(O)C2CC1(C)OC2,0.2944
CC12CC(C1)CN=CO2,0.275
Cc1ccnc(n1)C#N,0.2027
N#CC12C3CC=C1CN23,0.1742
CC1OC2CC1(C2)C=O,0.2171
C1C2CC3CCC1C23,0.3405
CC1COC1CN1CC1,0.3085
N=COC1CC1OC=O,0.2779
CC(C)(C1CC1)OC=O,0.2782
C1OC11CC2OCCC12,0.31
CC1CCC2(CC1)CC2,0.3443
CCCC(C[NH3+])C([O-])=O,0.2746
CC12OC(CCO1)C=C2,0.2515
Cc1cc([nH]c1)C#N,0.2066
C1C(CO1)NC(=O)CO,0.2727
COC(CO)C(C)C#N,0.3027
[O-]C(=O)C12C[NH2+]C1CN2,0.2403
CCCC1C(C)OC1=N,0.2887
CC12COC1C(=O)CC2,0.2007
CC12CN3C(C13)C2O,0.3064
CC(CC1CC1)C#N,0.3292
C1C=Cc2c1nc(o2)O,0.1773
O=C1CC=CC(O1)C#C,0.2498
CC1C2C3CC2C(C)C13,0.361
CCCC(C)OC=NC,0.2735
CC(=O)CC1C2CN1C2,0.2138
Cc1c[nH]c(n1)OC=O,0.2079
CC1=CC2C3CC2C3C1,0.2432
NC1=CN=C(O1)C1CO1,0.206
CC12CC1(C)C1OC21,0.3321
COCCC(CO)C#N,0.2884
CCC(=O)c1ccno1,0.1934
Cc1c[nH]nc1C(C)C,0.2572
CCC1C2OC(C#C)C12,0.2561
Cn1ccc(c1O)O,0.2287
CN1CC2OC2C1C#N,0.2586
CCOC1C(O)C1(C)C,0.2948
COC1(C)CCCC1O,0.3242
CC1CC2CC3C(C2)C13,0.3318
C1C2C3OC4=NCC13C24,0.1627
CC12CC1(CCC2)C#C,0.2849
CCCc1nc(co1)N,0.2138
C#CC1CN2N=NC=C12,0.2598
CC(C)c1cnn[nH]1,0.2527
CC1C2CC(O)C(C)N12,0.2769
OCC1(O)CC1OC=N,0.2683
COC1C=C2CC3C1C23,0.1813
c1nc([nH]n1)COC=O,0.2574
C1CC2(C1)C1C3C2CN13,0.3133
CC1COCC2CC12O,0.3134
CC1C(O)C(O)C2CN12,0.2703
OC1C2C3C2C1(O)C3O,0.3123
O=CC1CC(=O)CO1,0.2071
O=C1NCC2OCC=C12,0.2134
c1coc(n1)C(=N)N,0.2039
CCC(OC=O)C#C,0.2763
c1cc(ncc1F)O,0.1996
O=C1CC2OCC2O1,0.2712
CC1OCC1C=O,0.2153
N=C1NC2=C(CCO2)O1,0.2207
c1c(con1)NCC=O,0.183
CC12CC3C4C3C1OC24,0.3279
CN1CC=CC(=O)C1,0.1716
O=C1C=C2CC3C2N13,0.1508
C1OC2COCCC=C12,0.246
O=CC1CC11C2CN1C2,0.2252
C1C2(CN1CC#N)CO2,0.2592
CC1CCN1C(N)=O,0.2882
CCC12CC1(CO)OC2,0.2916
COCC1CN1C(N)=O,0.2794
N=COCC(=O)C#N,0.1788
O=C1CCNC1C#C,0.1996
CCCC1(C)CC2NC12,0.3121
CC12CC(O1)C1CC1C2,0.3202
c1c2c(nc([nH]2)N)on1,0.2003
OCC12CC1C(=O)C2,0.2319
CC(=O)CC(C=O)C#C,0.2152
C#CC1=CCC2CC2C1,0.2123
OC12CCC3OC1CC23,0.2953
CC1(CC1)c2nc[nH]n2,0.2455
COC12C(C)C1N1CC21,0.2838
C1CCC2(C1)CCCO2,0.3191
CCC1C2CCCOC12,0.2991
CC1=C(C#C)C2CC1C2,0.1893
OCC1(O)CC1(O)C#C,0.2737
CC1=CCC(O)C1O,0.2614
CC1CC1C1CC2CC12,0.3346
C1C=Cc2c1onc2N,0.1985
CC12OC3(CO)C1OC23,0.292
CN1C2CC1C2(C)C#N,0.2444
CC(O)C1=NON=C1C,0.2379
OCCOC1CC1CO,0.3224
OC1C2C3CC1OCC23,0.3047
COC1C(=O)C2CC12C,0.2078
C1C=CC23OC4C2OC134,0.2179
OCC1C(CO)C1C#N,0.2952
CCC1C2CC1C=C2,0.2407
O=CNC12CC1CC2=O,0.2262
N#CC1OCC11CCC1,0.2749
Cc1c(n(cn1)C=O)C,0.1828
OCC(O)C1CC1C#N,0.2901
CC#CC(O)C#C,0.2678
CC12CC(C)(C)C1C2O,0.3096
CC(O)C(CO)N1CC1,0.3039
CCC(C)C1=NNN=N1,0.2599
CC1C2COC2C=C1C,0.2508
O=CC1=CNCC1C#C,0.1836
C1C2C3C4=CCCC13C24,0.1887
CC1NC1CN1CC1C,0.3007
CN1CC=CC1=O,0.2104
C1c2c(onn2)C(=O)N1,0.2039
O=CCOC1=NCCN1,0.1922
CCCC1COC1CO,0.3104
O=C1NC23CC(C2)C13,0.2497
CC1=CCC2CC1C2=O,0.2154
CC1C(O)C(=N)N1C=O,0.224
CC(=O)CCC1CO1,0.2348
CC12CN3C1C(C#C)C23,0.2764
CCC(=O)CC1CO1,0.2297
CCn1nc(c(n1)C)C,0.2441
N=C1CN2N=NC=C2N1,0.2112
OC1C(=O)CC=C1C=O,0.1834
CC1CC2(O)C3NC3C12,0.289
CNC(=O)NCCCO,0.3044
OC1CCC2=C1OC=C2,0.2291
CC(C)(C)C1C2CC1C2,0.3675
C1CCN(CC1)CC#N,0.2593
OCC1CC2CC2C=C1,0.2518
CC1(C)C2OCC12C#C,0.2617
COC1C2OC(C)OC12,0.3118
CCC1CC(CC)C=C1,0.2602
CC1C(C#C)C2NC12C,0.2769
CCC12CC(C)(N1)C2=O,0.2437
OCCCC(=O)C1CO1,0.2246
COc1c[nH]cnc1=O,0.2029
C[NH+]=C1NC=C[C-]1C#N,0.2084
CCCOC(CC)CC,0.3247
Cc1cc(c[nH]1)CO,0.239
OCCC1CCCO1,0.3288
CN=C1OC2(CC2)C1O,0.26
CC1C2CC2C2(C)OC12,0.3351
CCn1cc(nc1)C#C,0.2194
N#CC1C2C3C4C2C1N34,0.2728
CC(=O)C(=O)C1(C)CN1,0.1628
CC(C=O)N1C=CC=N1,0.2082
ON=C1C=CC2CC12O,0.1863
C#CCOc1ccco1,0.2232
C1C2OCCOCOC12,0.3008
ON=C1C2CN2CC1=O,0.1547
CCC1(C)CC11COC1,0.3045
CC1(COC=N)COC1,0.2696
OC1C(NC1=N)C1CN1,0.2631
CC1(OC1CC=O)C#N,0.2234
N=C1OC23CCC2C1C3,0.2704
C#CC#Cc1c[nH]cn1,0.1858
CN=CN(C=O)C(=N)N,0.2129
O=CC1=CC2CCC1O2,0.1896
CN1C=CC=C1OC=N,0.212
CCC1(C#C)C2COC12,0.2691
C(CO)N=c1onno1,0.1876
C[NH+]1CC2CC12C([O-])=O,0.2473
C1CN1C1CC11CCO1,0.2904
CC1OC(C)C(=O)C=C1,0.1766
CC1=C(CNCC1=O)N,0.1917
CCC#CCC1CO1,0.2966
c1nc(=O)c(c(o1)O)N,0.1679
CC1CC2CC3(O)C2C13,0.3099
C1C(CO1)c2nnon2,0.1874
OC1CNC1C#N,0.2692
OC1COC(=N)C(O)C1,0.2698
CC1C2N3C1C=CC23C,0.2152
COC1CCCCC1C,0.3222
CC1CCC(OC1)C#C,0.2868
CCCCC1(CC1)C#C,0.2958
CC1C2CC3C2CCC13,0.3673
C1CC11C2CCC1C=C2,0.2556
CCC12CCC1C(O)C2,0.3196
CC#CCn1cnnc1,0.26
C(c1nc(no1)C#N)N,0.2022
CC1C=CN(C)C1=O,0.2089
CCC1(C)C(C)CC1=O,0.2174
Cc1c[nH]nc1N2CC2,0.2385
CC1CC1(C)CC#N,0.3152
C1CC(=O)NC1=O,0.2404
CC(C)C1C=CNC1=O,0.2122
OC1CC2CC(O2)C=C1,0.2351
CCCCC1CCO1,0.3293
OCC(C#N)C(O)C#C,0.2827
OC(C#N)C1CC2NC12,0.2596
CN=CNC(=O)CCO,0.235
OC1C2OC(=O)C12C#N,0.2526
CCNC(=O)C(C)(C)O,0.2679
CC1(CCC(=C1)C#N)C,0.2203
CCOC(=N)C#CC#C,0.1987
CC1CC2=C(C1)C=CN2,0.238
CC1OC23CN4C2CC134,0.2454
C1C2OC1C1=NON=C21,0.2372
C1COCCO1,0.3304
c1cnc(cn1)CCO,0.1954
O=CC12NC1C1COC21,0.2113
C1C(CC1=O)CCC#N,0.2232
C1C2CC1OC=NCC2,0.2548
O=C1C=CNCC11CN1,0.185
OCC1CC2CC(=O)N12,0.2332
CN=C1NC(C)C2OC12,0.2422
CC1(O)CC1CC#N,0.3014
CC1(O)CC1C(=O)C=O,0.1551
OC1C2C3CC(C3)C12O,0.3126
C1OC1C1NC1C1CO1,0.319
OC1C=CCC1(O)C#C,0.2566
CC1CC=CCC=C1C,0.2472
CC1C2OC1(C)C21CN1,0.3129
O=C1C2CC1OCC2,0.204
CC1CN2C(C3CN3)C12,0.298
COC(=O)C12CC(C1)N2,0.2442
CN=c1oc(c(o1)N)N,0.2362
N=CN1C=NCCN=C1,0.2184
CCN1CC1C1NC1C,0.2905
c1[nH]c2c(n1)OCO2,0.2073
CC1(CN=CO1)C#N,0.2711
COC12C3C4C(C13)C24C,0.2828
C#CCC1OC2COC12,0.2976
COC1CC1(O)C(C)C,0.2924
OC(CNCC#C)C#N,0.2764
O=C1C2CC1(C=C2)C#N,0.2455
C1OC2C3OC2C13,0.3067
CC1OC1C(C)(C)C=O,0.2235
C1CCC1,0.3938
OC12CC3CNC1C2O3,0.2675
CC1CC1C#CCC=O,0.2101
O=CC12COC1C=CC2,0.219
N=C1OC=CN=CC1=N,0.1628
C1C23NC=NC12C1OC31,0.2181
OC1CC11CCO1,0.2918
C1CC(=NCCO)OC1,0.2596
CCC#CCN=COC,0.2662
CC(O)CC1=CN=CO1,0.2416
CC1N(C)CC=C1C#N,0.1775
CCC(COC=O)C#C,0.2791
OC1C2C3CC2C(=O)C13,0.2257
C1C=CC2OC3C1C3O2,0.2341
C1C=C(CN1C=O)C=O,0.1742
CCCN(C=O)C(=O)C,0.2155
CN=C1OC(O)=CC=C1,0.1652
CC(O)C(N)(CN)C#N,0.2595
CCC#CCC#CC,0.2876
Cc1cc([nH]c1)CC#C,0.239
OCC1C=CC2NC12,0.242
C#CC(C=O)(C#C)C#C,0.2163
CC1(O)CC(O)(C1)C#C,0.2909
CCCCC1CN1C,0.3036
CC(OCCO)C#C,0.2914
OC12CC3(O)C4C(C14)C23,0.2929
NC1=NC=C(F)OC1=N,0.1598
CN1CC11C2OC1C2O,0.2842
C1C2CC=C3COCC123,0.2388
CC1(C)CCC2OCC12,0.316
CC1OC2CC(O)C12O,0.2996
CCC1CC(C)(C)C1O,0.3115
Cn1cccc1C=O,0.1828
CC1C2OC2(C)CC1O,0.3358
O=C1NCC=CC11CN1,0.2446
CC1C2C(C)OC12C,0.3142
CC1(CCO1)C1CCC1,0.321
OC12C3CC1OCOC23,0.3043
CC1(O)C(O)COC1=O,0.2695
c1nc2c(o1)NCCO2,0.2057
O=C1CCN2CC12,0.2187
CC1C2C3N2C2C1C32C,0.2971
CC(O)C12CC(O1)C2C,0.3177
NC1=C(OC(=N)N1)C#N,0.1872
CN1CC2(C1)CN=CO2,0.2437
CCC1OCOC1CC,0.3372
CCCc1ccco1,0.2354
CC1OC1C1=CC=NN1,0.2479
C1N2C3C4C=CCC13C24,0.2353
OC12CC3C4C3C1CC24,0.3202
N=COC(=O)C#CC#N,0.1918
C1C2CC1CC1OC1C2,0.3303
CC1OC=NC2CC2O1,0.2517
OC12C3C4C3C1CCC24,0.2894
O=C1C2OC=NC1C=C2,0.1988
C1CC11COCC11CN1,0.3119
N=COC1=CC=CC=C1,0.2266
C#CCC(C=O)(C=O)O,0.1903
CC1C2(C)OC(=N)C12C,0.2762
CCC1=CC2CC1CO2,0.2452
CC12CN3CCC1(O)C23,0.2818
CC1CC(CO1)OC=O,0.2665
N=C1C=NON=C1C#C,0.1791
C#CC1OCC11CCO1,0.2621
OC1CN2C1=NNC2=N,0.1999
Cc1cc(=O)cc(o1)O,0.2016
C1NC1C1=CC=CN1,0.2338
C1CC2C1OC1CCC21,0.3047
C1C2OC11CC=CCC21,0.2516
CC12OC1CC1CC21,0.339
CC(C)(O)C1CC(O)C1,0.3098
CC(O)C1(CN1)C(C)O,0.3108
CCC12CC(C1)C(C)O2,0.3216
CC1(O)C=CC(=O)C1O,0.1938
N#CC#CC1CCC=C1,0.2275
NC(C#N)C1OC1C#C,0.2578
COCC(C)CC#N,0.3017
COC1CNC1C(N)=O,0.2582
CC(O)C1CC2COC12,0.3033
CC1(CC1)C1CC(O)C1,0.3269
CCC1=NN(C)C(=N)O1,0.2153
CC1NC1C1CN1C,0.29
COC(C)C1CN=CO1,0.2714
NC1=NC=C(O)C(=N)O1,0.1722
CC12C3C1C1CC2C3O1,0.3407
O=CC12CC3C1COC23,0.2116
CCc1c(cc([nH]1)O)N,0.2204
CC1(C)NC1C#N,0.2882
CC(C=O)(C=O)OC,0.1869
OC12CC3C4CC3C1C24,0.3183
OCCCC1(O)CC1O,0.3195
CC1CC2NC12C1CN1,0.2931
C1C2CC1CC=CCC2,0.2333
c1[nH]c2c(n1)NCCN2,0.2158
CC1=Cc2cnoc2C1,0.1951
OC12CC1C1(CC21)C#C,0.241
OC1C=C(NC1=N)C#N,0.1807
CCN1CC11CC2NC12,0.3016
CC1=CC2C3CC2(C1)O3,0.2384
CC1(O)CC1O,0.3221
CCC(OCCO)C#N,0.2851
CC12C3CC1C=CC2O3,0.2341
CC1C2NC(=O)C12C,0.2506
OCC1CCC=CC1,0.2675
CC1COC(C)C11CO1,0.3209
CCCN1C(C)C1C,0.2891
CC1(O)CCOC(=O)C1,0.2715
CCC1CCOCO1,0.3497
CC#CCC1OCC1C,0.2941
O=C1CC2(CN2)C1C#N,0.2111
CCC(C)(C)C(C)C=O,0.2237
O=C1CCC2(CC12)C#N,0.2206
CC1OCC2COC12,0.3227
CC12OCOC3C1OC23,0.3088
COc1ccc(cn1)F,0.1982
CC1(C)COC11CC1O,0.2873
CC12CCC1C1CC21O,0.2889
c1c(oc(=O)o1)CC=O,0.2023
CCC12CC3C1N2C3C,0.3159
c1nc(c(o1)C#N)C#N,0.194
OCC12C3CC1CCC23,0.3164
CCC(C)C1CC1CC,0.3435
OCC1COC1=N,0.282
c1cncc2c1cco2,0.2065
Cc1nc2c(o1)CNC2,0.2211
CC(C)C1C(C)C1CO,0.3194
CN1CC(CO)OC1=O,0.3023
OC12CC3(C1)OCOC23,0.3093
CCCNC1COC1=N,0.255
OC1(CC1C=O)C#C,0.2188
CCc1cnc(o1)N,0.2307
OCC1(O)CC2OCC12,0.2984
C(CC#CCC#N)CO,0.2884
O=C1CC2N1C21CCC1,0.2342
O=C1C=CC2C3OC1C23,0.1802
O=CC1=CCC2CC2C1,0.1983
CC1CC=CCC1=O,0.2248
CC12CC1C1(COC1)O2,0.3085
CC1CC(C)=CC11CN1,0.2441
CC1(C)C2CCC1C2O,0.3258
C1CC2NC2CN=CO1,0.2521
N=COCCCC1CO1,0.2836
CC(C)(C)NC(=O)C=O,0.1726
OC1CC(C#C)C1O,0.2832
COC1COCCO1,0.3308
O=CCC12NC3C1NC23,0.2072
N=C1C=CNC(=N1)C#N,0.1558
C1OC1C12CC(C1)OC2,0.3257
[NH3+]CC1=C(CO)N=N[N-]1,0.199
CCCC1CC(C)O1,0.3321
COC1CCC(C)OC1,0.3142
Cc1[nH]c(cn1)C#C,0.2029
CCC(C)C1CC1,0.3627
OCC(=O)C(C#C)C#N,0.2248
C#Cc1coc(n1)C=O,0.1706
C1CC11CC2(CN2)CO1,0.3103
CN=C1CCOC(=N)N1,0.2349
O=CC12CC1NC2=O,0.2197
Cc1nc(=O)c(co1)N,0.1823
N=C1CC2=C(N1)N=NN2,0.1983
CCC1CN1CC#N,0.2756
OC12CC1OCOC2=O,0.2504
CC1(CCCCOC1)C,0.3158
CC1C(NCC1=O)C#N,0.2209
O=C1OCCN2CCC12,0.2314
OC12CC1(C=O)C1OC21,0.2163
CN(C=O)C1=CCOC1,0.2138
CC1CC11CNC(=O)O1,0.3102
OCC12CC1CC1NC21,0.3105
CC(=O)c1nccn1C,0.1905
CC1CC(=O)C=CCO1,0.1887
CC1=C2CCC2C2OC12,0.2322
C(=O)C(=O)C(=N)NC=O,0.1161
CC1CCC(=O)NC1C,0.2697
OCC1C2C=CCCN12,0.2238
CCC(CC(C)=O)C#N,0.2358
Cc1n[nH]nn1,0.264
CC1CC=CC2NC2C1,0.2492
N=C1OC(C#N)C2CC12,0.2745
C(C#Cc1n[nH]nn1)O,0.2174
OC1C2CCCCC1O2,0.2989
c1c[nH]c2c1OC(=O)C2,0.2025
c1c(cc(cc1O)O)O,0.2368
C#Cc1c[nH]cc1CO,0.2197
N=C1CNC2CC2O1,0.2578
COCCCCCOC,0.3378
C1COC(=O)C=C1,0.2169
CC1C(CO)C1CCO,0.3273
OC1C2C3COC2C13O,0.2994
CCCC1OC2COC12,0.3082
CCN=C1CC(O)CO1,0.2723
Cn1cnc2c1nc[nH]2,0.2102
O=C1NC2CC2C2OC12,0.247
OCC1NC(=O)CC1O,0.2699
C1C(CO1)NC=O,0.2761
CC12CC(C1)C(C2)C=O,0.2275
N=C1OC23CN(C2)C13,0.2273
C1CN1c2c([nH]nn2)O,0.2294
OC1CCC1C1CCC1,0.313
CC1=CCN=C(OC1)C,0.2311
C#CCCn1cccc1,0.238
CCn1cccc1C=O,0.1824
C(=O)C(=O)N(C=O)C=O,0.154
CC1(O)C2CC1C21CN1,0.3061
C#CC12OC3CC1C23,0.245
CN=C(N)N(C=O)C=O,0.2138
NC(=O)C1C2CCN12,0.2459
OCC1C=C2CC3C2N13,0.1665
CC1(O)C2NC2C1CO,0.3012
CCOc1c([nH]cn1)N,0.2266
COc1nc(on1)C#C,0.2022
CC1COCC(C)=CC1,0.2479
C1CC2(NC12)C1COC1,0.2989
CC(C#C)C#CCO,0.2806
NC(=O)N1C2C3NC3C12,0.2533
CCN=C1OCC1O,0.2713
C1C2C3C4C5C(C1N34)N25,0.291
CC1=CCCC=CC=C1,0.1828
CC(C#N)C1=NC=CO1,0.2422
c1nc(n(n1)CC=O)O,0.209
CC#CC(=O)C(C)(C)O,0.2024
CC1CC11OCCC1=O,0.2133
COCCCC(C)OC,0.3318
CC12CC3C(C13)N2C=O,0.2485
CC1CN2C1=CC=C2C,0.241
O=CC1NC(=O)C11CO1,0.21
C1CC(C1)CC(=O)C=O,0.1554
CCC1=CC(=O)NC1=O,0.1781
N=C1COC(=O)O1,0.281
CC1=C2CC=CC2OC1,0.2424
CC1CCOCC1=O,0.2105
CC1(C)OC(CO)C=C1,0.2523
CC([NH3+])CC([O-])=O,0.2771
NC1=CC=C(OC=N)O1,0.2051
C1C2N1C13CC21C=CC3,0.2129
CCC(C)(O)CCCO,0.3224
C#CC#CCC(=O)C#C,0.1807
CC1=C2NCC2OC1=O,0.2003
COC(CNC=O)C=O,0.2086
CC1NC(CC#C)C1=O,0.213
C1C2C3OC=NCC3N12,0.2701
C#CC1CN=C(O1)C#C,0.2198
CC1(CC1)CCCCO,0.3422
CC1(C=O)C2CCCN12,0.216
CC1N2C3CC2C13CO,0.2873
CC1=NCC(O1)C=O,0.216
CCC(=O)C(=O)C#C,0.1506
CC1C2OC(=O)C12CO,0.2711
CCC1(O)C2CC(=O)C12,0.2265
CC1(O)C=CC2CCC12,0.2571
CC1OC(N)=NC1C#N,0.2697
CC12COC3C1N2C3=N,0.242
CCC1OC2C(OC)C12,0.3019
C[NH2+]CC#CC([O-])=O,0.2052
CC1(C)CC11CCOC1,0.3262
CC1CC11N2CC1(C)C2,0.3155
CC1=CC23CC1C2CO3,0.2307
CC1CC(C=C1)C1CO1,0.2624
CCC(=O)C(=O)C#CC,0.1522
CN=CNC(=NC)OC,0.2317
N=C1OCC2(CN12)C=O,0.2152
CC1CC2=C(NN=N2)O1,0.227
CC#CC1(C)CCC1O,0.2912
OC1C2NC2C1(O)C=O,0.2049
O1C2C3C4C1C2N34,0.3049
CC1CNC(=N)C(=O)O1,0.198
C#CC12COC3CC1C23,0.2792
COCC12CC1(C)OC2,0.3032
N#CC1CCC2CC1C2,0.3296
OC1C2CC1C=CCC2,0.247
CC(O)(C#N)C#CC#N,0.2391
CC1C(=O)NC(C)=C1C,0.2099
COC1C2CN2CC1C,0.298
CCN1C(C)C1C#C,0.2568
CC1(CN1)C1(CO)CN1,0.3071
c1c(=O)[nH]cnc1F,0.1983
OC12C3NC1C3OC2=N,0.2561
C1CC(C1)OC2CC2,0.3194
CC12COC1C2CC#C,0.2936
CCC1(C)OC2CC12C,0.3112
C#CCCOCCO,0.3137
Cc1c(c(c[nH]1)O)N,0.223
CC1CC2CC2(O)C=C1,0.2369
O=CC(=O)C1C2CN1C2,0.1438
CC(C(C)=O)C(=O)C#C,0.1825
CN1C2C(O)CC12C#N,0.2651
C1C2C1C1CC3OC1C23,0.3201
CC1(O)CC11COC1,0.3031
NC(=O)C(CO)CC#C,0.2657
N=C1N=COC(=N1)C#N,0.1839
CC(O)C(OC=O)C#C,0.2711
CCCCOCC,0.3391
CC12C3CC4OC1C4C23,0.3094
CCN1CC1(C)C(C)O,0.3017
OCC(=O)CC(O)C#N,0.2365
CN=C1OC(C)CC1C,0.2721
CC(C)(COC=O)C=O,0.2286
CC1C2C(C)CC12C,0.3241
OCC12NC3CC1OC23,0.2972
CC1(C)CC2COC2=N1,0.2652
CCC(O)C1(CO1)C=O,0.2178
CC#CC1C2NC1C2O,0.287
O=CC1CC=CC=CC1,0.1904
c1[nH]c(c(n1)O)C(=O)N,0.1899
C1CN(C1)C(=O)CCO,0.2677
C#CC1CC(O1)C#N,0.2605
N#CC1CN=CN1,0.2458
CN=C1OCC1OC=N,0.2604
OC1C2CC3CC3C12O,0.3023
CC12OCC3CC1C23,0.3187
O=CC1OCOC1=O,0.2131
OC1C2CC2C2COC12,0.3064
N=C1ON=NC(=O)C=C1,0.1517
CCC1C2C3OC2C13C,0.307
C1C2C3C4C5CC4(C35)N12,0.3108
C#CC1(CO1)C#CC#N,0.2192
O=C1CN2CCC2C1=O,0.1191
OC1(COC1=O)C=O,0.2093
CCOC(C)CCOC,0.3284
NC1(CCCC1O)C#N,0.294
CC1=CC=NC=NC1=N,0.1639
CC1C2CC3C1C2C3=O,0.2305
CC1=NNC(=N)C(O)=C1,0.1746
CC(=O)C(=O)C1COC1,0.1565
NC1=NC(C#C)C(=O)C1,0.2027
CCC1(CC1)C(=O)OC,0.2825
OCC1=CC(=O)C2CC12,0.1898
COC1CC2CCC1O2,0.3272
CC(C)C1C2OC=NC12,0.2547
C#CC1CCCC2CN12,0.2724
CNc1cnn[nH]c1=O,0.1728
O=C1NCCCC2CC12,0.2647
C#CC1CN1C1CC1,0.2653
CN=COC1CC(=O)C1,0.2177
CC12CC(N=CO1)C2O,0.2495
CC1CC2=NCC(=N)N12,0.2208
CC1(CO1)C1C(O)C1O,0.307
CC1(C)CC(=O)C1C#N,0.2229
c1nc(no1)OC=O,0.2516
NC1=C(N=NO1)N(=O)=O,0.1774
OC1CC(O)C2CN2C1,0.2842
COC(=N)N1CCC1=N,0.24
CCC1(C)CC(C1)OC,0.3222
C#CCC(=O)NC=O,0.2213
C1C=CNC(=O)CC1=O,0.2063
CC12COC(C1)COC2,0.3163
C1CN2C3C4OC4C1C23,0.2813
C1C=CC(=O)CO1,0.1785
CC(CO)COCC#C,0.2883
C1OCC11C=CC2NC12,0.2399
[O-]C(=O)C1C[NH+]2CC1C2,0.1746
CC1CC23CCC2(C1)N3,0.2857
CC1CC2CC3(C)C2C13,0.3295
CC1OC(C#C)C1C#N,0.2762
CN(CC=O)C1COC1,0.1975
CC1C(=O)N2CC12C#N,0.2294
OC1CC2CC2N2CC12,0.2821
Cc1cn(c(=O)[nH]1)C=O,0.1924
CCCOCCOC=O,0.2848
CCn1cc(nn1)NC,0.2081
CC1(C)COC(O1)C#N,0.3005
CN1CC2(O)CC1C2=O,0.2031
N#CC12C3CC1COC23,0.2664
c1c(=O)occ(n1)C#N,0.1672
C1CC11C2OC2C2OC12,0.3157
OCC1COC(=N)CN1,0.2585
CC1C(CO)C2CN12,0.2956
CCOC1CC(=O)CO1,0.2222
C1N=CN2C=NCC12,0.2373
OC(C=O)C(O)C1CO1,0.2275
Cc1cnc(=O)on1,0.1666
CC1C=CC2NC12C#C,0.2333
CC1C2NC(C#N)C12,0.2517
OC1COC2COC2C1,0.3222
CC1=CC(C=O)C(O)C1,0.2242
CCC1CC(=O)C1O,0.223
CC#CCC(=NO)C#C,0.2077
NC(C(N)=[NH2+])C([O-])=O,0.2317
C1C2C1C13OC4C1C2C34,0.2953
O=C(C#C)N1CC2CC12,0.2117
OCC1CN1C(=O)C#N,0.2087
OC(CN1CC1)C1CO1,0.3154
CC1OC11CCC(C)=C1,0.2468
CC1(CO)C=CC2CN12,0.2341
CNC(=O)CC1CO1,0.2725
CC1CC2(O)CC2O1,0.3113
N=C1CCOCC(=O)N1,0.2262
[NH3+]CCC1=COC([O-])=N1,0.2338
OCC12CC3CCC1C23,0.315
CC1CC2CC=CC12C,0.2602
CC1C2CC3C1(C)C23O,0.2996
CC1C2COC(C)CN12,0.2996
CCC1CC2(O)CCC12,0.3198
CC(C)c1nc(on1)N,0.252
COC(=O)CNCCO,0.2472
CC(=NC)OC,0.2761
c1c([nH]nc1N2CC2)O,0.251
OCCC1=CCC2NC12,0.2455
OCC1OCCC2OC12,0.3355
CN(C)c1ccn[nH]1,0.2344
c1c[nH]cc1C(F)(F)F,0.2531
C1C2CCCC1C=C2,0.2534
CCC1OC(=N)C1OC,0.2705
CCC1CC1(O)C#CC,0.2693
OC1CC2C3OC3C12,0.3093
CC12CC(CC3CC13)O2,0.3201
CC1(C=CC=CC=C1)C,0.179
CCCC1CN(C)C1=O,0.2781
OCC1C2C3CN1C23,0.2996
CCCC#CC1OC1C,0.274
OC1C=CCN2CC12,0.2353
O=C1CC2COC2C1,0.2204
CC(=O)C1(C)COCO1,0.2195
CN1C2CC(O)C12C#N,0.2589
C[NH2+]CC1=N[N-]C(=O)O1,0.148
CCC(C)N1CC1C#C,0.2625
N#CC1(CC2CC2)CN1,0.2845
OC12CC1CC1CC21O,0.2938
CCCCC(C)(N)C#N,0.301
C1CN(C1)c2n[nH]nn2,0.2017
CC12CC(=O)NC1CO2,0.2731
OC1=NC=NC(=O)O1,0.2007
O=CCC1C2C3CN3C12,0.2022
Cc1c(cn(n1)C)OC,0.2309
C#CC1(CC1)CC2CC2,0.2957
COCC1OCCC1O,0.312
CC(C)C1(CC1O)C#C,0.2893
c1c(c(c([nH]1)O)O)O,0.2185
CC1=C(CCC1=O)NC,0.1975
CC1=C(NC(=N)O1)C#C,0.1755
CC12CC3C(OC1)C23O,0.2842
Cc1c2c([nH]n1)OCC2,0.245
CCNc1cc(co1)O,0.2193
CN1CCC1(C)C=O,0.1821
CCC(C)(C)C(O)CO,0.3138
C#CC(=O)OCC#N,0.2382
OCC1CC2(CO2)C=C1,0.2504
CC12C3CC(C13)C2(C)O,0.3144
COC1CNC2CC2O1,0.2773
CCC1OC(C#N)C1O,0.2742
OC1CC11CC(O1)C#C,0.254
CC1C2OC2C(C)=C1C,0.2375
C1NC11C=CC2CC1O2,0.2359
CC(=O)c1ccon1,0.2005
CC12OC1C(O)C2C=O,0.2107
CC1C(CO)OC1(C)C,0.3129
CC12CC3C(C13)C(=O)C2,0.2227
CCC1CCC(C1)OC,0.3294
Cc1c(nno1)CO,0.2243
C1C2C3CC4OC3C2C14,0.3291
CNC1=NC2C(C)C2O1,0.2676
OC1=NC(=N)N=C(F)O1,0.2321
CC1C2C(CO)CCN12,0.2908
N#CC12CCC1CCC2,0.3235
CC1C=CN2C=CC=C12,0.1972
C1NC1C1=NC=CC=N1,0.2093
CC1OC(=O)C11CC1O,0.2744
CCC12NC1CC2OC,0.2953
C#CC#CC12CC(C1)O2,0.2062
CCCC1NC1C(C)O,0.3145
COc1ccon1,0.25
C1C2C=C3COCC3C12,0.2354
NC1=CC=C2C(O)CN12,0.2204
OC12CN3C4C3C1NC24,0.2986
CN1CC2(CN2)C1C#N,0.2537
N#CC12NC3C1CCC23,0.2595
Cn1cc2c(c1)nn[nH]2,0.18
CC1OC23CCC12CC3,0.2896
OC1(CC1(O)C#N)C=O,0.2138
c1c(c([nH]n1)O)OC=O,0.2219
OC(COC=O)CC=O,0.2253
CCC1(C)CCC1OC,0.3267
CC(C)(C)CO,0.3363
CC(CO)N1C=NN=N1,0.2666
O=C1OC2CC(=O)CC12,0.2226
OCCC(CO)OC=O,0.2653
CC1CCC=C1CC#N,0.2536
CN1CC(C=O)C1C=O,0.1949
COC1(C)C(C)C1O,0.2948
CN=COC(=O)N1CC1,0.2542
CC(O)C1OC2CC2O1,0.3196
CC1NC1(C#N)C1CC1,0.2897
CC1CC2C3OC3(C)C12,0.3239
CCCOC(=O)NC=N,0.2537
N#CC1=CC2OC2CC1,0.2041
CCC(O)C(O)CC#N,0.3026
CC12C3C4C3C1(CO)N24,0.2788
CC12COC1C=CCO2,0.2521
OC12CC1(O)CC(=O)C2,0.2164
OC1CC1C1(O)CC1,0.2745
O=C1CCC11CC2OC12,0.2097
CC1OC2C(C)C(C)C12,0.3047
CCC(NCC#N)C#N,0.271
O=CC1OC2=NCCC12,0.2063
CCCC(C=O)(C=O)O,0.1938
O=C1OC=NCC2NC12,0.2291
CC1C(C)C1C#CC#C,0.2153
CC1C2CCC(C2)C1C,0.3477
CC1CC2(CN2)C1O,0.3025
OC(CNC=O)CC#C,0.2782
C#Cc1cc(ccn1)O,0.2049
COC12CC1C1CC2C1,0.3404
OCC1C2CC1C(=N)O2,0.2843
C1C2C1C1CC3C(O1)C23,0.3036
OCC12OC3C1C2C3=O,0.2256
OC1COC(C=O)=NC1,0.1941
CC1(C)C2C1C1OCC21,0.3017
CC1OC2(C)CC2(C)O1,0.3179
O=C1NCCC1CC#C,0.266
NC(=O)CCC(O)CO,0.2797
Cc1cc(n(n1)C)OC,0.2521
C1COCC(=O)C=C1N,0.1893
FC1=NC=CC(=N)O1,0.1884
C#CC1=CCC2(C1)CC2,0.2101
CC1C2CC(CCO)N12,0.3027
c1cncc2c1nc[nH]2,0.2084
CC1(OCC2OC12)C#N,0.2994
C1CN1CCOC(=O)N,0.2936
OC1C(=O)NC=C1C#C,0.1785
CC(C)C1C2C3CC1N23,0.3079
CC(C)(C)OCCO,0.3269
O=COC1CCC(=O)O1,0.2733
CCC(C)(CC)CC,0.3656
CC(O)CCC(C)=NO,0.255
CCCC1OC1C(C)O,0.3452
CN=C1NCC1(O)C#C,0.2387
CC1C2CC3OC2(C)C13,0.325
C1COCC=CC=C1,0.2048
C1C(=NO)COC(=O)N1,0.2469
CC1CC=CN1C(N)=O,0.2131
CCC#CCOCCO,0.2835
CC1CC(=O)C(=N)N1C,0.1682
FC1=C(F)C(=N)N=CO1,0.1969
CC12CCC1C(O)C2,0.3205
OCC1NCCNC1=O,0.252
CC(=N)OCC=O,0.2296
OC12C3NC1C1(CN1)C23,0.29
CC(O)C#CCC(N)=O,0.2667
OCC(=O)C1CCC=C1,0.2157
CC1C=C2C=CC3C1C23,0.175
CC(O)C(=O)C(C)C=O,0.2015
CC1=NC2(CC2O1)C=O,0.2177
C1CC2C3OCOC23C1,0.304
CC(CN1CC1)NC=O,0.2752
OCCC12CC(C1)C2,0.3436
CC#CC1(CC1)N2CC2,0.2771
CC(O)C1C2CCC12,0.3221
CNc1c(n[nH]n1)N,0.2099
CC1CCC(CC1)(C)C,0.3588
C1CC2C1C21OCC=C1,0.2262
CC#CC1NC1C(N)=O,0.2526
CN1C(=N)C2OC2C1=N,0.2231
CN1C(=N)C=NC=C1F,0.1589
Cc1ccc(nc1O)N,0.1966
OCC1NC1C1CC1,0.3133
[O-]C(=O)C1CC[NH2+]C1,0.277
CC#CC1OC11CCC1,0.2692
CC12CN1CC2(C)C,0.3027
CC1(CCC(=NC)O1)C,0.2732
COCC1CC1,0.3419
CCC1=CC=CCCC1,0.188
CC(C#N)C1CC(=O)N1,0.2801
CC12CC1CC2(C)CO,0.3171
CCN=c1ncocn1,0.2027
O=C1COC11CC2NC12,0.2014
OC1C2CCC(O)C12O,0.299
Cc1c(c(n[nH]1)C)C=O,0.2071
CC12CC1C(O)C1OC21,0.3161
OC1C2NCC12OC=N,0.2572
Cn1c(cc(n1)CO)O,0.2487
CC(O)C1OC1C,0.3272
O=C1CN=C2OCC2C1,0.2094
CCC(O)(CC#C)C=O,0.2159
CN1CC1C#CCC#C,0.2552
N#CCN1CC2OCC12,0.2568
C#CC1=C2CCC2CC1,0.1973
CC1CCCC1(C)C#N,0.344
CC12C3COC(C13)C2=O,0.2208
CC1CC2(CC2)C(=N)O1,0.2783
CC(O)C1NC1(C)C=O,0.2212
C1CNC2=C1C(=O)NC2,0.2018
CC12NC1C1CC2(C)C1,0.2967
O=C1OC2CC3NC3C12,0.2727
CCCC(C)(C)C(C)O,0.3278
CN=C1NC=NC(O)=N1,0.1769
N#CC1CC11COCO1,0.2865
OCC1C(CO)C1CO,0.3181
OC1C(=O)C2NC12C#C,0.1953
CC1(C)C2CC1N1CC21,0.3147
OCC1C2CC3C2N13,0.3224
OCC1(CC1O)C1CO1,0.3258
C1COC2OC=NC2C1,0.2545
CCC(C)C(O)C(C)C,0.3261
CC1CC1C1=CC=NN1,0.2498
OC1C2CCC1C2C#N,0.3095
CC(OC(C)=O)C#C,0.2769
O=C1NCC1CCC#C,0.2788
CC1CC2COC1O2,0.334
CCC#CC(CC)C#C,0.2862
CC(C)C(C)(C)O,0.3273
C(#N)C(C#N)(C(=O)N)N,0.2544
C1OC1C12CC(O1)C=C2,0.2354
CC1(C)C(C#N)C2CN12,0.2727
CN1CC1C1=NC=CN1,0.2322
CCOCC1(C)CC1C,0.3329
CC(OC(=O)C#N)C#C,0.2187
N=C1NC(=O)OCC=C1,0.2048
C(=O)Nc1nc(no1)O,0.2158
CCC1CC(C)NC1=O,0.2706
C1CCOCOC=NC1,0.2617
c1c2n(nn1)C3(C2)CC3,0.2591
CC1(OCCO1)C2CC2,0.3356
CC1(C)CC(O)C1=O,0.2178
CC1=CCCCNC1=O,0.2205
CCC(=O)CNC(=O)C,0.2146
CC(=O)CC1(CCC1)C,0.2294
CCC12OC3C1C2C3C,0.3068
CC(=O)CC(C)(O)C=O,0.2138
Cn1ncc(n1)C#N,0.2349
CC#CCC(=O)C1CC1,0.2276
CC1(O)C2CCC1O2,0.3302
CCN(CC)C(=O)C#C,0.218
OC1CN2CC2CC1=O,0.2051
C#CC#CCN1CC1,0.2188
CCc1c([nH]nn1)CO,0.2452
CC1(O)C(C)(O)C1(C)O,0.273
C1CC11CN=C2OCC12,0.2633
NC(=O)C12C3CN1CC23,0.2605
CCCC1OC1(C)CO,0.3394
CCC(CO)C(=N)OC,0.2878
C1CC12CC(=O)NC=C2,0.2058
OC12CCC3CC1CC23,0.3277
OC12CCCC1C1CC21,0.3181
C1CC(C1)C(=O)C=O,0.154
CC1CC2OCC12CO,0.3061
CC(O)C(N)(C#N)C#N,0.2742
CC1CC11C2CC1(C)C2,0.3447
CCN=COC1CCC1,0.2724
OC1CC2=CC3OC3C12,0.2354
N#CCCC1C2CCC12,0.3032
CC1OC(=O)N2CC12,0.2898
OC1(CC1C#N)C#N,0.2875
COCC1(CC(=O)C1)O,0.2199
CC(=O)c1c([nH]cn1)N,0.1866
CC12C=CC3C1CN23,0.2075
Cc1cncn1C(=O)C,0.1897
O1C=NC2C3C4C3C2C14,0.2549
CC1=CCNC(C1)C#N,0.2529
CC1OC1C1OCC1O,0.309
CC1(C)CC(O)C(=O)C1,0.2227
CCC1C(C)C2COC12,0.3061
CC1OCC2(C)CC2O1,0.3347
COCCCCC1CC1,0.3404
OC1CN2CC(=O)CC12,0.196
CC1CC1CC(C)=NO,0.2567
CC12CC1C(CC#N)O2,0.284
CCC1C=CC2CC1O2,0.2372
[O-]C(=O)C1C[NH2+]C1C#C,0.2654
CC1CC23OC4C2C1C34,0.3039
NC1=CN=C(O1)C1CN1,0.2097
CCOC1CC1,0.3376
CCC(C=O)C(N)=O,0.2078
Cc1cnc(o1)CNC,0.2278
c1cc([nH]c1)C2COC2,0.239
CC1CCC(=O)C(C)N1,0.1963
CN1CC2C1COC2=O,0.2423
CC1(O)C2CC1(C2)C#C,0.2952
CN=c1cn[nH]cc1O,0.1627
c1cocnc(=O)c1=O,0.1709
OC1CC2C(=O)CC12O,0.2206
O=CC1(CN=CO1)C#C,0.2065
CC12CC(O1)C2C1CO1,0.3169
N=C1OC2CN3CC1C23,0.2465
CC12CC(CO1)CCC2,0.314
N1C2C1C1NC2C2OC12,0.2995
CC(C)C(C)(O)C#C,0.2988
CCCC1CCC(C)C1,0.3738
COC1C2C3OC2C13,0.3102
C1C23CCCC12N=CO3,0.2581
OCC1OC11COC1,0.32
CC1C2CC3N1C23C#C,0.2592
NC1C2N=CNC12C#N,0.2324
CC1OC2=NCCNC12,0.2593
C(CO)C(=N)NC=O,0.2318
CC(C)(CO)C1(C)CO1,0.324
OC1C2CCCC(=O)C12,0.2225
CC#Cc1[nH]c(cn1)N,0.1897
CC1=CCCC1C(N)=O,0.2481
CCOC1C2OC(C)C12,0.3043
O=C1CC2CC2CC1=O,0.1554
CC1C(C#C)C1C1CC1,0.2852
c1c(noc1N2CC2)N,0.2316
C(CC(=O)CC#N)CO,0.2374
CC12OC1C1(CO1)C2=O,0.1984
C[NH+]1CC2(CC12)C([O-])=O,0.1695
CC1CC2OC(=N)C12N,0.2653
CCC1=CC2(CO2)CC1,0.2464
O=C1C2CC1C2CC#C,0.2526
OC12C3OC11C=CC2C31,0.2142
CC1(COC1CO)C#N,0.2863
CC(C#C)C(O)C(N)=O,0.2609
COCC(=O)CC=O,0.2166
CC1C(C)C1C(C)(C)O,0.3077
O=CC1CC2CC2C=C1,0.221
O=C1C2CC1N1CC1C2,0.1978
c1c2c(nco2)no1,0.2093
CC1CC2=CNC=C2O1,0.2306
CC1(CC#CC#C)CN1,0.2282
OC1CCCC11CN1,0.2994
NC1=NC(=N)OC(=O)O1,0.2345
c1c([nH]cn1)CC(=O)N,0.2241
CC1CC(=O)C1,0.2231
O=C1CCCC11CCO1,0.1975
c1cncc(c1C=O)O,0.1734
CC1OCC1C(F)(F)F,0.332
C1NC11CNC11COC1,0.2949
CC12CC(NC1=O)C=C2,0.2154
CC12CC3(CN1C23)C#N,0.2663
C1CN1C12CN(C1)C2,0.3094
COC1CC2CC3C2C13,0.327
CN=C1NC=NCCO1,0.226
CC(N=C(N)C=O)C#N,0.189
C1C2C=C3CC1N1C2C31,0.1724
CC12CC3C1C2C31CO1,0.3472
NC(=O)C1CCC1O,0.2632
CN=C1CC(C)(O)CO1,0.2756
CN=CN(CC=O)C=O,0.2049
CCC1CC=CC(=O)N1,0.2075
C1CC23OC2C=CC3O1,0.241
CC(=O)CCC#CCO,0.2307
CC12C3C1C1(O)C3C21O,0.271
CC12CC1OC2CC#N,0.2758
OC12CC1C1C(C#C)C21,0.2457
CNc1c(c[nH]n1)C#C,0.2001
OCC1CCC1NC=O,0.2785
c1c[nH]c2c1OCO2,0.2144
CC1C2CC2COC1=O,0.2759
CC1(C)OC(=N)C1(C)C,0.2915
CC1CNC(=N)C(=O)C1,0.1728
c1cn(nn1)C2COC2,0.2559
CC1C2CCCC1C2=O,0.2222
C#Cc1cnc(cn1)O,0.1814
CCCOCC(O)CC,0.3281
CC1=CCC(NC1)C#N,0.251
CC1N=C(N)COC1=N,0.2531
CC1C(C=O)C1(C)O,0.2229
NC12CN(C1)C2C#N,0.2582
OCC1(CCC=C1)C#C,0.2573
CC12CC1CC(=O)OC2,0.2757
C[NH2+]C(C)C(O)C([O-])=O,0.263
OC12CC1C1(CC1)C2,0.323
N#CC12CNC3C(O1)C23,0.2282
C1CC1N1CC2OCC12,0.2894
CCC(O)C1(CC1)C=O,0.2275
CC(C#C)C1CC1O,0.3059
CC#CC(C)(C)C=O,0.2174
OC(CC(=O)C#C)C=O,0.1956
CNc1ccnc(n1)O,0.209
CC(O)C1COC(=O)N1,0.3138
CC1(CCCO1)C1CN1,0.3111
CC12CN=C3OC1C23O,0.1575
CC(O)C([NH3+])CC([O-])=O,0.2761
CC(C)C(N)(CO)C#N,0.2849
CC(C)(CCC#C)C#C,0.3041
COC(C)(CCO)C#C,0.2969
CCC(O)C1CC1C#C,0.2896
C(C1CN1)C1=COC=N1,0.2387
CC1(CC=CCO1)C#N,0.2681
O=C1CC2OC1C2C#N,0.2115
O=C1C2CC3C2C13C#C,0.2381
CCN(C=O)C1COC1,0.2561
OCC1CC1(O)C#C,0.2712
CCc1conc1CO,0.2435
OC1C(C#N)C1(O)C#C,0.2514
CC1C2C3C2C2C3OC12,0.3074
O=C1CC2NC11COC21,0.2174
CC12CC3NC1(C)C3O2,0.3029
CCC12COC3CC1C23,0.3218
CCOC1CCC=CC1,0.2682
COC12CC1C1CC21O,0.2768
COc1c(nno1)CN,0.2045
N=CN1C=NCC1C#C,0.2143
CCOC1CCC(C)C1,0.3252
CC(=O)c1cnn(n1)C,0.2043
ON=C1COC1C#C,0.2482
CC1CCC(OC=N)O1,0.286
O=C1CC(OC1=O)C#C,0.1721
CC1(CCC[NH2+]1)C([O-])=O,0.2691
CC1(O)C2CC=CC1O2,0.2345
CN1CC11CCC(O)C1,0.2933
CCCC(CC)NC=O,0.2825
CCOC(=NC)C(=O)C,0.1778
OCCC1C=CC2OC12,0.2442
[O-]C(=O)C[NH+]=CN1CC1,0.1589
CC1CCCC2CC12O,0.3217
C1OCC11C2OCOC12,0.301
CCCCC(=O)COC,0.2344
CC(C#C)C(CO)C#N,0.2956
CC12COC1(C)C(=O)N2,0.2486
CC(=O)C=O,0.1574
CC12CC(C=C1)C1NC21,0.2547
CC(O)C1=NC=NC=N1,0.2042
CCC(C)(C)OC=NC,0.2735
CC1C2OC(CO)C12O,0.2964
c1c(oc(n1)N)OC=O,0.2056
C1OC2C3CC12CC3,0.3013
CC12OC1C(O)CC2O,0.326
O=CC1=CC(=O)C2NC12,0.1442
CCC1(CC=O)CCO1,0.2212
O=C1OC2C3CC12OC3,0.252
COC(C#N)C1OC1C,0.2887
C1CC2(C1)C(=NO)CN2,0.229
CCN=COCC#C,0.2672
CCC(C#N)C1(O)CC1,0.3094
OCC1N2CC1(O)C2,0.3117
CC1=NCC(=O)OCO1,0.2533
N=COCC1=CNN=N1,0.2535
C1C(=O)NC1(C=O)C=O,0.1995
CCC1C2CCC(O)C12,0.3225
C1C(CN1CCC=O)O,0.2066
OC1=CN2C3CC3C2=C1,0.2038
CCC1(CC(=O)C1)C#C,0.2199
O=C1CNC(=O)C1C#C,0.2048
C1CC11COCC2CC12,0.3196
OC1CC1C1CC1C=O,0.2281
COC1C=CCC1C,0.2587
CC1C2C3C4N3C1C24C,0.3045
CC(=O)C1C2CC1C2=O,0.2172
O=C1C2CC1(C2)C#N,0.2532
CC(O)C1(O)COC1,0.3039
CC1(CO)OCC1C#N,0.2822
CC(O)(C=O)C1CCC1,0.2224
Cc1cn[nH]c(=O)c1N,0.1735
N=C1OCC11CC2CN12,0.2555
c1nc(on1)OC(=O)N,0.2624
CCN=C1OCC1C#C,0.2719
OCCN=C1OCC1O,0.2556
CC1CCCC2CC12,0.3406
CC(=O)CC1NC1(C)C,0.2266
COC12CN3C(CC13)C2,0.3035
N#CC1COC1C#N,0.2809
CC(OC1CC1)C1CC1,0.3231
OCCC1C2C3CC1C23,0.3266
COC(N)=NC(C)C#N,0.2782
Cc1c(c(on1)C)C#C,0.2166
OCC12CC3(CO3)C1O2,0.3185
CC12OC1C1(CO)NC21,0.2774
Cn1ccc(=O)cc1O,0.2049
OC1CC2OCC1C2O,0.2987
CC1CC11OC(=O)C1C,0.2793
CC(O)CC1CC1C#C,0.2898
CC1(CC#C)CC1C#C,0.2755
CC(O)CC1CC1(C)C,0.3191
CC1=CC2CCC(C1)O2,0.255
Cc1conc1NC=O,0.2314
OCC(=O)C1(CO1)C#C,0.2246
CC1(C)N2CC(O)C12C,0.2855
CC(C#C)C1=CNC=N1,0.253
CCCc1n[nH]nn1,0.2608
OCC1CC(O)C1=NO,0.2376
CC1(O)C2CC1(CO)C2,0.3189
CC(C)(CC#N)CO,0.313
N=C1NC(=O)CC11CO1,0.2455
CCC1(C)NC1C1CN1,0.2997
N#CC1COCC11CC1,0.2975
C[NH2+]CC1=C([O-])N=NO1,0.1227
OCC12C3CC4C(C13)N24,0.2941
CC1C(O)C1(O)C(C)=O,0.2252
CCCC(O)C1CN1,0.3169
CC(O)C1(C)C2CCN12,0.2941
CC12CC(O1)C21CC1,0.3173
c1c(c(nc(n1)O)O)O,0.193
C1CC(=O)c2c1nno2,0.1808
CC12CC(C1)C=C2CO,0.2363
c1cnc2c(n1)CC=C2,0.1875
CC1=CC2OC2C2OC12,0.2361
Cn1c(nc(n1)N)O,0.2458
CC1(CC(=O)C=C1N)C,0.2056
C#CCCCCOC=O,0.2754
NC1=CN=C(O)OC1=N,0.1662
C1OC2C3CCC1C2O3,0.3168
CCN(C1CC1)C(=O)C,0.2506
CCOC=NC1COC1,0.2523
C(=O)C#CC(=O)NC=O,0.177
CCOC(=O)C(N)C#N,0.2529
CC1(C)C2C3OC2C13O,0.285
N=C1OCC2C3CN3C12,0.2528
OC1C2COC1C21CO1,0.2998
CCCC(CO)C(C)=O,0.2305
NC(=O)CCC(O)C=O,0.2117
CCC(COC)C(C)O,0.3133
c1c(nno1)CO,0.2306
C#CCCC(=O)N1CC1,0.2514
Cc1nccc(n1)C#N,0.1879
N=C1OC2CNCC1O2,0.2612
OC12CC1N1CC21,0.2898
CC(=O)Oc1ccno1,0.2434
CC1(CC1C=O)C1CC1,0.2247
COC1OCC(O)C1O,0.3296
CC1(O)C2OC(C)(C)C12,0.2959
c1c(ocn1)NCC=O,0.1745
Cc1nc(n(n1)C)NC,0.2471
CC(C)(O)C1(O)CC1O,0.302
O=C1C2CC2C2OC12,0.2039
OC12CC=CC3C1CC23,0.2496
O=C1CC2=CCCC2O1,0.2453
O=CCC1C2C3CC3C12,0.194
CCOc1cnnn1C,0.2437
CC1C2CC3C2CC13C,0.3542
CC1C2NC1(C=O)C2O,0.205
CC(C)C1(C)C2CC1O2,0.3145
OC1CC2(CO2)C1C#N,0.2932
CCC1(C)OC1(C)CC,0.3334
Cc1cc(c([nH]1)C#C)O,0.1902
c1coc(=O)n1CCO,0.2378
NC1(C#N)C2OC1C2O,0.2747
C[NH2+]CC1=C([O-])C=CO1,0.1708
CC1C2OCCC(C)C12,0.3127
COC(C=O)C1COC1,0.2066
CC1(OC2CNC12)C=O,0.2055
c1c(cnc(c1F)F)N,0.1904
O=CC12C3CN=C1NC23,0.164
CC1CC2(C)OC12,0.3357
COC1C=CCC2OC12,0.2655
O=CCN1CC1CC#C,0.2204
CC12C3CC3C3C1CN23,0.3091
c1c(c(nn1C=O)N)N,0.1851
CN(C)C12C3CC1OC23,0.2964
C(=N)N(C=N)C=N,0.2278
O=CC1CC11COCO1,0.2191
N#CC12NC3C=CC1C23,0.2137
Cc1cncn1C(=O)N,0.2072
CC12CC1C1(CC21)C=O,0.1959
CC12CC(C)(C1)C2O,0.3172
CCC1C(C)C1(O)CC,0.3048
CC12CCC1C(C2)C#N,0.3126
c1c(c2c([nH]1)NCC2)O,0.2233
OC1CC2C1N2CC#N,0.2748
CCC1C2CC1C2C=O,0.2201
COC1CC2NC2(C)C1,0.3048
CC(C)C1=CCC(=O)N1,0.2144
CC1=CCCC(C1)C=O,0.2182
CC12NC1CC=CC2=O,0.1877
CCC1(COC=N1)C=O,0.2132
O=CC12CC1C1CN21,0.2048
CC1(O)C2COC12C#N,0.2429
N#CCC12CC3C(C1)C23,0.2916
CC1NC1CNC(C)=O,0.2783
OCC(CNC=O)C#N,0.2786
CCCc1cnn[nH]1,0.2521
C1C2C3C4OC4C=C1C23,0.2136
C1COC2C3OC2C3C1,0.3085
CC12CCN3CC3C1O2,0.2957
C1C2CC11CCCCC21,0.3554
CC1CC(C)C(=O)C1=O,0.1425
Cc1noc(=NC)n1C,0.2207
OCC1C(OC1=O)C=O,0.226
CCOC1(CC1)C2CC2,0.3107
C1CC1Nc2n[nH]nn2,0.2077
CN=C1ON=CC(F)=C1,0.1594
CN1N=NC(=O)NC1=N,0.1835
CC(CCO)C(F)(F)F,0.3444
c1c(nn[nH]1)N2CC2,0.2395
CC12C3CC1(C)C(=O)N23,0.2477
CC(C#N)N1CC(C)C1,0.2664
CC1CC(O1)C#CCO,0.2729
OC1C2C3CC(N23)C1=O,0.2075
C#CCN=COCC#N,0.266
CC1(C)N2CC3C2C13O,0.2843
CC1C2CC1C2(O)C=O,0.2188
CCN(C)C(=O)C=O,0.1762
CCc1c[nH]c(=O)[nH]1,0.2316
OC1CC(=O)NC1=N,0.2469
N=C1CCC(=O)C(=O)O1,0.1765
CN=c1[nH]c(co1)OC,0.227
CCC1(O)CNC(=O)C1,0.2764
c1c(ncnn1)N2CC2,0.176
N=C1ON=C(CC#C)O1,0.2444
CCC1=NC(C)C(=O)O1,0.2476
OCC12OC3CC1(O)C23,0.2769
CC1C2CCOCOC12,0.3202
c1cc2c(nc1)onn2,0.1947
CC(C#CC=O)C1CC1,0.2051
COCC(C)C1COC1,0.3171
N#CC1(CC2CC2)CO1,0.2924
O=C1OC=C(O1)C1CN1,0.2357
COCC(C)C#CCO,0.2785
N=C1C=CN=CNC1=O,0.1729
Cc1cocc1N2CC2,0.2308
C#CC1=CCCNC1=O,0.1902
O=C1C2C3C4C(CC14)N23,0.2198
OC1CC=CCC(O)C1,0.2552
CCC1(CN1C=O)C#N,0.2489
CC(C)OCCC=O,0.2272
OC1CCC(=O)C(O)C1,0.2297
CC1C(C#C)N1C,0.2571
CC1OC2CCC1CO2,0.3165
CC(O)C1(C)CCC1=O,0.2161
CC1NC(=O)C1(O)CO,0.2589
Cc1cnc(nc1)C,0.2069
O=CNC1COC1=O,0.2633
CC(O)CN1C=NC=N1,0.269
CC1OC(=N)CC=C1,0.2629
CCC(C)(OC)C#N,0.3032
OCC1COC(=O)CN1,0.2472
C#CCn1c(ncn1)O,0.2596
N#CCC1CCC11CC1,0.3165
CC12C3CC1OC(=O)N23,0.2811
NC(=O)C(N)(C#C)C#N,0.2492
CC12NC1C1OCC2O1,0.3094
CC(C)C1=CNC(=N)O1,0.2229
O=CC1CC11CCCC1,0.2268
C1COC(=N1)CC(=O)N,0.251
ON=C1C2OC2C11CC1,0.2385
CC(CO)N(C=O)C=O,0.2127
CNC(=O)CNC=O,0.2612
CN1CC(C#N)C1C=O,0.1984
CC1C(O)CC2CC12O,0.3176
NC(=O)C12CC1C(=O)O2,0.2449
c1cncc2c1onn2,0.1988
CC(=O)N1CC2C(O)C12,0.2514
Cn1cc(cnc1=O)O,0.155
C1C2C1N1C2C11COC1,0.2783
CCC1=CCCC(O)C1,0.2593
CCc1c(cc[nH]1)C,0.2403
CCc1c(cc[nH]1)C=O,0.1955
OC1CCC(=O)C=CC1,0.1891
CC12C=CC3C1C1C2N31,0.2309
CC(O)C(C#N)C1CC1,0.3088
CN1C2C3C4=CCC13C24,0.1494
O=C1CNC(=O)N2CC12,0.2121
OCC1OC2C1OC2=O,0.2456
O=C1CC2OCOC2C1,0.2176
C1C2C1C1C3C4C(C23)N14,0.3107
CC12CC3CC3(C)C1O2,0.3441
OC1C2COCC=CC12,0.2303
CC1NC11COC2CC12,0.3039
OC1(CC=O)C2CC1C2,0.2298
O=C1CN2CCC2CO1,0.2295
CC(C)OCC(O)C#C,0.2843
CC1C2OC1C2CC#N,0.2845
OC(C#CC=O)C1CN1,0.1845
OC1CC(CNC=O)C1,0.2813
CC1(CC1)NC(=N)C#N,0.2099
N#CC12CN3CC3C1N2,0.2497
CC1OCOC2CC12O,0.3114
O=CNCC(C=O)C#N,0.2188
C#CC1OC1C#CC#N,0.2156
CC1CC2NC1C2=NO,0.2582
N=C1C=CC(=O)OC=N1,0.1899
C#CCN1CC1,0.2771
CCC1C2CC1OCC2,0.3173
OC1CCN=C1NC=O,0.2263
CCC1CNC1=O,0.2804
CCOCC(C)CC#N,0.3
OC1CC1(C=O)C1CN1,0.2072
O=CNCC12CC1CC2,0.2769
CCOC1CC2C(O)C12,0.3115
COC1(CC1(C)C)C#C,0.2771
CC12NC1CC21COC1,0.3012
OCC1COCC=CC1,0.2635
CC12CC(CC1O)C2O,0.33
CCC1(CC(=O)C1)CC,0.2215
OCC1C(NC1=O)C=O,0.2217
CC1(O)CC(C)(O)C1=O,0.1916
CC1(O)CCC(C1)C=O,0.2286
CC1OC23CC12CC=C3,0.2279
OC12CC3CC1(O)C23,0.2757
Cc1cc([nH]c1C#C)O,0.1932
Cc1nc(co1)C(C)C,0.2412
CC12C3N1C1C2CC31O,0.2887
NC12CC(O)C1OC2=O,0.2471
Cn1c(nc(n1)C#N)O,0.2242
CC1=NOC(F)=CC1=N,0.1903
COC1CC1C#CC#C,0.2117
CCOCC(C)CC#C,0.3083
C1OCC2NC2CO1,0.3238
O=C1C2CN3C4C3C1C24,0.2147
N=C1OC(=O)C2NCC12,0.2311
O=CC1(CCCO1)C#C,0.2078
CCC(O)C1OCC1O,0.2955
O=C1CC2CCC(C2)C1,0.2227
CCOc1cnoc1,0.2249
COC1CN2CC1(O)C2,0.2852
COC(=O)C1(CN1)C#C,0.2463
N=CN1CC11COC1=O,0.2421
C#Cc1cc(co1)C=O,0.1783
COC1COC1C#N,0.274
COCC1C2OC1C2O,0.3018
CC1CCC(O1)C(C)=O,0.2208
CN1C2C3CC3C(=O)C12,0.1917
COC1CCC(C1)C=O,0.2294
CCC1=C(NC(=O)C1)C,0.2096
COC(=O)c1cc[nH]c1,0.2162
C1CC1CCC#CC#N,0.2435
CCC1(CO)CCO1,0.3179
CC(=O)NC12CC1CC2,0.2659
Cc1cnc(nc1C)F,0.2172
O=COC1C2OCOC12,0.2468
CC(O)C1=NOC(=O)O1,0.2688
C1CCCCCCC1,0.3625
CC12CC1C1OC1C=C2,0.2398
OC12CC1CC1NC21,0.3038
CC1(C)OC(=O)C1C=O,0.2246
N=C1OC23COC2C1C3,0.2683
NC12CC1OCC2C#N,0.2762
CC12CN=C3NC1C23O,0.1614
CN1N=CN=C(N)C1=N,0.1623
COC1=NC(=N)C=NO1,0.2001
C1NC23C=CC4C2OC134,0.1991
CC1C(C(O)CO)N1C,0.2832
C1CC23CCC(OC2)C13,0.3189
CC1CC11CCOCC1,0.322
OCC#CC1OCC1=O,0.2119
CCNC(=NC)C(=O)C,0.1624
CNC(=NCC#N)C#N,0.2035
N=C1OC2COC12C#N,0.2471
CC(C)(C)C1(CO)CN1,0.3031
CC12C=CC3C1N3C=N2,0.2285
CCC1CC(C)C(=O)C1,0.2218
C1N2C3CC4COC13C24,0.3119
O=C1C2OC3C2COC13,0.1952
CC1(C#N)N2CC1(N)C2,0.2624
CC1(C=O)C2C3CN2C13,0.2067
O=CC1CCCOCO1,0.2257
CC1CC23CN4C2C1C34,0.3011
c1c(c(no1)O)CC=O,0.2204
CC1=NCC2NCC2O1,0.2621
C1C2NC2C2=C1ON=N2,0.1676
CC12CC1(C)N=CO2,0.2599
OC1C2COC1C(=O)O2,0.2497
CN=C1CC(C)C(=O)O1,0.2521
CC(C)(CO)NC=O,0.2784
C1OCC2=CCCOC12,0.2527
NC(C#N)C(O)C1CC1,0.2971
O=C1CC2CC1OCC2,0.1994
OC1C2COC3CC3C12,0.3021
COC=NC(C)C#N,0.2697
c1ccc(=O)cc(c1)N,0.146
CCC(C)C1(C)CCO1,0.3152
C1CC(O1)C1=NOC=C1,0.2427
CCC1CN1CC#C,0.2658
C1C2CCCCCCC12,0.3301
CC#CC(C)C1CO1,0.3005
CCC(C)(C#C)C(C)=O,0.2276
CC1OCC(=O)OC1=N,0.2487
CCCN=C1OCC1O,0.2715
CC1(O)C2CC11OCC21,0.2994
CC1NC1C(O)C(C)=O,0.2281
COCCOC(=O)CN,0.2616
COCCOC1CC1O,0.3107
CC12CCC1C(=O)NC2,0.2675
CC1(O)CC1CCO,0.3233
COCCC(C)CCO,0.3289
CC(C)COCC(=O)C,0.2345
O=CC12CN3C(C13)C2=O,0.2017
CC1(C)OCCC2NC12,0.3097
CC1OC1C(C)(C)C#C,0.3104
CC(C=O)N1N=CC=N1,0.222
CCCn1ncc(n1)C,0.2492
COC12CC1C(C)(C)C2,0.3285
COCC1(C)CN1C=O,0.2534
Cc1c(cc([nH]1)C#N)O,0.1858
CC12C3C4C1C=CC2N34,0.2295
COCC1C2CN1C2,0.3066
OCCC1C2CC(=O)C12,0.2293
CC12CC1C(C)(C)O2,0.3161
CC([NH3+])C1=C([O-])N=NO1,0.1515
C1OC1C12CN1CC=C2,0.2314
COCCc1ccno1,0.2447
CN1C(=O)CC1(C)C#N,0.2738
CC12CC3NC3C1O2,0.3078
CCC12NC1(C)C1OC21,0.3145
CC1=C([N-]N=N1)[NH+]=CN,0.1337
CC1C=CC2OC12C#C,0.2384
CC1C=CCC1(O)C#C,0.2644
COC12CC(C1)C2(C)C,0.34
CC12CC1N1C(C#C)C21,0.242
c1nc(no1)OC2CC2,0.2425
N=C1C=C(NN=N1)C#C,0.1601
O=CCCC1CC=CC1,0.2237
CC1=C(COC1=N)C=O,0.1734
Cc1c(onn1)C(=N)N,0.192
CCCC(OC)C#CC,0.2934
CC(O)C1(C)OC1C=O,0.2174
CN1CC2C(O)C12C#C,0.2315
c1c([nH]c(nc1=O)N)O,0.2252
N#CC1C=CCC2CC12,0.2652
CC1COCOC(=O)N1,0.2879
C(CO)c1c(nn[nH]1)O,0.2216
CC(O)C(O)C(=O)C#C,0.1857
N=COCC1=CC=CN1,0.2321
C1C2C3CC4OCC24C13,0.3231
CC1OC(=O)CCC1O,0.2715
CN1C2CC2(C)C1C#C,0.2401
c1nc(c(c(=O)o1)F)F,0.1897
N#CC12CC(CCC1)N2,0.2694
NC1(C=CNC1=O)C#N,0.2067
OCCC1CNC1C#N,0.2651
CC(O)(CN1CC1)C#N,0.2925
c1c[nH]c2c1oc(=O)[nH]2,0.2174
CN=C1CC2(C)CC2O1,0.2644
CCC1=CC2CC1C2O,0.2379
O=C1CCC2CNC2=C1,0.1988
C1C2C3OCCC1C23,0.3083
CC1=CCC(C#N)C1=O,0.1985
CC(=O)N1CC12COC2,0.2485
c1c(non1)OCCO,0.2323
CCC(O)(C#C)C#N,0.2815
N=C1COC2=NCCN12,0.2331
O=C1OC=NC1C1CN1,0.2157
CCCC1(CC1)C(C)O,0.3319
ON=C1COC2CNC12,0.2294
OC1(CC1CC=O)C#C,0.2197
CC1(CC1)C1(CO1)C#N,0.2919
CC1C2NC1C(=C2)C#N,0.184
CC(O)C1=CNN=N1,0.251
C(C1CO1)C12CCC1O2,0.3247
OCC12CC1(O)C(=N)O2,0.2748
OC1C2OC1C1CC21,0.3345
c1c(oc(n1)N)NC=O,0.1915
CC1CN2C=CC=C2C1,0.2433
COC1COC(=N)O1,0.3108
CC1C2CCC1C2C,0.372
NC=[NH+]C1=CN=N[N-]1,0.1356
CC(=O)OC1CCOC1,0.2645
O=C1CC2CC1C(=O)C2,0.1948
N=COC1C2COCC12,0.2656
CC(CC=O)N1CC1C,0.211
COCC1C(C)C1(C)C,0.3265
O=CC(C#N)C#CC#N,0.2077
NC1=COC(=N)C(F)=C1,0.1538
CC1OC1C(=N)OC=O,0.2446
N=C1C=C2CCN2N=N1,0.1648
OC1COCOC1C#C,0.2812
CC1CC(=O)CCO1,0.2248
OCC1=NNC(=N)C=N1,0.1464
CCC1(CCCC1)CO,0.3312
CC(C)CN1CC1CO,0.282
CCCC#CC(O)C#C,0.2669
CC(=O)C1(CC1)COC,0.2325
C#CCc1c(n[nH]n1)O,0.2331
COCC1=CC2CC1C2,0.2372
CN1N=C(N)N=CC1=N,0.1272
c1[nH]c(c(n1)N)OC=O,0.1932
CC1NC(=O)CC2OC12,0.2737
OC12CC3CC1C(=O)C23,0.2284
CCC1=CN(C(=O)C1)C,0.2045
CC#CC(C)CCCO,0.3034
c1[nH]c2c(n1)CCC2=O,0.2006
CC1OC1C1CCC1,0.3393
CC1CC2OCC12C,0.312
O=CNC12CC1COC2,0.275
CC(CN)(C#N)C(N)=O,0.2674
OCCC1OC(=N)C=C1,0.2105
CC1C(C2CO2)N1C,0.2966
O=C1CCC2(CN2)C1,0.2179
CC1=CC2C(O)CC2C1,0.2479
CC12CCC1C(=O)O2,0.2777
COC12CC1(NC2)C#C,0.2276
CC1(CN2CC2)CCO1,0.3117
Cc1[nH]cc(n1)O,0.2263
CC1(CC1)C(O)C(N)=O,0.273
O=CC1CC2C3OC2C13,0.2118
N#CC12CC3CC1C2O3,0.2849
COC1(C#C)C2CC1O2,0.2766
C1CC(CCCOC1)O,0.3256
CC(O)C1(O)CCC1O,0.301
CCC1COCOC1,0.3368
CC(C)(C=O)C(=O)N,0.2158
CC1COC(=N)OC1C,0.2918
C1C(OC=N1)(CO)CO,0.266
CC1OCC(CCO)=C1,0.2467
C1C2OC3(COC3)C12,0.3129
OC12CC(=O)C1N1CC21,0.198
c1ccnc(c1)CC=O,0.2063
c1c2c(c([nH]1)N)nc[nH]2,0.1939
CC1C2C=CC(C=O)N12,0.1934
CN1CCC1C(=O)C=O,0.1346
COC1CC2NC12C#C,0.2542
COc1ccc(cc1)F,0.2058
CC(C1CO1)C(F)(F)F,0.3649
C1OC2C=CCC3OC123,0.2581
CC1CC1CC1CCO1,0.3253
CC(CC#N)(CO)CO,0.3052
CC#CCNC(=O)C#C,0.2238
CC12OC1CC2(C)C#C,0.2929
CC1(O)C2CN2CC1O,0.2927
CCC1CC(CCO)C1,0.342
c1c(c(no1)C#N)C#N,0.2237
Cc1cnoc1C(=N)N,0.1995
COCC(C)CCC=O,0.2294
CC1C2CCCC1C=C2,0.2551
NC1(COC1=O)C1CC1,0.2559
CC1(C)COCC11CO1,0.3303
CN=C(C(=O)N)N(C)C,0.213
O=C1CN=C2NC=CC12,0.1943
CC#CC1(CC1N)C#N,0.2582
CC(C)OC(CO)C#N,0.2977
CCCCNCC#N,0.2701
OCCCCC(O)C#N,0.2832
N=C1N=NNC=C1C#C,0.1518
C1C2OC1C21CCOC1,0.3178
OCC1CC2C1CC2=O,0.2193
NC(=[NH2+])C1(CC1)C([O-])=O,0.2544
CC1CN=C(N)C(=O)C1,0.1726
C1CC1(CC=O)O,0.2209
COC1CC(=O)C11CN1,0.2065
C#CC12OCC3C1NC23,0.2745
CCOC12CC1NC2=O,0.2399
CCCN1C=NCC1=O,0.2279
c1c(coc1CO)N,0.2152
c1c(nno1)NCC=O,0.1843
O=C1C=CC=CC2CC12,0.1604
CC1(C)CC11CCCO1,0.3022
CC(=O)CC1(CC1)C#N,0.2254
CC1(CO)NCC1=O,0.2121
CC12CC1C1(C)C(O)C21,0.2739
Cn1c(=O)cnoc1=O,0.2067
c1c2c(n[nH]1)C=CCO2,0.1847
CC12CCC1(C)N2C=O,0.2431
CC1C(OC=N)C1C#C,0.2621
CCC12NC1CNC2=O,0.256
CC(O)C(C)C1CC1,0.3303
CC#CC1CC1,0.2837
CCC(O)C1C(O)C1O,0.2833
OCCN1CC2OCC12,0.2788
O=C1CNC2(CC12)C#C,0.1939
CC1OC(C)C1C1CC1,0.3235
CC1OCC2C(O)C12O,0.2993
C1CC1C#CC(=O)CO,0.2039
CC1C2C3C4C3C2(C)C14,0.3227
CC(C)(CO)C(=O)CO,0.2295
N#CC1OCOC1C#N,0.2882
O=C1CCC2CC2N1,0.2691
C1C2C=CC3=CC=C1N23,0.1476
Cc1ccc([nH]1)C(=O)C,0.1813
COC1=NCCN1,0.2764
OC12CCC1C2OC=N,0.2738
CCC1CCC2C(C)C12,0.3325
C1N2CCN=C3NCC123,0.2439
CCCC1C(CC)N1C,0.2868
CC1(CO)CCOC1,0.3173
CCCN1CC1C#C,0.2632
c1c(cn2c1C=CC2)O,0.1632
CC1OC2C1C(C)C2=O,0.198
OCC12CC(C1)(N2)C#N,0.2741
CC12CC(CO)=CC1O2,0.2403
CNc1c[nH]c(n1)C#N,0.1701
C1C2CC11CN=COC21,0.2715
CC(O)C1C2C3CC2C13,0.3325
O=C1COC1CC1CC1,0.2219
CC1=C(C)C2NC1C2=O,0.2325
OC12CC3NC1C2C3=O,0.203
O=C1OCOCC1C#N,0.2625
CCC1(CC1O)C(N)=O,0.2736
C#CC1NC1C1COC1,0.2756
Cc1c(cn[nH]1)NC=O,0.2208
CC12CC3NC(=O)C1C23,0.2565
CCC1(CC1CO)C#N,0.3111
CN(CC#N)C1CCC1,0.2518
CCCC(O)CCCO,0.3308
c1c(=O)nc(on1)N,0.1865
CC(=O)C(C)(C)NC=O,0.223
N#CC1CC2(CN2)C1,0.2865
CC1=CC2N3CC2(C)C13,0.2113
N#CC1C2CN1CCC2,0.2516
N=C1N2CCC2C11CO1,0.2256
CC1CC11CCC(=O)N1,0.2661
CCCC1C2OC(C)C12,0.3163
C1NC1C12CC(C1)O2,0.3005
CCC(=O)C1OC1C=O,0.1996
CCC1=CC(=O)C(=O)C1,0.1415
CC(NC=O)C(=O)CO,0.2148
C(CC#N)COC=O,0.2864
CC1(C)CN1CC1CO1,0.3097
CN1C=C(C)C(O)C1=O,0.2
CC(=N)OC(CO)C#C,0.2732
CC1C(C)N1C(=N)C=O,0.1691
C#CCOCC(F)(F)F,0.2899
CC1NC(=O)CC11CO1,0.2743
CC1(C)COC1CC#N,0.2954
N#CC12CNC3C1OC23,0.2575
CC#Cc1nc(no1)O,0.1997
N#CC1NC23CC(C2)C13,0.2524
C1C(=O)NC1(CO)CO,0.2688
COCCC1(CC1)O,0.3243
COC1C2NC2(C)C1C,0.293
CC1(CC(=O)C1)C(=O)N,0.2265
Cn1cnc(c1N)O,0.2264
CC12CC1CC1(CC1)C2,0.3441
CC1=CNC(=N)OC1=O,0.1863
C1CC2OCCOC2O1,0.3171
CC1C2CC=CCOC12,0.2565
CC1(C)C2NC(=O)C12,0.2513
CC(O)C(C)OCC#C,0.2821
CC12OC(=N)C1(O)C2O,0.2626
CCCC1C2CCC1O2,0.3204
CN1C2C3OC(C23)C1=O,0.23
CCC1C(O)C=CC1=O,0.1878
CCOC(CC#C)C#N,0.2856
OCC1(CN1)C(O)C#C,0.2896
OCCC1C2NC2C1O,0.3086
N#CCC1C2C3NC3C12,0.2701
C1COC(O1)COC=O,0.2724
CCc1c(cc([nH]1)C)O,0.2205
O=C1CC2CC2C=C1,0.1857
C1C2CC3OCC2C1O3,0.321
CC1(C)OCC(=N)O1,0.2899
C#Cc1cnoc1N,0.2138
C1C=CC(O1)(C#N)C#N,0.2573
CC#CCC(C)CC#C,0.2862
CC1CCCC1CC#C,0.3142
OC1C2CC1C=CCO2,0.2453
CCC1(O)C(C)OC1C,0.3023
COC(=O)C(=O)C1CC1,0.1812
CC1OC(=N)C11COC1,0.2706
CCC(C#N)C1CCC1,0.3369
CCc1cc(c(o1)N)N,0.2124
CCC1CC2C(OC)C12,0.3167
Cc1cnncc1C,0.1843
CC(O)C1C=CNC1=O,0.2123
CCC#CC1C2CC1C2,0.2886
CC(C)C1OC(C)C1C,0.3151
C1CN1CC(=N)NC=O,0.2293
CC1OC2CCC12C,0.3128
COc1cncnc1N,0.206
C1C2C3CC4OCC13C24,0.337
N=C1ON=NC=C1C#N,0.1495
CC1=CN2CC(O)C2=N1,0.2389
c1c(ncc(n1)N)C#N,0.1798
CC12CC1C(C)(C)CC2,0.333
CC1CC2(C)OC(C)C12,0.3074
c1c(nno1)CCCO,0.2318
C1NC1C1OCCCO1,0.33
CC(C)C1C=CCC1O,0.2624
N=C1OCC(OC=O)O1,0.2579
CCCC1CC2(C)CC12,0.3286
CCN=C1OCC11CN1,0.2615
N=C1OC(=O)C2CNC12,0.2363
CC1=CC(O)C2NC12,0.2396
OC12C3C1N1CC3N=C21,0.1198
COC1CCC1CO,0.322
c1c(ncn1C=O)CO,0.1905
CCOc1c(cn[nH]1)C,0.2515
c1c[nH]c2c1oc(n2)N,0.2039
CC1=CC2C(C1)OC2=N,0.2526
CC#Cc1cnn[nH]1,0.2099
CC1(C)NC2C1OC2=O,0.242
Cn1c(=O)cn[nH]c1=O,0.202
CC12C3CC1(O)CC23,0.3056
CCC(C#N)C#CCO,0.282
N#CC1C2NC1C=C2,0.2115
CC1=C(COC1)COC,0.2415
NC1=CC(N)=NC(=N)O1,0.1897
N#CCC1CC11CCC1,0.3155
CCC1COCC1C=O,0.2208
Cc1ccc([nH]1)N(C)C,0.2228
CCC1=CC(O)C(=O)C1,0.2221
CCCC1COC1=N,0.2894
OC(CCCC=O)C#N,0.2287
N#CC1=CCC2COC12,0.2125
CC(C#C)C1CN1C,0.2754
c1c(c(c[nH]1)O)N,0.23
COC(CO)(C=O)C#C,0.2157
CC1CC1(O)C(C)=NO,0.2414
Cc1c(n2c(n1)CC2)C,0.2453
C#CC(=O)N(C=N)C=O,0.1934
CC1(CN=C(O1)C#N)C,0.2195
CC1(C)C2OCC12C=O,0.2165
CCN1CC1C,0.3128
C1C2CC3=C(N=CO3)N12,0.2153
CCc1c(ocn1)CC,0.2368
Cc1cc([nH]n1)C#N,0.2215
OC1C=CC2CC12C#C,0.2331
CC1CC=CC1CC=O,0.2241
CCCC1CC1CC#N,0.3252
CC1(CO1)C(=O)CC#N,0.2244
CC12CCC(C=C1)C2=O,0.2348
CC1C2CC2(C)C1=NO,0.2445
c1cnn2c1cncc2,0.1773
CC12CC1CCCC2O,0.3315
Cc1c([nH]c(n1)O)CO,0.2332
CC12OCCC1=CCO2,0.2492
O=CNC1CNC1=O,0.2744
C1OC11C2CC3CC2C13,0.3378
OC1C=C2C=CC3C1C23,0.1755
C(CO)n1nc(nn1)N,0.2178
OC1CCCC1C=O,0.2259
CN=COCC1CCC1,0.2727
CC1(CC1)OC=O,0.2769
O=C1CC2COC12,0.1998
CNC1(CC1)C(=O)C#N,0.1586
CCC1OCCCCO1,0.3293
C1CN=COC(=O)N1,0.2525
CC(CC#N)C(C)C=O,0.2245
N=C1NN=NC=NC1=N,0.1578
CCC(O)C1C(C)C1O,0.3057
CCC12OC1CC2(C)O,0.3157
CC1COC=NCC1=O,0.2164
CC1=CC2(C)OC1C2=O,0.246
Cc1nc2c(o1)CC=C2,0.1917
CC12C=CC3C1C(O)C23,0.225
O=CC12CC1C1CC2C1,0.2308
CCC(C#N)C(C)(C)C,0.3438
CC12NC(C1O)C2C#C,0.2861
CC1(CC1)C12CC1CO2,0.3079
CC1CN2CC12C(C)=O,0.2165
c1c2c([nH]n1)CCOC2,0.2516
CC1CNC2=C1NN=C2,0.2119
CN=C1C=CNC=N1,0.1835
OC1CCC11CCC1,0.3223
CC1CC2(CN(C)C2)O1,0.2923
CC1=NC(=O)N=NO1,0.2404
CC(=O)c1c(nco1)N,0.1729
CC12C=CCC1(O)C2O,0.2329
c1nc(c(o1)CO)C#N,0.2242
CC(CC(F)(F)F)C=O,0.2297
CC12NC1C1CCOC21,0.2894
NC1(COC(=N)C1)C#N,0.2755
OC1C=CCOCC1=O,0.1958
COC(=O)C12CC(C1)O2,0.2447
OC1CN2C1=COC2=O,0.2252
CC12NC1C=CC2=O,0.1755
OC1C=CCCOC1=N,0.2461
CC1C2C3CC1(C=O)N23,0.215
C#CC(=O)NCC=O,0.2146
CCC(C)C1CC2CC12,0.3322
OC1C=CC2(O)CC12,0.239
OC1CCC(CC#C)=C1,0.2558
OC1(CC2CC12)C=O,0.2303
N=C1OC2C3COC2C13,0.2626
CC(=O)NCC1(CC1)O,0.2736
CC1OC2CCC12C#N,0.2735
CCC1(C)CC=CCO1,0.2671
C1OC23C1CC1C2CC31,0.3181
CCCCCOC,0.3395
CN1C2C(=O)CC12C#N,0.204
CC(C=O)C1(O)CC1O,0.227
CC1=COC(=N)N1C=O,0.1931
O=CC12CN1C(=O)OC2,0.2233
CC1C2CCC(=NO)C12,0.2409
OC1CCC=CC11CC1,0.2509
CC1OC(C)C11CO1,0.3295
Cc1conc1N(=O)=O,0.1902
OC1C2CC1OCO2,0.31
O=CC12OC1CC21CN1,0.2037
CC1(C)CCC2CC2C1,0.3318
O=C1CC23NC12CC=C3,0.2118
CC(=O)Cn1nccn1,0.227
CCC12CC(O1)C21CN1,0.3062
O=C1CCC2OC2CO1,0.2722
C1C=CCC2OC12,0.2697
FC1=NC=C(F)C(=N)N1,0.1883
CC(O)C#CC(C)=NO,0.2007
NC1=CC(OC=N)=NN1,0.2285
C1CC23COC(CC12)C3,0.3204
CC1C(OC1=N)C1CC1,0.2892
CC1(CO)CNC(=O)N1,0.2995
COC1C2C3N2CC13C,0.3158
O=C1OC2C3OC2C13,0.2419
C1C2C3C4N=COC13C24,0.2615
OC1C(O)C1C1CCO1,0.2782
OC1CCC(=O)C1C#C,0.2113
CC12OC1(C)C1C(O)C21,0.3068
CNC1COC1C#N,0.2393
CCC1C2C3C1C(C)N23,0.3177
COC(C)CCC#C,0.3107
OC1C2CC1C2CC#C,0.3109
CC1C2CC(C2)N1C=O,0.2673
CC1(CO1)C1OCCO1,0.3369
CC1OCC2CC12CO,0.3134
CCc1c(con1)OC,0.2284
Cc1c(onc1O)CN,0.2373
CC12COC(C1)C=C2,0.2466
c1cnc-2noncc12,0.153
CC1CC(C)C(=O)C1O,0.21
CC1C2NC2(C)C1C=O,0.2038
CCOCC(C)(C)OC,0.3288
NC(=[NH2+])[C-](OC=O)C#N,0.2018
c1c(cnc(n1)N)N,0.168
CC1C2CC1C2=NO,0.2702
CC1OCC2=C1OC=N2,0.2294
CC1(C)CC2(O)CN1C2,0.2938
CCCCCCC(C)C,0.379
Cc1cc(ncc1F)F,0.2159
OC1CCCC(O)CC1,0.3306
OCC1C2COC(=O)C12,0.2657
OC1CC2(CO2)CC1O,0.3153
CCOC1CC2(O)CC12,0.3215
CCC(C)(C)C(N)C#N,0.2954
CC12CC(C1)C1CC21,0.3434
C#CC1C2COC12C#C,0.242
CC1C2NCC12C#N,0.2525
CCc1c(nc([nH]1)N)O,0.22
C1Oc2c(n[nH]c2O1)N,0.2319
CC(N)C(=O)OCC#C,0.2541
O=CN1CCC1C#C,0.2625
CC1=CNC(=O)N(C1)C,0.2207
CCCN1C2CC1C2=O,0.2503
O=CCC1COC=N1,0.223
CC(C)C1(O)CC2OC12,0.3135
CC1C2CC(O)C1C2C,0.3359
CC1(CC1)N1CC1C#C,0.2563
N#CCC1NC1C1CN1,0.2848
C1C=CC2C=CC3C1C23,0.2398
CC12OCC1C2C1CC1,0.3063
CN=C(c1nc[nH]n1)N,0.2067
OC1C=C(NC1=N)C#C,0.1803
CC1OCOC(=O)C1N,0.2447
CC1CC(CN2CC2)O1,0.3196
CC1(C)CC2OC1C2O,0.3352
c1c(c2c([nH]1)nc[nH]2)O,0.2038
CC1OC2CCCC2O1,0.3344
O=CC1CC(O1)C=O,0.2056
CC1OCC1OC1CC1,0.3199
NC1=NC(=N)OC=C1O,0.1722
OCC1(O)C2CC(=O)C12,0.2249
O=C1OCCC1N1CC1,0.2566
c1cc([nH]c(=O)c1)O,0.182
CN=COC1(C)CC1O,0.2614
CN=C(C=O)OC=O,0.1626
CCCC1OCC=C1,0.2481
CC1OCCC11CN1,0.3173
CC(O)C(CC#N)C#C,0.3034
NCC(NCCO)C#N,0.273
C1C2C=C3CCN=C3N12,0.1903
C1=CC2C3C4C(C13)N24,0.2321
CC(=O)n1ncc(n1)N,0.1857
CC12NC3C(OC13)C2=O,0.1941
CCCc1cnoc1C,0.2377
CC(=O)C1COCC1O,0.22
CC(C)c1ccno1,0.2454
CN=c1cnc(n[nH]1)N,0.1342
CC12CC1C1CC21,0.2933
CC1OC2C1C1CC21O,0.3074
CC1COC(CO)=NC1,0.2755
Cc1coccc1=NO,0.18
OC1(C=O)C2CC1OC2,0.1937
NC1=C(O)C(=N)NN=C1,0.1637
C1CC23N=COC2C3O1,0.2311
OCC12OC3=NCC1C23,0.1623
CC(COCCO)C#N,0.3033
OC12C3CC1OCC2O3,0.2968
CC12CC(O)(CO)C1N2,0.2943
CCOC1C2OCOC12,0.2954
C1OC1C1CCC2CN12,0.3181
C1CC(C1)C1C2COC12,0.3104
OC1C(OC1C#C)C#C,0.2519
CCC(O)(CO)C1CC1,0.3264
CCCC12CC(N1)C2=O,0.2469
CCCc1c(con1)N,0.2168
CC1(CC#C)OCC=C1,0.2438
CC1CCC(C=O)=CN1,0.1884
CC1COC11C2COC12,0.273
O=C1CC2(C1)C1CCC21,0.221
CC12C3C4C1C(N34)C2=O,0.2097
CC1OCC2(CC2O)O1,0.3094
CN(C)C(=O)C1CCC1,0.265
CCC(O)CC(N)=O,0.2715
c1cncc(c1C=O)N,0.1546
OC1CC(C#C)C2NC12,0.2957
CC1CC11C(C)OC1C,0.3167
CN=C1N=NOC(C)=N1,0.2225
CN=COC1CN2CC12,0.2629
COC(=O)C(N)C#C,0.247
N=C1OC2CCNC2=C1,0.2091
CCn1cnc(=O)nc1,0.2002
CC12CC3NC(=O)N1C23,0.2662
CCC1=CCC2CC1C2,0.2482
CC1(C)C(O)C1CCO,0.2934
Cc1cnoc1C(=O)C,0.1942
CCN1C(C)C1C(N)=O,0.2354
CC(CC#C)C#CC#N,0.2362
CCn1ccc(=O)cc1,0.2018
CCC(CC)CC(=O)N,0.2786
C1C2OCCC3CC12O3,0.2916
N#CC12C=CC3NC1C23,0.2223
CCC(C)(OC)C#CC,0.2925
NC1=NOC(=N1)C1CN1,0.2191
CC1C2C3CC1C23O,0.3052
CC(O)C1=CC=CO1,0.2353
COC12CC(O)(C1)C2,0.3221
N=C1C=CC(=O)ON=C1,0.1765
NC(=O)C12CC(CC1)O2,0.2682
CC1COC(CCO)=N1,0.2713
COC12CC1C(C)(O)C2,0.3132
N#CC1C2COC12,0.2871
CC1OC11CCC1CO,0.3282
CCOC1COC=NC1,0.2682
CC(C)(C#N)C(O)C#C,0.2919
COC1(CCCO1)C#N,0.3091
ON=C1CC2OCOC12,0.2397
CCC1=CC(O)C2CC12,0.2392
C#CC(=O)C1(CC1)O,0.1932
OC(C#C)C1(CN1)C#N,0.2766
CC1=NC(=N)N=NO1,0.2253
CCC#CC(CO)OC,0.2845
CC1C2C3COC3C12C,0.301
CCC1=CCC(O)CC1,0.2603
CC(=O)C(O)C1CO1,0.2351
CC1=C(C)C(=N)OC=N1,0.1831
C1OC11CC2CC3C2C13,0.333
CC1C2C3NC3(C)CN12,0.3091
OCC1NC(=O)N2CC12,0.2886
OCCC(NC=O)C=O,0.2184
CC1=CC2CC2OC1,0.2361
CC12CC3(O)C(OC1)C23,0.3001
CCC(COC)C#N,0.3058
CN=c1cnc(no1)O,0.1518
OC(CC=O)C1CN1,0.2182
CC12CC3(C)CC1(C)C23,0.3264
O=CN1CC1CCC#N,0.2527
Cn1cn[nH]c1=O,0.2362
COC12CN3C=NC1C23,0.2125
OC1CC2C1C2(O)C#N,0.2793
C1C2OC3=NON=C3C12,0.2225
C#CCNc1ncco1,0.2298
CCC#CC(=N)NC=O,0.2158
COC(=O)N(C=N)C=O,0.2247
C1CC(O1)C1=CN=NN1,0.2452
CC1(CCOC1)OC=N,0.2761
OC(C#N)C12CC1CN2,0.2518
OC1C2NC=NC12C#C,0.2344
N#CCC12CC3C1CN23,0.2764
O=C1CC2C=CC(=O)C12,0.1822
c1c(c(co1)NC=N)N,0.2146
CC12CC3C4CC4C1C23,0.3242
CC12CC1C1OC21CO,0.291
CCC1NC(=O)C1C#C,0.2693
C#CC12C3C4C3C1OC24,0.2702
CC1CC1C#CC(C)=O,0.2069
c1c(nn(n1)C(=O)N)N,0.1969
CC1(C)OCC2C(O)C12,0.3045
CC1(C)C=CC2COC12,0.26
CNC(=O)C(C)C(C)O,0.2738
CC12OC3(C#N)C1NC23,0.2454
CC1C2C=CC(CO)N12,0.2252
CCC1=CC(=O)C(=N)N1,0.1542
CC(C)C(=O)C(C)C#C,0.2206
CC(O)C1=COC=C1C,0.2422
CC(=O)C(CO)CC#N,0.2263
CCC(CO)C#N,0.3096
CC1(CN1)C1=NON=N1,0.1983
CN(C)c1cc(on1)N,0.2305
C#CCC1=NCCCO1,0.2714
OC1C=CCC2NC12,0.266
CC1C2CC(CO)C12,0.3246
COC1(CC(=O)C1)C#N,0.2213
C1C=CC2NC2C2NC12,0.2331
C1CCC(C1)NC(=O)N,0.299
COC(C)CC(=O)C#C,0.1906
c1c[nH]nc1CN2CC2,0.235
CC12C3NC3C1C2C#N,0.2548
CC1C=CN(C=O)C1=O,0.2062
N#CC12NC1C1CC2N1,0.2637
c1cn2c(c1O)C=CC2,0.1685
COC1CC2CC2C1C,0.3238
c1c(onc1N)CO,0.2315
C1N2CC3OCC=CC123,0.2238
CC12CC1(O)C(N2)C#N,0.2504
O=C1CC23CCC(O2)C13,0.2226
CC12CCC(O)C1N2,0.3077
OC1C2CC1C21CCC1,0.3223
OCC1CC(O)CC1=O,0.2167
CC(O)C(=NO)C1CC1,0.2441
O=CCC1C2CC1OC2,0.2148
Cc1[nH]nc(n1)NC,0.2265
CC(C)C(C)C(C)O,0.3303
O=CC1(NC2CC12)C=O,0.1828
C1CN(C1)C(=O)C(=N)N,0.213
C1CC(C1)CC#CCO,0.2766
CC1CC(O)(C=C1)C#N,0.2567
c1c[nH]c2c1COCC2,0.2408
CC(OC(=N)C#N)C=O,0.2085
OCC1C2CCCN12,0.2893
CC1C=C(C)COC1=O,0.2612
CC(C=O)C1CC1(C)O,0.2241
Cn1cnc(c1C#N)O,0.2026
CC1(CO1)C1(CN1)C#C,0.2837
CC12CC(CC1)C2=O,0.2285
COC12CC(C1)CC2O,0.3156
NC(=O)N1C2C3CC1C23,0.2737
c1nc(on1)NCC=O,0.1963
OC12C3C=CC1C=CC23,0.2367
CCC1C(O)C2OC12C,0.3203
[NH3+]CC1=C(O)[N-]C(=N)O1,0.1775
CCC1(CCC1)OCC,0.3212
CC(CC#C)C1CCO1,0.3041
O=CCC12CC1N=CO2,0.2208
CC1(C)C2NC2C1=O,0.2159
Cc1cnccc(=O)n1,0.1622
C1CC1(C#N)NC(=O)N,0.2814
OCC1NC(C=C1)C#N,0.2425
CC(CC=O)C1(O)CC1,0.2272
CC12CCC(O)CC1N2,0.3031
CC1(O)C2CC3C2OC13,0.308
CCN(C)c1ccn[nH]1,0.2325
CCC1(CC1C)C#CC,0.2851
C1CC1NC=O,0.2757
CC1C(C=O)C1(O)C#N,0.2158
O=C1C2CC3(COC13)C2,0.2083
C1CC11CC2CC1C2,0.3581
CC1=NOC(=N1)C1CO1,0.2444
COC(C#C)C(=O)CO,0.2129
N=C1CCN1C(=O)C#C,0.2041
c1cncc(=O)cc1N,0.1458
N=C1CCN2CC2CO1,0.2584
NC1=NN(C=O)C(=N)N1,0.2003
CC1=CCNC(=O)C=C1,0.1827
CC12CN3CC3C1O2,0.2914
CN1CC1(C)C1(C)CN1,0.3026
CC1C2OC2C11COC1,0.3184
O=CCC12COC1CN2,0.2045
c1cc(ccc(=O)c1)N,0.1434
CC1(CC1)C(O)CC=O,0.2231
CC1CN(CC#N)C=N1,0.2368
CC(CCO)C1(C)CC1,0.341
O=C1NCC2(CO2)CO1,0.3105
COCCC(O)C1CO1,0.3331
CC1(CC1)C1C2CCN12,0.3116
C1COC(O1)CCC=O,0.2297
C1CC1C12C3CC1CN23,0.3227
CC12OC1C1(NC21)C#N,0.2418
C#CC1NC=NC1C#C,0.247
CCC(CC)C(=O)C#N,0.2062
CC1OC(C)=NC1C#C,0.269
CC12NC1C1(C)COC21,0.2899
CCC1(C)OC2CC1C2,0.3221
CN1C2CC2(C)C1C=O,0.1833
C#CC1C=CC2NC12,0.2401
C1CC1N1CC2(CN2)C1,0.2913
CCn1ccc(c1O)N,0.2173
O=C1CC2C(C3CO3)C12,0.2302
C1C2N1C=NC21COC1,0.2384
Cc1nc([nH]n1)N,0.2555
C#CC(=O)C1(CC1)C=O,0.1864
C1CC1OCCNC=O,0.2831
C#CC1C2CC1C21CC1,0.2991
C1CC1(C=O)C#CCO,0.2281
OCC(CC#C)OC=N,0.278
CCC1CCC2(CC2)O1,0.3084
CC1OCC=C1CC#N,0.2373
CC(C)OCC#CC#N,0.2313
CC(C)Nc1[nH]ncn1,0.2489
CC1CC2OCCC12C,0.3155
C1C2C3OCOCC1C23,0.3252
CC1OCC1OC=N,0.2716
CN1CC(O)C1=O,0.2678
CN1C2CC1C2(O)CO,0.25
ON=C1CC(O)C2NC12,0.2411
OC12C3C1C1OC3C2O1,0.3233
CC#CC1(CC1)C(=O)C,0.2246
C1CC12C(=O)CNC=N2,0.197
CC(=O)CCOCC#C,0.2349
CC12OCC1C1NC21,0.2985
Cc1cc([nH]c1C)C,0.233
C[NH2+]CC(N)C([O-])=O,0.242
CCC(CC([O-])=O)[NH2+]C,0.2769
c1cc(nc(c1)N)CO,0.199
CCN(CC#N)C(C)C,0.2566
O=C1CCC23CCC12O3,0.2178
CC1C2C3CC1OC23C,0.3184
CN1C2C3NC2(C#C)C13,0.2359
CC12CC=CC1C(=O)O2,0.2461
CC1NC1C=O,0.222
CC1OC(CO)CC1=O,0.2203
CCC1(C)CCC1C,0.3558
COC1CC11CCC1,0.3116
CC1(CC1)n2cnnn2,0.2629
OC12CC3C(N3C1)C2=O,0.2132
COC1COC(C1)C=O,0.2114
CC(C)(C=O)NC(=O)N,0.2207
CN1CCCC(=O)C1=O,0.1815
CC1(C(=O)CCN1C)C,0.1987
CCC1CC2CC2C1O,0.3218
CN=C(C1CC1)OC=O,0.2389
c1ncn(n1)C2CCC2,0.2658
CC1C2CC1(CO)C=C2,0.2415
OCC12C3C4C(N13)C24O,0.2669
CC1C(O)C(CO)N1C,0.2896
CC(C)(COC)C#N,0.3086
N#CC1(COC1)C1CO1,0.2846
N=C1NC=NOC1=O,0.1973
C1CC2=CCCC2=C1,0.1965
CC1COCOCC=C1,0.2511
CC(C)N1CCC1C#N,0.2551
CC12CC1C(=O)C2(C)O,0.2224
O=C(C#N)N1CC2CC12,0.2108
COc1c(cccn1)N,0.1939
CC1=C(COC1=O)N,0.2148
OC12CCC1C2C#N,0.2963
OC1CC2C3CC1N23,0.2964
CCC1(C)C2NC2C1O,0.3125
CC12CC3CC3(O)C1O2,0.3221
CC(OC=O)C(=O)C=O,0.1532
OC(C#N)C1(CO1)C#C,0.2823
OC12CCC11CC2C=C1,0.2177
c1cncc2c1CC=C2,0.1957
C1CN=CNC(=O)OC1,0.2302
c1c(=O)[nH]ncn1,0.1669
CC(O)(C=O)C1(C)CC1,0.2164
CC(=NO)C#CC#N,0.181
NC1=NC(COC1)C#N,0.2508
OC1COC(=NC1)C#C,0.2281
[NH3+]C1C2NC1C2C([O-])=O,0.151
CC1CCC2=CC=CN12,0.244
COC1C2OCCOC12,0.2882
CC12NC3(C#C)C1NC23,0.2461
CC1CC2=CNN=C2O1,0.2331
COC(C)C1C2CCC12,0.3261
CC(C)CN(C=N)C=O,0.2227
OC1C(=O)C2CC12C#C,0.2091
OC1(C=CNC1=N)C#N,0.1923
ON=C1CC2(CC12)C=O,0.2079
N#CC1OC2CNC12,0.2457
CC(C)C(=NO)C1CN1,0.2339
CC1=NC=NC(=N)C=C1,0.1671
CC(C(C)=O)C(C)(C)C,0.226
OCC#CC1C2COC12,0.2601
OC1C[NH2+]C(C1)C([O-])=O,0.2661
CC1CC1C12CC1CC2,0.3217
NC(CO)(CC#N)C#N,0.2801
CC12OC(CC=C1)C2=O,0.2157
CC1OC(OC1=N)C=O,0.2085
CC12NC1CC=C2C#C,0.2038
O=CC12CCC3C(O1)C23,0.1997
CCOC(=O)CNC=O,0.2498
O=CCC1=CC2NC2C1,0.203
OC1CC1(C#N)C1CC1,0.2801
COc1c[nH]nc1C#N,0.212
O=CCCC1OC1C#C,0.2285
CC(CO)C(=O)C(N)=O,0.1758
CC([NH3+])C1=CC([O-])=CO1,0.0789
CC(C)C1CC11CCC1,0.3352
OCCCCC(O)C#C,0.2963
CCC12CCC1(C)O2,0.3243
C1C2CC3COC2C1C3,0.3076
OC1CC11CCC2NC12,0.3036
C#CCNc1ncon1,0.2244
OC1C2NC1C(=C2)C#N,0.1923
CNC(C=O)C#C,0.1943
C#CC#CCN1CCC1,0.2076
NC1=NC2CC(=O)C2O1,0.1956
CNC(=[NH2+])C(C=O)=N[O-],0.1281
CN1C(=O)CC(N)C1=O,0.2278
CC1C2C(C)C1C2C,0.3808
CN1CC11C2C3OC1C23,0.3053
CC(NC=O)C(N)C#N,0.2676
C#CCCC(C#C)C#C,0.2847
CC1C2CN3C2C(O)C13,0.318
CNCc1nc(no1)O,0.2194
C1CC2OCOC12,0.3287
CC1C2CCCC12O,0.3232
COCCC(C)C1CO1,0.3396
CC1OCC(O)CC=C1,0.2649
OC1CC2(CC1O2)C=O,0.2128
CN1CC1C(=O)C1CO1,0.1893
CC1=C2C=CCC2OC1,0.1916
CC#CC1C2CN=CN12,0.2267
N=C1OCCC1C1CC1,0.2819
CC1(CC2CC1C2)C#C,0.3118
CC1CC2CC2C1,0.3401
CC1C2COC(=N)C12O,0.2578
CCC(C)(C=O)N1CC1,0.1886
OC1=NC(F)=NC(=O)O1,0.2223
CC(OCC1CC1)C#N,0.2949
CCC1(CO)CN1C=O,0.2498
O=C1C=C2CCC3C1C23,0.1794
O=CC1OCOC11CC1,0.2162
CC1CN=C2OCC12C,0.262
CC1(CN1C=O)C=O,0.2148
CC1OCC1(O)C1CO1,0.3085
OCCC12CC1CCO2,0.309
CCCC1OCC11CO1,0.3249
CCOC(C)(CC)C=O,0.2132
CC(=NC)N(C)C(=O)C,0.2289
CC12OC1C1CN1C2=O,0.2201
CC#CC1(C)C(C)C1C,0.2833
OC1C2CC2CC1C#C,0.2961
CC1(COCC1O)C#N,0.2929
CC1(O)C2NC(=O)C12O,0.232
CC12CC1C(O)C1CN21,0.2854
CCc1c(nn[nH]1)CO,0.243
CC1(CC1)c2cnoc2,0.2419
C1CC(C1)(C2(CC2)O)O,0.2984
CC(C=O)N(C=N)C=O,0.2152
C1CC2=C(N1)ON=N2,0.1655
c1ccc2c[nH]cc2c1,0.1615
C1C2NC2C2=C1OC=C2,0.2271
CC1(C)OC2CC1C2=O,0.2092
C1C2CC3CC1C(O2)O3,0.3267
O=C1C2COC2C11CC1,0.215
CCC1(C#C)C2CC1C2,0.2983
CC(C)(C(=O)C#N)NC,0.1669
CCn1cnc(c1O)O,0.2184
C(CC#CC=O)CC#N,0.2044
CCOC(C)(C)C(=O)C,0.2293
COC(=O)C(N)C(C)O,0.2554
O1C2C1C1OC3C(O1)C23,0.3167
OC12C3C4CC1C2(O)C34,0.2908
OCC12CC(OC1)C2O,0.3078
c1c[nH]nc1CO,0.2649
CCC1(CC(C)C1)OC,0.3208
C1CC1C#CC(=O)C#N,0.1833
CC(=N)OC(=O)C1CO1,0.2317
OCC1=CC2C3CC2C13,0.225
CC1OC(CO)C(=N)O1,0.2864
COC1C2CCCC1O2,0.3152
CC1(CNC=C1C=O)C,0.1793
CC(CO)(CC#N)C#C,0.2998
CCC1N(C=O)C1(C)C,0.2541
CC12CC3C1C1CC1C23,0.3443
CC(C)(C)C1(C)CO1,0.3364
CC1N2C=NC3C2C13O,0.2099
CC12CC(=O)C1(CO)N2,0.2186
CC1=C(C)C2(O)CC2C1,0.2419
CNc1cocc1NC,0.2309
C#CCC12CCC1OC2,0.2864
CC1C2CC3C2OCC13,0.3268
CC1OCC(O)C11CC1,0.3113
OC1C2OC2CCC1=O,0.2368
COCC1C2C3C1CN23,0.3176
CC12NC3(CO)C1NC23,0.2918
N#CC1CC2C3CC2N13,0.2814
CC12CC1COCO2,0.3128
CC(C#C)C1COC1C,0.2913
CNC(=NC)C(=O)C#N,0.1511
CC(C)C#CCCC#N,0.2857
CC(C)OCC1CC1O,0.3202
C#CCOC1=NCCN1,0.2457
Cc1cc(=O)occ1O,0.1658
CC1(CNC=CC1=O)C,0.1898
O=CNC1=CCC2NC12,0.2078
C#CC1=CCNC1C#N,0.2061
N#CC1COCC=C1,0.2643
CC1C2CC(=O)C12C=O,0.2061
Cc1c(con1)OC=O,0.2444
C#CC(=O)CC#CC#N,0.2048
c1cnoc1N2CCC2,0.219
OC1COC2(CCC2)C1,0.3118
OCC12CCC1C2O,0.316
NC(=O)N1C=NC2CC12,0.2245
C#CCC1C2OCOC12,0.3045
Cn1cnoc(=O)c1=O,0.1987
CC1CC23CC(C12)N3C,0.283
CC12CC(C)(C1)OCO2,0.3247
CC#CC1(CC1)OC,0.2741
[NH3+]C1(CC([O-])=O)COC1,0.2715
CC1CC(C=O)C=C1C,0.2143
COC1(C)CCC1(C)O,0.3164
OC(C#N)C1=NON=N1,0.2386
N=C1CNC(CO1)C#N,0.2513
CC1CC2C=CCC2=C1,0.2483
OC1CNC1(C=O)C#N,0.209
C1CC12CCOCC2,0.3255
CC(O)CC#CC1CO1,0.2744
C1COCC(=O)COC1,0.2052
CC1[NH+]=CNC1C([O-])=O,0.2388
c1cnoc1C=O,0.19
C1CC2OCCN3C1C23,0.2907
CC(O)(C(N)=[NH2+])C([O-])=O,0.2181
COC1CC11OC2CC12,0.2934
N#CC1CC2COC1C2,0.2928
CC1CN1C1=NC=NN1,0.2478
OC1C2CC3C=CC1N23,0.2145
CCC(C)C1(CO)CN1,0.3045
CC(C)(CO)OC=NC,0.2745
CC1C(O)C1CC=O,0.2259
CC1(C)N=C2CC3C1N23,0.1941
CC12CC3C(OCC1)C23,0.3099
Cc1ccnn1C2CC2,0.2489
C1C(=CC(=O)N1)CC=O,0.1946
c1c(c(c[nH]1)O)CCO,0.228
N=COCC(C=O)C#N,0.2089
N=C1OC2C3OC3C2=C1,0.1998
OC1CC(O)C2CC1C2,0.3165
NC(CC(N)C#N)C#N,0.2709
CC1OC2C3COC2C13,0.3065
CC1C2CC(C)C12C,0.3226
COCC(=O)CC(C)O,0.2306
CC1OC2C3CC(O1)C23,0.3353
CC1(NC1C1CO1)C=O,0.2265
CC(O)C1=CC2CC1C2,0.2341
OC1C2CC3(O)C2OC13,0.2977
CC1CC(O1)C(O)C=O,0.2153
c1c2c([nH]c1N)nno2,0.1778
NC(=O)CC1(O)CC1O,0.2529
CC1CC2(COC2=N)N1,0.2491
OC(C=O)(C#C)C1CN1,0.2032
C#Cc1c[nH]cc1C=O,0.1872
C#CC1OC11CC2OC12,0.2701
N#CC1CC23CC(C2)C13,0.2796
OC1C(O)C1NCC#N,0.2419
c1c2cnoc2[nH]c1O,0.2051
CN(C)C(CC=O)C=O,0.1783
N=C1OCC2=C1NN=C2,0.2157
Cc1c(cncn1)C=O,0.1779
COC(C)C(=O)OC,0.2548
CC#CCC(=O)C(C)O,0.2212
CC(=O)NCC#CC#C,0.2201
COC(=O)C1C2CCN12,0.2364
COC1(C)C2CCC12C,0.3211
CCC1C(C=O)C1C#N,0.2223
CC1(C)C2CN1CC2=O,0.2041
O=C(C#N)C12CC1CN2,0.1712
CCC(O)C(OC)C=O,0.213
Cc1nc(co1)N(=O)=O,0.1918
CNc1cc[nH]c(=O)n1,0.2
COC1CN(C=O)C1=N,0.2162
CCOCC1OCC1=O,0.2243
O=CCC12C3C4C1N4C23,0.1922
c1cnnccc1=NO,0.1309
NC1=NC(CO)CC1=O,0.1828
CC1(COC=O)CN1,0.2729
OC1CC2(CN2)CC1O,0.3105
C1C2CCC3CC2C1O3,0.3149
CC1C(OC1C#C)C=O,0.218
Cc1c2c(c[nH]1)[nH]nn2,0.175
CC#CC12CC(O1)C=C2,0.2337
COCC1OC(C)C=C1,0.2492
C1OC1C12CC1N=CO2,0.2602
OC1CC2C3OCC3C12,0.3009
CCC(=O)N(C=N)C=O,0.22
N#CC12CC1COC=N2,0.2484
C1C2COCCOC12,0.3217
CC12CC(C)(C1)N1CC21,0.3184
OCC12CC(C1)OC=N2,0.2576
CC12COC(C#C)C1N2,0.2807
CC12C3C4OC1CC2C34,0.3133
CCC#CC1CC2CC12,0.2937
OC(CC=O)(C#C)C#N,0.2249
CN=C1NC2C(C)OC12,0.2431
CCCC1(CN1)C#N,0.2953
CCC(=O)C(=O)C1CO1,0.1511
O=CC1CCC(C=O)=C1,0.1793
COC1COCCC=C1,0.2429
CC1(CO)COC1C#C,0.2753
OCC1(O)COCC1O,0.2954
Cc1c(c(n[nH]1)C#N)N,0.1967
CC12OC(=N)C3NC1C23,0.2446
C#CCCC(C=O)C=O,0.1976
c1(nc(nc(=O)o1)O)N,0.2291
N#CC12CNC3CN1C23,0.265
C1C(CC(=O)NC1=O)O,0.231
NC1=CC=C2C3CC3N12,0.1983
OC1C2COC(=N)C1N2,0.2578
C1C(CO1)C(=O)C#N,0.1766
C1C(=O)CC1(CC#N)O,0.22
CC12CC3(C)OC3C1O2,0.3178
c1cnn2c1CCC=C2,0.2039
OC1CC=C(C1)C1CN1,0.2395
Cn1c(nc(n1)CO)O,0.2613
N=C1NC=C(CO1)C#N,0.1892
CC1=C(COC1=N)C#N,0.1888
CNc1coc(n1)CO,0.2112
ON=C1CCC(C1)C#C,0.2467
Cc1c(cc([nH]1)N)C#C,0.2047
CC(C)(C#N)C1CN1,0.2826
N#CC12CC1COCC2,0.295
O=CC1OC1C1CC1,0.2164
CC1=C(O)NN=CC1=N,0.1726
CCC12CC(O1)C2C,0.3237
OC1C2CCC1(O)C2O,0.2928
CC1CC(=O)CC11CO1,0.2213
CC12C3C4C3N1CC24,0.3022
OC1C23CCC12COC3,0.294
CCn1cc(c(n1)C)O,0.2308
O=CC1OC2CC3C2C13,0.2163
CN=C1OCC2CC1C2,0.2732
CCC1CC(C1)OC=O,0.2863
CN=C(c1n[nH]nn1)N,0.2001
CC1OC2C1C1OC21C,0.2989
CC1C=CC(C)(C)C1O,0.2632
CC1CC(C)C1(C)CO,0.3325
CCC1C2C3C1CN23,0.3166
O=C1N2CC2C2CCN12,0.2636
CC12COC(CC1=O)C2,0.2233
CN1CC1(CO)CO,0.3018
CC1CN2C1C2C(N)=O,0.248
CNc1cc(=O)cco1,0.1983
O=CCC1CC1NC=O,0.2259
CN1C(CC#N)CC1=O,0.2733
O=C1CCC2CN12,0.2417
N#CC1=C2CN3C(C1)C23,0.1515
CC(O)C1(C)CCC=C1,0.2579
CC1(CC#C)CN1C=O,0.2529
c1c2cncnc2c[nH]1,0.1611
O=CN1CC2OC2C1,0.2712
OC1CCC1C(F)(F)F,0.3388
CCN(CC=O)CC#C,0.1981
CCC(C)C(C)CC=O,0.2292
O=C1C=CC2=CCCC12,0.1632
OC1C2CN=C3NC1C23,0.2129
CN1C2C3OC2C13C,0.2888
CCN(C)CC(=O)C#C,0.1651
Cn1ccc(c1)OC,0.2277
CC#CC(C)CO,0.304
CC1N2C(=N)OCC12C,0.2796
COC1=NNN=CC1=N,0.1731
CCOC1C2CC1C=C2,0.2414
CCC12OC1(C)CC2C,0.3211
CC12C(O)CC11CC2C1,0.2853
O=CNC1=NC2CC1C2,0.2187
CCC1OC2(C)CCC12,0.3151
OCCC12OC1C1OC21,0.2912
c1[nH]nc(n1)N=CN,0.2116
C1CC12CNC(=O)N2,0.2929
c1(c(onn1)N)N,0.2066
OCC12CC(C1)OC2,0.2996
CC12OC1C1CC2(C)O1,0.3093
Cc1c(oc(n1)C)C#C,0.1969
CCC(=O)NC(=N)C,0.2443
OC12C3C1C1OC3C21,0.3083
O=CC1CC23CC(C2)N13,0.1885
CC12CC(CC1=NO)O2,0.2559
c1nc(c(c(n1)F)F)O,0.2324
c1c(oc(c1O)N)CO,0.2049
O=C1OCCN2CC1C2,0.2237
CC(C)C1(C)OCC1O,0.304
CCC12CN3C(C13)C2O,0.3023
CCCC1CC11COC1,0.3113
CC1C2C1C1C3CN1C23,0.3112
Cc1c(c(oc1N)C)N,0.215
OC12C3C4C3C1C(=O)C24,0.2069
CCC(O)CCCCO,0.3326
OC1CC1[NH2+]CC([O-])=O,0.2645
CC#CC(C)C#N,0.2873
N#CC1C2CCN1CC2,0.2692
NC(=O)OC1CC2NC12,0.2928
N#CC1NCC1N1CC1,0.2575
CC#CC1(N)CC1C#N,0.268
CC1CC23OC4C2NC134,0.2614
CC1CC2(COC12)C=O,0.2176
CC12CC3N1C2C31CO1,0.3224
CC1COCC1(N)C#N,0.2792
CCC1OC=NCC1O,0.266
FC1=NC(=N)OC=N1,0.1923
CCC12CC(C)C1CO2,0.3098
CCC1CCC(=O)C1O,0.2101
CC12CC(O)C1CC2=O,0.2203
C1C(CN1C(=O)C#N)O,0.2202
c1c(non1)C=O,0.1881
[NH3+]CC1=C([O-])C(O)=NN1,0.2198
OCC1C2NC(=O)C12O,0.2394
CCC1CC1(C)OC,0.3295
c1c(cnc(n1)F)F,0.2098
CCC12CC(C1)(O2)C=O,0.2082
CCCNc1c[nH]nn1,0.2088
CC12OC1(CO)C1CC21,0.321
CC1CC2(OCC12)C#C,0.2649
c1nc(nc(n1)N)CO,0.2136
CCC(CO)C1CCC1,0.3402
CC(O)C(C)NC(C)=O,0.2754
CN1C2CC1(C2)C#N,0.2459
CC1CC(C1)N1CC1,0.311
COCc1[nH]c(=O)on1,0.2552
CC(=O)OCC(=O)OC,0.2827
CC1OC11CNC1C#N,0.2682
OCC1OCC(O1)C=O,0.2184
C1COCC(=C1)CC=O,0.2083
CC12CC1C(=CC2)C#C,0.2017
C1OC11C2C3CC2C13,0.3565
C[NH+](C)CC#CC([O-])=O,0.187
OCC1=NCC2CC2O1,0.2754
OCC1N2C3CC=C1C23,0.1741
CC1CC2(C1)OC2C#C,0.2751
C#CC1CCC=CCC1,0.2567
OCC12COCC1N2,0.3287
[O-]C(=O)C1CC1NC=[NH2+],0.2336
COCc1c[nH]c(=O)o1,0.2399
c1cnn(c1N)C2CC2,0.2393
OC1C(O)C11CC2NC12,0.277
CCCN1C2C3CC3C12,0.2776
COC1C2OC2C1CO,0.3035
CC1(C)COC1CO,0.3086
CC(=N)Nc1nc[nH]n1,0.2223
CCCC(=O)C(F)(F)F,0.2274
CC1CN2CC2C2OC12,0.2976
OCCC#CC1CN1,0.2682
CCCC12CC=CC1O2,0.2461
C#CC1CC(CC#N)O1,0.277
CCC1C2C(O)C1N2C,0.2822
CC1CCC11CCC1,0.3509
c1nc(c(n1C=O)O)N,0.1726
CC(C)n1cnc(n1)N,0.2308
CC1(CCC1)OC=O,0.2776
CC12CC3(CCC3)C1O2,0.3272
CC1OC1COC(C)=O,0.2828
OCC1OC1C#CC#C,0.2143
CN1C2C3C1C2C3=NO,0.2512
Cn1cccn1,0.2625
CCCC1C(C)C1CC,0.3335
CC1C2OC2C=C1C#C,0.1969
O=C1CC2=C(N1)ON=N2,0.1692
O=C1C2C3C2C2(CN2)C13,0.237
CC1(NC=CC1=O)C=O,0.1821
CC(O)C1=NOC=C1C,0.2467
NC1=NC2CC2(O)C1=O,0.1669
CC1(O)COC1=O,0.2634
COC1(CC1)CCCO,0.3249
OC1CC1(O)CC#C,0.2795
CC(C)N(C=O)C=O,0.214
CCC(C)C1(O)CC1O,0.3171
CC1=C(COC1)C1CO1,0.233
COCC1CC(C)CO1,0.3267
CC1OC1C1(CO)CN1,0.3108
CC1OC(C)(C=O)C1O,0.2038
CN1C2C3OC3(C)C12C,0.2939
c1cc-2cccoc2c1,0.131
C1C2NC2C2=NNN=C12,0.2397
CCCC1(C)CCO1,0.319
OC1C2NCC12C#N,0.2643
C#CCN(C=O)C1CC1,0.2541
O=C1OCC2CCN12,0.2904
OC1COC(=N)C1C#C,0.2723
OC12CC(C1)C21COC1,0.3116
N#CCOC1C2CCC12,0.2708
NC(=O)OC1C2CCC12,0.3126
c1coc2c1[nH]c(c2)O,0.1998
CCOC1(CC1C)C#C,0.2785
N#CC1CNCCN1,0.2416
Cc1c(c([nH]c1O)O)C,0.2223
OC12CC1C=CC2C#N,0.2441
Cc1cc([nH]c1)N(C)C,0.2295
CCOCC12CN(C1)C2,0.3065
OC1C(=N)OCC1=O,0.2114
O=C1CCC2CC3C2C13,0.2187
O=CC1(C#C)C2COC12,0.2066
COC1CN=C(CO)O1,0.2819
c1c(c(c[nH]1)N)CO,0.237
CC1CC2(C)C3OC3C12,0.3218
CC1C=CCCC2CC12,0.2638
COCCCC#CC#C,0.2315
NC1(C#N)C2OCOC12,0.2619
CC1(C)C2CC3OC2C13,0.3171
CC12C3C(CN13)C21CO1,0.3271
OC1C2OCC2C1C=O,0.2181
COC12CCC1(C)C2C,0.3159
Cc1c2c(no1)CCO2,0.2114
CCCC1CC(O)C1C,0.3244
CC1(C)CC(O)C2OC12,0.3272
CCC(=O)C(C)C(C)C,0.2304
C(CO)N=CNC=O,0.2278
CCCC1(CO1)C#CC,0.2788
C1CC1C1=CCC2NC12,0.2415
CCOC1C2OC2C1O,0.3133
c1noc(=O)c(=O)o1,0.2044
O=CC1CC(=O)N1C=O,0.2065
CC12CC(C)(O1)C21CC1,0.312
C#Cc1c(cc[nH]1)C#N,0.187
CC(C)(C#C)C#CC#C,0.2283
OC12C3CC(OC1=O)C23,0.2572
CC1CC11C2CC2C1C,0.3257
CC1=NC2(CC2)CO1,0.2521
NC=NC1=NOC(=N)O1,0.1908
CN(C1COC1)C(=O)N,0.2814
COC1CCCC1O,0.3103
CC1C(=O)C2NC12C,0.2157
OC1(CC1)C1CCOC1,0.2933
CC12CC3C1N2CC3=O,0.217
CC1CC2OC(C)=NC12,0.2619
c1cn2c(n1)CCC=C2,0.1991
CC(=O)c1ncno1,0.1898
CC(=NC(C)(C)C)OC,0.2646
CCC1OC2CC12C#N,0.2715
CC1C(O)C2CCCC12,0.3005
Cc1cc(=O)oc(n1)C,0.1969
CC1NC1(C)C(=O)C=O,0.159
COC1CCC(C1)OC,0.3194
CC1COCCC1=O,0.2245
O=CC12CC(C1)OC=N2,0.2124
CC1(C)CCOCC1O,0.3177
CC12CC1C(CO2)C=O,0.2159
COC1(CNC1)C#N,0.2569
C1C=Cc2c1onc2O,0.2011
CCC(CC=O)OC=O,0.2234
N=CN1C=CCOC1=O,0.2252
CC12CCC1(O)C(=O)C2,0.2184
CC(O)C1=COC(N)=C1,0.2229
CNc1c(nno1)N,0.1999
N#CC1COC2CC1C2,0.2855
CC1CC2OC1C=C2,0.2552
C1C2(CO1)CO2,0.3209
Cc1c(cc(cn1)N)N,0.1919
OC12C3NC1CCOC23,0.2723
C1C(N1)(C#N)C#N,0.269
CC(C)C(O)CC#C,0.3051
C1CCOCC=CC1,0.2467
CC12CC3CC4C1C2C34,0.3263
CN=C1NC2C(N)C2O1,0.2626
CC12CCC3CC1C23C,0.3234
CC#CC1NCC1C#N,0.2636
OC1CN2C1CNC2=O,0.2769
CC1C2CC(C)(C)CC12,0.3282
C1OC23C4CC2(C4)OC13,0.2677
OC1CC2CC2(O)C1,0.306
CCC1CC11OCC1O,0.2872
COC(C#N)C1CN1C,0.2473
C(C=O)c1noc(=O)o1,0.2291
CCC1=CC(=O)C(C)C1,0.1922
CC#CC1(OC1C)C=O,0.2133
CC1C(C)N1CCCO,0.289
COC1(C)CC(C1)C#N,0.291
CCCC(C)(C)O,0.3252
N#CC12CC3CC1NC23,0.2747
CC1(CCO)OC2CC12,0.3159
c1c[nH]c2c1nc(o2)N,0.2211
CCC(O)(C=O)C#C,0.2146
Cn1cnc(c1C=O)O,0.173
COc1nc(on1)N,0.2541
OCC1NC(=O)C11CO1,0.2525
COC1CCC2(C)NC12,0.3036
CC12COC(CO1)C2=O,0.198
O1C2C1C1C=CC2C=C1,0.227
CC1C(C)C2(O)CC12C,0.3108
C#CCC1CC(=O)C1,0.2218
OC1C2CCC1(N2)C=O,0.2134
N#CC12CC3C1NC23,0.2666
CC1=NCC(C)(O1)C#N,0.2697
CC(OC1CCC1)C=O,0.2249
OC1CC2CCC1O2,0.3206
OC12CC1CCOC2=O,0.2496
CC1CCOC1(C)C#C,0.2882
CC#CCc1cnco1,0.2426
COCCCC(O)C#C,0.2844
O=CC1(CC2OC12)C=O,0.2031
COC1C2CC1N=CO2,0.2521
ON=C1CCOC1C#C,0.2458
CCC1C2COC1OC2,0.3301
O=CC1CCC(=O)C1,0.2165
CC(=O)N(CC=O)C=O,0.2115
N=COCC1CC2CC12,0.2818
CN=C1OC23CC(C2)C13,0.2656
CC1(C)CC1C#N,0.313
OC1CCC1C1COC1,0.3002
ON=C1CC(C1)NC=O,0.2478
CC12C3C=CC11CN2C31,0.2185
CC1N2CC(O)C2C1=O,0.1972
CCCNC(=O)OC,0.3115
c1c(noc1NC=N)N,0.2075
CCC1(CC1(C)C)C#C,0.29
CC1CCC(CCO)=C1,0.2568
C(CN(C=N)C=O)C#N,0.2293
OC1C2C3OC4C1C2C34,0.287
CC1=CCC(=N)OC1,0.2589
CN1C=CC(OC=N)=N1,0.2331
N#CCNCC1CO1,0.2729
c1c(con1)C(=O)C#N,0.1987
Cc1c(ncnc1O)C,0.2254
CC1CC1N1C=CC=N1,0.2591
CCCC1CC2C(O)C12,0.3205
CC(O)C1N(C)CC1=O,0.2
c1cnc(c(=O)[nH]1)F,0.1775
C1C(CO1)(CC(=O)N)O,0.2531
CC1CN=C2OCC2O1,0.2599
CC(=NO)C1COCO1,0.2566
CC1C2CC(C)C=CC12,0.2479
Cc1c(cn(n1)C)C#N,0.2358
NC(CC#C)C#N,0.2865
c1cc(cc(c1)O)O,0.2176
CC1(C)CC2CC(=O)C12,0.2157
OC12C(C#N)C1N1CC21,0.2559
CC12CC(=O)C1C2C#C,0.228
CCC1(CO)OCC1=O,0.2221
c1c(c(nc(n1)F)N)F,0.209
N=C1OCC11OC1C#C,0.2554
[NH3+]CC1=NC(=N)N=N[N-]1,0.1688
C#CCC1CC2CC12,0.3075
CC12CN3C1C(O)C23C,0.2906
OCC1C(O)C11COC1,0.2915
N=C1CN2CC(C2)O1,0.2486
CC1C(C)C2C1OC2=O,0.2777
OC12C3CC1OC23C#C,0.2388
N=C1OCC2(CC2)CO1,0.2979
CC12CCC(=O)CC1N2,0.2159
CC1CC(=O)C1(O)CO,0.1982
CCC(C)(C)C(C)OC,0.3245
OC1CC=C(C1)NC=O,0.2132
CCCC1OCCC1C,0.3219
CC12C3CC1(C)C=CC23,0.2384
O=CCC#CC1CN1,0.2072
C1CC2OCC3C1C23,0.3181
CC12NC1C(=O)C21CO1,0.2037
NC(=O)C1OC1C#C,0.2471
CC1CCC11CC1(C)C,0.3257
CC1C2C3C1CN23,0.3195
CNc1c(nc(o1)O)O,0.2317
COCC1CN1CC#C,0.2789
NC(=O)OC(CO)C#C,0.289
CCC1CCN(C)C1=O,0.2681
C(=O)C(C=O)(C(=N)N)O,0.1996
OCCC(CO)C#N,0.3031
CC(O)CC1CC(=O)C1,0.2226
OC1=NC(=N)N=NO1,0.2428
CC(C)NC(CN)C#N,0.2636
CC1C2OCC(C)(O)C12,0.2936
CC1OCOCCC1=O,0.2183
COCC(=O)COC=O,0.2296
C1CC2(CC2)C(=O)C=C1,0.1907
CC1NC1C#C,0.2832
CC(CO)C(C#C)C#C,0.2939
CC12OCC(CO1)C=C2,0.2449
CC(=N)NC(=O)N,0.2548
CC1NC1C(O)CC#C,0.2957
N=C1OCCCC2CC12,0.2671
CC(C)OC(C#N)C#N,0.2739
OC1C2OC(OC12)C#N,0.257
C[NH2+]C(C)C(C=O)=N[O-],0.1582
OC1(CC1OC=N)C#C,0.2645
CC#CC(C)C(=O)C#C,0.1871
CC#CC1CN1,0.2698
C1C(=O)CN1CCCO,0.2073
CC1C2OC2C2CN12,0.2944
CC1(COCO1)C,0.3328
CCC(=O)C(C)(C)C,0.2295
COC1C(C)C2CC12C,0.3206
CC1CCN2C1CC2=O,0.2537
CC12C(O)C1C1NC21,0.2789
CNC1=NNC(=N)C=N1,0.1257
CC1CCC=C1NC=O,0.2121
CC(=NO)C1CC(=O)O1,0.2531
CN1C2C3NC3C12,0.263
COCC1CCC1CO,0.3264
CCC(O)C1=NNC=C1,0.2576
C1CC23COC4C(C24)C13,0.315
COC1CC1C(C)O,0.3246
CCOC(C)(CC)C#N,0.3019
C1C2C=CC3OCC3N12,0.2205
CCC(C)(C)N=COC,0.2702
c1[nH]c(c(c(=O)n1)N)O,0.2076
C1OCC1C1CN=CO1,0.2681
CC1(C)C2CN2C1C#C,0.2617
N#CC12CNCCC1N2,0.262
CC1OC1C(O)CC#N,0.3056
CCC(CC)C(C)OC,0.3275
CC1CC2(CC1C2)C#N,0.3299
CCCC1=CC2CC2C1,0.2433
CC12CC3C(O)C3C1N2,0.2805
COC1C2C3C1C2N3C,0.2982
C1Cc2c([nH]nn2)OC1,0.234
CCCOC(=O)CC#C,0.2781
C1COC(=O)C(=C1)CO,0.2224
CC1C(CC1=O)C=O,0.222
C1C2N1CC21CC2OC12,0.3125
OCC12CC3C(C=C1)N23,0.2202
CC1OC1C1(C)NC1C,0.3182
OCC1NC1C#CC#C,0.2162
CN1C2C(O)C1(C)C2O,0.2802
C#CC12C3C4C3C1C24,0.2478
CC1(COC=NC1)C#C,0.2691
CC12CCOC3CC1C23,0.3276
OCC(=O)C1CNC1=O,0.2311
CC1=CCC2(OC12)C=O,0.2122
CCC1C(CO)C1CO,0.3035
C1=C2C3C4C1C1C4N3C21,0.145
CC#CCC1CN1C,0.2804
OC1CC2OC2C1,0.3229
CCC(O)C(C#C)C#N,0.2863
CCC1C(N1C)C(C)=O,0.2172
CCC1C2CC1CCC2,0.351
CCC12C3CC3C1N2C,0.2748
CC(C)(CC#C)C#N,0.3005
CC12C3C4C5C3N1C5C24,0.26
CC(C)(C)c1ccoc1,0.2425
ON=C1C2CC2C11CO1,0.2371
CC1CNC(=O)OC1=N,0.2673
CC12OC1CCC=C2,0.2477
CC12C3CC4C3C1(C)N24,0.3091
CCC1CCN1C(C)=O,0.2642
COC1C2CC(=O)CC12,0.2282
OC1C=CC=CNC1=O,0.1861
OCC12CC1CC2O,0.3145
CCN1CC2OC(=O)C12,0.2316
Cc1c(cco1)C2CC2,0.2283
O=C1OC2C3CC3C12,0.2625
CC1COC(C)(O1)C#N,0.3087
C1COC(=O)C(=O)OC1,0.226
CCOCC(O)C1CN1,0.3131
CC(C)C(O)C1(O)CC1,0.3131
CCN1C=C(C)OC1=N,0.2178
CC1(CC1)OC2CCC2,0.3258
OC1(CC2OCC12)C#C,0.2651
CC12CCC(O1)C21CC1,0.3249
CC1CCCC2OC2C1,0.3338
OC1COC11C2CC1O2,0.2837
c1c(oc(=O)[nH]1)C2CC2,0.2307
c1c(non1)OC=O,0.239
C#Cc1cc(c([nH]1)N)O,0.1815
N#CC1C2CC3(CC3)N12,0.265
CN=C1OC2C3NC1C23,0.2445
C(=O)c1c([nH]nc1N)N,0.1787
CC1OC(=N)CC2OC12,0.2815
CC1CC2=C(N)N=NN12,0.2202
COCC(O)C#N,0.2851
CC(C#N)C1NC1C=O,0.2215
CC1OCC11CN2CC12,0.3045
CC(CCNC=O)C#C,0.281
COC1CC(C)C(=O)C1,0.2201
CC(C)n1cncn1,0.2716
O=CC1(CC2NC12)C#C,0.2109
C#CCN1CCOC1=O,0.2839
c1cncc2c1OCC2,0.2251
C1OC2CC1CN=CO2,0.2673
NC12CNC1(C#N)C2O,0.2226
N#CC1CCC2CN1C2,0.2538
NC1=NNC(=N)C=C1O,0.1535
CC1(C)COC1C=O,0.2138
CC12OC3COCC1C23,0.3024
N#CC12CCC3C(N1)C23,0.2602
N=CN1C(=N)NCC1=O,0.2203
C1CC2(CC2)NC1=O,0.2675
CC1=NC(=N)OC=C1,0.1725
C1COC12CC(=O)C2,0.2131
Cc1c[nH]nc1CC#N,0.2553
OC(C#N)C1NCC1=O,0.2225
CCCC1=CC(O)CC1,0.2565
OC1CC(O)(C1)C1CN1,0.2927
CCC(O)C(O)C1CC1,0.3092
CC1C2NC2C11CC1O,0.3008
OC1C2CCNC12C#N,0.2585
CC1C2C3OC1C23C=O,0.2157
CC12CCN1C2C#C,0.259
CC(C)(CCO)C(=O)N,0.2744
CN=c1[nH]c(=O)cco1,0.1982
CC(=O)C(O)CN1CC1,0.2262
CC1=CC(=N)NC(=O)N1,0.2021
CC(C=O)C1=NNC=N1,0.2191
OC12CCC(OC1)C2=O,0.206
CC1=C(F)C=COC1=N,0.1728
CC(C)N1N=NOC1=N,0.2029
OC1=NNC(=N)C=N1,0.1346
NC1=C2C(O)CN2N=C1,0.2178
CC12COC1COC=N2,0.2699
CC12OC1(C)C1CC2C1,0.3291
CC1(C(C1(C)C)OC)C,0.308
OC12CC1C1OC2C=C1,0.2393
OC12C=CC3OC1C23O,0.2168
CC1(CC2CC1O2)C#C,0.2926
OCC1C=CC2CCC12,0.2537
CC(=[NH2+])N1CC1C([O-])=O,0.2636
C1OCC2=C1ON=N2,0.1704
CCCC(C)CO,0.3411
C1C2N=C3OC4C2N1C34,0.1466
COCCCC(O)C=O,0.216
OCC1CC(C1)OC=O,0.2863
CCC1(O)C2CN2C1C,0.2894
CCC#CC(C)OC=N,0.2791
O=CN1CC2C3CC3C12,0.2666
C1CC2OC(CO1)C=C2,0.2491
CNC(=O)CC(N)C#N,0.2566
OC12CC1NC(C2)C#N,0.2527
N#CC1NC2C3NC3C12,0.2565
CC1OC11CNCC1=O,0.1835
Cc1ncc(=O)[nH]n1,0.1663
ON=C1CCC1C=O,0.2147
O=C1C=CC2CN3C2C13,0.1807
CCCc1cc([nH]n1)N,0.2442
CC(=O)OCC1(C)CO1,0.2845
CC1C(CO)CNC1=O,0.2735
C1C2N3CC22C=CCC132,0.2217
N=C1ON=NC=NC1=N,0.1617
Cc1nc(nc(n1)C)C,0.2228
OC1(CCC=C1)C#C,0.2553
O=C1CC(CO1)C#N,0.277
CC#CC=O,0.2051
C1C=C(COCO1)CO,0.2534
OCC1OC2C1NC2=N,0.2505
CCC(C#N)C(O)C=O,0.2329
CC1CC(O1)C(C)(C)C,0.3165
CCC12CCC(CO1)C2,0.3136
O=C1C2CC3CCN1C23,0.2472
O=C1CC2C(N1)C2C#C,0.256
O=C1C2CCC1CCC2,0.221
C#CCN=c1ocno1,0.234
N=C1NCC11CN=CO1,0.2568
OC1CCNC(=O)C1,0.2677
OC1CC2CC1O2,0.3268
OCC1C2CC2(O)C1=O,0.222
CC12C3C1C(=O)C3C2O,0.2384
O=C(C#N)C1CC=CC1,0.1741
CC(C1CCC1)C(N)=O,0.2749
c1c(=O)ncncn1,0.1592
CCc1cc(=O)cco1,0.1985
c1cc(=O)onc1F,0.1782
C#CC1CC(O1)C#C,0.2584
c1c([nH]c(n1)CC#N)O,0.2301
O=C1C2CN2CC2CN12,0.2298
COC(C#C)C(N)=O,0.2483
OC1CC(C#N)C2OC12,0.305
CCOC1C2C3OC2C13,0.3109
CC1CC(C=O)C(=O)N1,0.2208
CC1CC1OC1(C)CC1,0.3151
CC12CC1C=CNC2=O,0.2108
CC12OC3CC3C1C2O,0.3092
CN1C(C#C)C(O)C1=N,0.2492
CC1=CC(=N)OC(O)=N1,0.1881
C1NC1C1OC1C1CN1,0.318
CCC(CC=O)N1CC1,0.2193
CCCC1(CC1)C(=O)N,0.2748
C#CCNC(=O)C(=O)N,0.2104
O=C1OC2CC3CC12C3,0.2713
O=CC12CC3CCN1C23,0.2182
CCCC(C)C(=O)CO,0.2379
CC1CC1(C)C1(C)CO1,0.3362
CCC1(CC1)C(O)C#C,0.2989
CC(O)C1CC(C1)=NO,0.2488
CCOC1C2CCC12C,0.3222
CC(C)C(=O)C(O)C#C,0.2234
CCC1C2OCCOC12,0.3006
OC12CC1C1OCC1=C2,0.2291
OC12CCOC1C1NC21,0.2861
CCC1OC(C)C=C1C,0.249
C1CC23C4CC12C1C4N31,0.28
CCC(CC(C)O)OC,0.3113
CC1C2CC1(C)C2(C)C,0.3578
CC(=O)C(=O)OC1CC1,0.1817
O=C1CC(O1)C#CC#N,0.2248
c1c([nH]cn1)NCC=O,0.1817
CC1=CCNC(=O)C1,0.2559
CC1=NC(=N)NN=N1,0.1642
CC(CO)(C#N)C1CC1,0.3041
OC1CC(C=C1)C#C,0.2522
C1C=CCOC(=O)CN1,0.2235
O=C1NCC2CC(C2)O1,0.3049
CCC1NC(=O)NC1C,0.3038
CC12C3C4CC1C4C23C,0.3199
CC1C(=O)OC11COC1,0.2668
O=CC(CC#N)C#N,0.2293
CNc1c(cc[nH]1)C#N,0.2084
CC(O)C(C)OCCO,0.323
CC1C2CC(C)C12,0.3328
CC1(O)CNC(C1)C#N,0.2731
CC1=CCC(C#C)C1O,0.2592
OC1CCC1COC=O,0.2834
CC1OC(=N)C(C)C1C,0.2831
OC12C3C1N1CC3CC21,0.2973
CC12COC(C1)OC=N2,0.2691
C1C2CCOCCC1O2,0.3091
OCC12C3C4C3C1OC24,0.3169
CCC[NH2+]CCC([O-])=O,0.2767
CN1C2C3CC1(C=O)C23,0.1852
O=C1C=CC2C3CC1C23,0.1799
C1C2OC1C1C3CN1C23,0.2743
CC1=CC(=O)C2C(O)C12,0.1842
CCC(O)COC(N)=O,0.3223
O=C1C2OC2C2CC1O2,0.1999
CCC1CC2(O)CC2O1,0.3102
CC(C1OC1C)C(N)=O,0.2707
O=CC(C#C)C1CCO1,0.2154
C1CC2(CCC=C2)C=C1,0.2489
COC1=CC(=O)NN=N1,0.1725
CC(O)C1=COC(=O)N1,0.2314
OCC1C2(O)CCC12O,0.2899
C1C2CC1C1=CNC=C21,0.2561
C(COC=O)NCC#N,0.2579
CC1=C(C)C2CC(C2)C1,0.2446
C#CC1=CC2CC3C2C13,0.1949
O=C1C2CCC1C21CO1,0.218
CC(=O)C1C2NC2C1=O,0.2103
CC1=CC2(C)C3CC1C23,0.2345
C#CC1C2C3OCC1C23,0.2703
N=CN1CC(=O)NC1=O,0.2378
CC1C2C(=O)OC12C=O,0.2191
c1nc(on1)N2CC2,0.2392
COC1(CCC1O)C=O,0.2059
Cc1c(nc(cn1)F)O,0.1964
OC1CCC11CCOC1,0.3139
OC1C2CC(=O)C1C=C2,0.2051
COC(=O)C(C)OC=N,0.2552
CCCC1(O)CC(O)C1,0.3222
CC1(CN1)C1CO1,0.3237
COC(C#C)C1CO1,0.2938
CCC#CCC(C)CC,0.2963
CC1OC2CC(C=O)C12,0.2167
Cc1c(nn[nH]1)CO,0.2437
N#CC1OC1C1CCO1,0.2629
CC1=C(N)OC=NC1=N,0.186
C1C(OCO1)(C=O)C=O,0.2072
OC1C(O)C1(O)C#C,0.251
CC12C3CC3C1C2C=O,0.1923
CC1([NH2+]CC1N)C([O-])=O,0.2603
COC(=O)NC(=N)CO,0.259
CCC1OCC=CC1C,0.2659
CC1NCC(O)CC1=O,0.2158
CC12CNC1COC=N2,0.2408
CC1OC(C)C2OCC12,0.3219
C(C1CO1)C1=NCCO1,0.2715
OC1CC2OCC(=O)C12,0.2093
CC1C=CC2OCC12O,0.253
CC1(CNC(=O)O1)C=O,0.2213
CC1COC(=N1)N1CC1,0.2689
CC12NC3C1NC23C=O,0.186
CC(CO)C(=NO)C#C,0.2081
CC12C3CC1OC2=NC3,0.2146
OC1C2C3CC(C23)C1=O,0.2133
c1nc(nc(n1)F)O,0.2396
c1c[nH]cc1CC(=O)N,0.2449
c1c(onn1)N2CC2,0.2133
O=CC1C2OCC=CC12,0.2164
CC(C)(C)N1CC1C#N,0.2613
CCC1(NC1C#C)C#C,0.2544
c1c(coc(=O)c1N)O,0.1584
C1C2C=CC3OCC2C13,0.2429
CC1OC(C)(C=O)C1C,0.2096
OC1=NNC(=C1)C1CN1,0.2352
C(C(=O)NC=O)O,0.2225
CC12CC(CC1=O)C=C2,0.204
CC(=N[O-])C#CC(N)=[NH2+],0.1095
CC(OC(=O)C#C)C#N,0.2378
OC(CC#C)(C=O)C#C,0.214
CCC1OC(=N)C1C=O,0.2238
ON=C1CC2C3NC3C12,0.2412
C1C=CC23CC=CC12N3,0.2253
O=C1CC2OCC2C1=O,0.1408
CC1CC2C1C(O)C2=O,0.2208
O=CC1CCC(=O)CO1,0.204
CCC1(CC2CC12)C#C,0.3028
O=C1CC2CCCOC12,0.2054
O=C1NCCCC1C#N,0.2667
CC1CC2CC1C(=O)O2,0.2742
CC#CC(=O)N1CCC1,0.2217
CC1N2CC11OCCC21,0.2967
OC1C2C3CC2(N3)C1=O,0.2002
O=CN1C2CC1C2,0.2501
CC1(CO1)C(O)C#N,0.2869
CC12CC1C(CO)C=C2,0.247
CC12C3C(N=CN13)C2O,0.2289
Cc1coc(=O)nc1N,0.1994
NC1C(CC#N)OC1=N,0.269
O=C1C2COC(C2)C1=O,0.1417
CC12CC3C(C1)N3C2,0.3107
CCC(C)C(=O)CC,0.2304
CC(=O)N1CC1(C)C#C,0.2531
C1NC1C1C2C3CC2N13,0.2969
CCCOC(=O)CO,0.2869
C1C2OC3C4OC3C2C14,0.3151
OCC1CC(=N)NC1=O,0.2455
CCC1NCC(=O)C1O,0.2001
CC(=O)Cc1cnon1,0.228
CC1C2C(N2C)C11CC1,0.3066
CC[NH2+]C(C)(C)C([O-])=O,0.2672
CC1N=CNC1C#N,0.2449
O=CC1C2OC2C11CC1,0.215
CC1CN1C1=NCCO1,0.2664
CC1=C(N)C(=N)C=NO1,0.1562
CC1(CO)COCC=C1,0.2663
CC1=CC2NC2(C1)C=O,0.2048
CC1COC2CC12,0.3139
O=C1CC2OCC12C#C,0.2096
CN=C(N)n1nnnn1,0.1983
C1CC11CC2OCOC12,0.323
CC1C2CC(CC12)=NO,0.2484
CC1=C2CCC2COC1,0.2501
c1c(c(on1)CN)C#N,0.2195
CCCNC(=O)CC#C,0.2757
C1OC2CC=CC22NC12,0.2303
N#CCC1CC1C1CC1,0.3018
OCCC1COCC1O,0.3092
CC(=O)C12CCC1C2O,0.2245
NC(=O)C1CC(N1)C#N,0.2547
C1C2OC2C2=C1C=CN2,0.2273
CC(C)(C#N)N,0.3024
OC1C(O)C11CCCO1,0.2638
CC1C(CC=O)C1C=O,0.2163
CC(=O)NC(=O)C1CC1,0.221
O=CC1NCCOC1=O,0.213
O=CCC1CC2CN2C1,0.206
O=C1NC2CC(C2)O1,0.2994
CC1=NNC=C1OC=N,0.2461
C1C2C3C4C(C5C3N25)N14,0.2893
C1OC2C=CCCC=C12,0.2432
CC1C(C)C23CC(C2)C13,0.3046
OCCC(O)(CO)C#C,0.2808
c1c(c(=O)nco1)CO,0.2101
Cn1cnc2c1OCO2,0.2062
OCCC1OC2CC2O1,0.3266
CCCc1nc(no1)C,0.2611
CC(CN)(CC#N)C#N,0.2772
CC(O)CC1(CO)CN1,0.296
OC1C(C#C)C1N1CC1,0.275
CC12CC1C1CCC2C1,0.3314
CC#CC1(O)CC(C)C1,0.2805
c1noc(=O)n1CC#N,0.2486
CC1(CC1)CC2CC2,0.3473
C1CC1C1C2COCC12,0.3259
CCC12C3C4CC(C14)N23,0.3026
CN=C1NCC11CCO1,0.241
COC12CC(C)(C1)C2,0.3378
COC1C2CCC1OC2,0.3116
CCC1C2OC=NC12,0.2554
c1c(nc[nH]1)C(=O)N,0.2357
OCC(O)(C#C)C1CO1,0.2973
CCC12COCC1C2O,0.31
CC1NC1(CC=O)C#N,0.2206
CCOCC1C2CCC12,0.3325
COC1CC1C1CCO1,0.3219
c1c[nH]cc1C(=O)CO,0.2035
C1C(CN1CCO)C#N,0.2603
OCC1CCC11CCC1,0.336
CCC1C(O)COC1C,0.314
OC12COC1C21COC1,0.2878
C1CC1(C(F)(F)F)O,0.3521
CCC1C2CC(=O)C1O2,0.2114
CCC(OC)C#N,0.3045
C1c2c(oc(=O)o2)CO1,0.2547
C1COCC1=C2COC2,0.2378
C1C2CC=CC3OCC123,0.2548
CC12OC1CC21CC1O,0.3068
CC12CC1(OCC2)C#C,0.2601
Cc1c[nH]c2c1CCN2,0.2264
COCC12CC(=O)C1O2,0.2169
OC12CC1OC(=N)CC2,0.2792
CC1COC(O1)C#C,0.2935
CCOCCCNC=O,0.2838
N=C1OC=C(O1)C1CN1,0.2253
CC1C(=N)OCOC1=O,0.2676
Cc1c(nc2n1CC2)O,0.2191
CC1CC=C(C1)C1CC1,0.2459
N=CN1CC2(CO2)C1=O,0.2168
CC1CC1C#N,0.3174
CC(OCC#N)C1CC1,0.2926
NC12CC3C1N3C2C#N,0.2496
CC#CC(C)CCC=O,0.2231
C#CCC1=NC2CC2O1,0.2553
COc1ncnc(=O)o1,0.2126
CCC(C#C)C1CC1O,0.3042
COC=NC1(CC1)C#N,0.2518
CCc1[nH]c(cn1)O,0.2389
C1C=CC(=O)CN=CO1,0.2027
NC1=NOC(=N)C(F)=N1,0.1553
NC1C=CC2OC12C#N,0.2228
CC1C=CC(=O)C1(C)C,0.1898
CCC1C(CO)CC1=O,0.2197
OC1CC2CC1C1NC21,0.3014
N=COCC1CO1,0.2829
OC1CC11C=CCC1O,0.2485
CC(C#C)C1(CO)CO1,0.3045
CC1CNCC(=N)O1,0.25
CC12CC(O1)C=CC2O,0.2384
CCC1C(N1C)C(N)=O,0.2584
CC1=CC2CC(C1)O2,0.2389
CC#CC(=O)N1CC1,0.217
OCC1(O)C2C3CC1C23,0.2978
CC(C)N(C=N)C(=O)C,0.2336
CC1C2N1C(C)C21CC1,0.3078
CCC(C=O)N1CC1,0.2212
OC1C2C3C=CC1CN23,0.2342
OC12CC1(CC=O)OC2,0.2122
NC(CC#N)C#CCO,0.2675
c1c(c(=O)[nH]nc1N)N,0.1712
O=C1COC11C2COC12,0.1973
OC1CC(COC=O)C1,0.2778
CC(CO)C12CC1CO2,0.3076
CC(OCC1CO1)C=O,0.2217
COC1CNCC(=O)C1,0.2
CC1COCCC11CO1,0.3296
ON=C1C=CCOC1=N,0.1819
C(C#N)c1c(nno1)N,0.1874
OC12CC3C1N3CC2,0.3032
CC(O)CC#N,0.3214
NC(=N)C1(CCO1)C#N,0.2504
CC1CC(=N)OC1C,0.2867
O=CC1NC11CN2CC12,0.2078
O=C1C=CC2CC1CO2,0.1853
O=COC1COCCO1,0.2559
CC1C2OC2CC11CC1,0.3377
C#CC1=C(CCC1)C#C,0.1738
CC(C)CC(C)C#N,0.348
N#CC12CC3C1COC23,0.2776
CCOCc1nnon1,0.2016
CC(CCC=O)C1CO1,0.2287
C#CC(=O)C1=CNCC1,0.1546
C[NH+](C)C1(CC1)C([O-])=O,0.2569
O=CC1CC=CC1,0.2278
CC(CC#N)(C#C)C#N,0.2918
CCC(C=O)C(C)(C)C,0.2235
CC12CN3CC(CC13)O2,0.2966
CN1C2C3C1C2C31CC1,0.3017
O=C1CC2(OC12)C1CC1,0.2149
CC(O)CC1(CO1)C#N,0.2876
CCOCC1CC1C#C,0.2924
CN1C2C3(O)CC2(O)C13,0.2782
O=C1C2CN2C11CC1,0.2221
C1C2OC1C1CCCC21,0.3201
CCCOC=NC,0.273
OC1C2C1C1(O)CN2C1,0.2856
CC(C)OC(C)CC=O,0.2218
CC(=O)C#CC#CC#C,0.1585
CN=c1oc(no1)C#N,0.1806
COc1cccoc1=O,0.1739
CC1=CC2NC2C(=O)N1,0.207
CCC1C2CC(C)(C)C12,0.3299
CCC1(CC)OCC1O,0.3025
CC1CC2C3CC2C3O1,0.3289
CC(=NCC1CC1)OC,0.2734
CC1COC(C=C1)C#C,0.2607
CCC1(CO)CC(O)C1,0.322
O=C1NC=NC2CC2N1,0.2383
CC1=CCNC(=O)N1C,0.2182
OCC1=NNC=CC1=N,0.1858
CCC(NC=O)C#N,0.2755
CC12CC3C1C2OC3=N,0.2694
CC#CC1NC(=N)C1O,0.2574
N=COC1CC1C#N,0.2771
O=C1CC2CC3CN2C13,0.2149
FC(F)(F)C(C=O)C#C,0.2187
O=CC12CC1C1(CC1)C2,0.2246
COCC1OC11CCC1,0.3233
CC(O)C1CCOC1=N,0.2798
CCC1OCC2OC12C,0.3372
CC1C(O)C11OCC1O,0.2871
OCC12C(O)C3C1CN23,0.3011
CC12COC1C2(O)C#C,0.2514
OCC12CC1C(=N)OC2,0.2772
CNC(=O)C1CC=CC1,0.2618
CC1=NCCC(O)CO1,0.2562
CNC(=O)CCCC#N,0.2757
CCOC(=O)CN1CC1,0.2522
c1cnon1,0.2698
C1C=Cc2n1nc(n2)N,0.1666
CC#CC(C=O)C#N,0.2128
CC1C2C3C1CC23C=O,0.2264
CC12CC(N1)(C#C)C2=O,0.2372
CCCC(CCO)C#C,0.3084
CN1CC(C1)OCC=O,0.1909
N#CCC1C2OC1C=C2,0.2375
CC1CN1C1=CNC=C1,0.2265
CC1OCC2C3CN3C12,0.307
OCCC1COCC1=O,0.2145
CCC(=O)c1nnon1,0.1855
CCC(=O)C(O)C1CC1,0.2334
CC([NH3+])C1=COC=C1[O-],0.2206
OC1CC(OC=O)C1O,0.2694
Cn1cc(nn1)C(=O)N,0.2332
CC12CC3C4OC4C1N23,0.2871
NC(=O)C1CC1O,0.2541
CC(=O)N1CCCC1=O,0.2332
CC1=CCN=COC1,0.2328
O=CN1CC1C#CC#C,0.2125
CNc1ccoc(=O)n1,0.2057
c1c(nc[nH]1)C(F)(F)F,0.2606
CC1CN2C1=NCC2=O,0.2294
CCN1C(C)C11COC1,0.2964
CC1NC11C2C3CC1N23,0.3074
N=C1OC2CCOC12,0.2732
C(CC(=O)N)C(=O)C=O,0.1572
CC1OC2OC1C1OC21,0.3304
OC1(CC[NH2+]C1)C([O-])=O,0.2824
CCC1CN1C(C)CO,0.314
CCC(=O)OCC(=O)C,0.2356
CC1C2CC2C(O)C1O,0.2983
CN=C1NC(CO)C1O,0.2474
c1nc(nn1CC#N)N,0.2195
CC(=O)C1CCO1,0.2179
C1CC23CCC4C2CC134,0.3056
COC1(C)C2OC1C2=O,0.2419
C1OC1C1CCOC=N1,0.2675
CC(C)(C)C1(C)CCO1,0.312
C1CCC(CC1)C=O,0.2256
CC1CNC2=C1C=CO2,0.2124
CC12C(O)C1OC2C#N,0.2431
OC12CC1C1CCC2O1,0.3219
CC1=NCC(O1)C1CN1,0.2677
C1CC2C3C4OC3C24O1,0.301
c1c2c(no1)NCC=C2,0.1867
CC(O)(CO)C1(C)CN1,0.2887
CCc1c(c(co1)C)C,0.2339
O=CC(=O)CC1CN1,0.1425
CC1CC(C)(CCO)O1,0.3194
C#CC1(COC1)C#C,0.2771
C1C2C3C4C5CC13C2N45,0.3239
CC1(CC=CC(=O)O1)C,0.2156
CC1CN2C=CN=C12,0.2566
CC1=C(C)C2OC2(C)C1,0.238
CC1C2C3CC4C1N2C34,0.2694
CCC1OC1(C)C(C)=O,0.222
OC(C=O)C1=CON=N1,0.2162
CC1(CC1C#C)C(N)=O,0.2586
CC1OC11C2CC1C2O,0.3358
CC1(C)OC2COC12,0.3094
CC(C)(C)C(C)(O)C#N,0.3117
O=COCC1CO1,0.281
CCC1C(C)C(C)C1C,0.3378
O=C1CC2CC12N1CC1,0.2122
c1c2c(co1)CCCC2,0.2326
c1c2c(n[nH]1)CN=C2N,0.2141
CC(C=O)C(C)(C)C#N,0.2196
CN=c1[nH]c(no1)CO,0.2126
C1CC(=O)C2(C1=O)CO2,0.1745
CN=C(C(F)(F)F)N,0.2556
C1C2CC1OCCC2,0.3158
OC12CC3(O)C=CC1C23,0.2307
CCOC1CC2CC12C,0.3258
C#Cc1cnoc1C#N,0.1834
CC12CC3CN(C1)C23,0.284
N=C1OCC11CN=CO1,0.2634
OC12CC(C1)(CC2)C=O,0.2231
CC1C2CCC1C2=O,0.2276
O=CN1C2CC2C2CC12,0.254
CC1OCC2(C)C(O)C12,0.309
OC12CC(C1)C1OC21,0.3232
CCC1C2C(C)OC12C,0.31
CCCC1NC1CC#N,0.3002
c1[nH]c2c(n1)COC2,0.2393
CC1C2N1C1CC21CO,0.2808
CC12COC(C1)C1CN21,0.3216
COC1C(O)C1(C)C,0.3012
CC(O)C1=NC=NN=N1,0.1608
CC1CC2(CCC2O)C1,0.3273
CC1CCC11OC1C=O,0.2173
COC1C(=N)NCC1=O,0.1996
OC1C2C1C1OC2C1=O,0.2379
OCC1CC2CC12O,0.2997
OCC12CC1OCCO2,0.3065
CCC1=CC2NC2C1C,0.2423
CCC1CC1(C)C(C)O,0.326
NC(=O)C1CC1C#N,0.2641
CCCC1CC1C=O,0.2286
CCC1CC1OCCO,0.3245
c1c2c(oc(=O)[nH]2)on1,0.2093
CC(O)C1(CC1)OC=O,0.2748
CC1C=CC(C)(C)C1C,0.2596
Cn1c(cncc1=O)N,0.1636
Cn1cc(cc1O)N,0.2297
Cc1c(c(ccn1)O)N,0.2059
OC1C2COC(C2)C1O,0.2908
c1nncn1CC(=O)N,0.2435
CC1CC2(CC3CC23)O1,0.3174
OCC1(CO)CC1O,0.3019
CC1C(C)C1NC(N)=O,0.287
O=C1OC2CC1C2C#C,0.2588
c1c2n(cn1)CCOC2,0.2439
NC1=C(F)C(=N)N=CO1,0.1832
CC1C=CC(=O)OC=N1,0.2052
CN(CC#CC=O)C=O,0.1897
CC(=O)C1(C)NCC1=O,0.1924
CC1N=COCC1C#C,0.2657
CCNc1ccccn1,0.1923
CC12C=CC3(C)OC1C23,0.2254
CC1OC(=N)C1(C)C#N,0.2805
CC1C(O)C(O)C1O,0.3155
O=C1CC2OC1CC2=O,0.2014
C#CC(=O)NCCC=O,0.2153
CC1(CN1)C#CC(N)=O,0.2311
O=C1CCC(=O)C2NC12,0.2136
CCC1(C)C(O)C2CN12,0.2939
CN1C2C3C1C2(C)N3C,0.29
CC(=O)COCCC#N,0.2352
c1nc(no1)CC(=O)N,0.2108
CC(C)C1OC(=O)C1N,0.2499
CC([NH3+])C(O)C([O-])=O,0.2839
CCC1(CC(C1)C)CC,0.3492
C1CC11C2C3C=CC1N23,0.2125
CCCC(=O)CC#N,0.2366
O=CC1C2CCC3C2N13,0.2033
C(C#CCNC=O)C#N,0.2665
CC1C2C3C4CC2C1C34,0.3495
N=C1OCC2N=CNC12,0.2467
CC1(CO)CC2OC2C1,0.3256
NC1(CC2OC12)C#N,0.2703
OC12CC3(C#N)C1CC23,0.2979
CC1C(O)C2N=COC12,0.2503
CC1(C)CNC(=O)C1O,0.2769
COc1cnc[nH]c1=O,0.1887
C1C2CCOC3CC12C3,0.3223
CC#CC12CN1CCC2,0.2713
CC1=NC=C(O)OC1=N,0.1605
CN(C)c1cn[nH]n1,0.2067
N#CC1C2CC1OCO2,0.2935
O=C1C2NC2C1N1CC1,0.2027
C(C1CC1)C12CC1CO2,0.3073
CC1=C(C)C2(C)CC2C1,0.2422
c1[nH]c(c(n1)O)OC=O,0.2047
CC(CC=O)C(O)C#N,0.2266
CC(C)(C)C(N)C#N,0.2958
OC1C2C3C1OC23C#C,0.2424
CC1CNCC(=O)CO1,0.199
OC1C2C3OC2C3C1O,0.2813
CC1(COC1C#C)C#C,0.265
C1CC11CN2CC2CO1,0.304
CC1C2CCC12C#N,0.2849
COCC(C=O)C1CN1,0.2136
CC1C2OC2(C#C)C1O,0.2618
OC1CCOC(=O)C1=O,0.1821
CCC1=CC(=O)NCC1,0.2085
C1C2C=CC3C1C=CC23,0.2302
CC(C)C1(O)C2CC1O2,0.3275
c1cnnc(n1)CC#N,0.1647
C1CN1CCC=O,0.2208
OC1(C#C)C2NC2C1=O,0.1962
C1CC12CC=CC2,0.2643
C#CC#CC1CCOC1,0.2272
CCC1(CCC=C1)CC,0.2614
CC(C)NC(=NC)C=O,0.1583
NC(CC#CC#N)C#N,0.2215
OC12CC1C=CC2C#C,0.2426
COC(C=O)C(=N)OC,0.2225
Cc1ccccc1N,0.2095
C#CCN(C=N)C=O,0.2313
C1C=C(C(=O)CN1)C=O,0.1544
CNC1=C(C)NC(=N)O1,0.22
C#CCCC(=O)N,0.2758
C1C(CO1)NCC=O,0.2116
C1C2CC1C1=COC=C21,0.2492
OC1CC(=N)NC(=O)C1,0.2415
CC(=O)C1CC2CC1C2,0.2298
CC1=CC2C3OC1OC23,0.2432
c1c(c(ncn1)N)C=O,0.1799
CCOC(=NC)C=O,0.1704
COCC1C2N1CC2=O,0.2201
Cn1cc(nc1O)N,0.2299
CC1C2C3C1C(C)C23O,0.3139
c1c(nc[nH]1)N(=O)=O,0.1961
OC12CC1N1CCC21,0.2837
C1CC1(COCCO)O,0.3163
CC1CC2(O)C(O)C12O,0.2883
CC12CC1(O)C(=O)N2,0.2429
c1c(c([nH]n1)N)C2CC2,0.2382
O=C1OC23CCC2NC13,0.2349
COC1CC(C)(CO)C1,0.3147
C1C=CCOC=N1,0.2555
CC1=NC(=O)NC(=N)O1,0.2174
OC1(CC1)C1OC1C=O,0.2085
CCCC1=CCCCC1,0.2585
OCC1CCCC1C#N,0.3038
CC1(O)CC1(C#N)C#N,0.2715
OC1C2C3CC(O)C1C23,0.2977
O=C1NC2CC3NC3C12,0.2774
C1COCOC(=O)CO1,0.2486
C1OC11C2C3CC1CC23,0.345
OC12CC1(CC#N)CC2,0.299
CC1C(O)CC2OC12C,0.3319
C1CC12CCOC(=O)O2,0.3155
C1CC2OC3C(O2)C3O1,0.3012
CC(C)(C)N(C=O)C=O,0.2092
OCC12CC(O1)C(=O)C2,0.2145
CC1C2C3C4C(CN24)N13,0.2624
OCC12CCC1N2,0.3255
CCC1=CCC(C)C1C,0.2572
COC1(COC1C)C=O,0.2089
c1c(c(n[nH]1)O)OC=O,0.2335
CC1OC2CCOC12,0.333
CCCc1c(c[nH]n1)O,0.2356
OC1(CC1N1CC1)C#C,0.2663
CCC1=CC(CC1)C#N,0.2584
CCC12OCC3C1OC23,0.309
CC1(C)C2C3C(O)C3C12,0.2668
O=C1OC2CCC3C2C13,0.2692
O=C1CC(N1)C#CC#C,0.2177
OCC(O)C1CN1C=O,0.2615
COC12C3CC1CC23O,0.3007
c1[nH]nc(n1)N,0.2332
CC1NC(=O)C1CCO,0.2796
O=C1C2CN2CC2OC12,0.2039
CCC1OC1C1CN1,0.3305
CCCC1(C)OC1CC,0.3433
C1C(CC(=O)C1=O)CO,0.1429
C(c1c(nno1)C#N)N,0.2107
CC(NC(N)=O)C(N)=O,0.259
CCOC(C)C#CCO,0.2779
NC(=O)C12CC(C1)CO2,0.2712
N=COC1C2C3CC2C13,0.2807
CC1NC11CCNC1=O,0.2682
OC12CN(CC1)C2C#C,0.2531
CCC#CCCCC=O,0.223
OC12CC3C4OC(C13)C24,0.3023
N=C(OC=O)C#C,0.2223
C1C2CC3COC(O3)C12,0.3259
C1C2OC2C2=CC=CN12,0.226
C1C=C(CO1)CO,0.2509
CC(=N)OC12CN(C1)C2,0.2626
CC1OC=NC11CC1O,0.2502
CC1CCC2CC12O,0.3242
FC(F)(F)C1C2CCC12,0.3515
C1C2CC1C=C2,0.2404
CC(C)(c1c[nH]nn1)O,0.2513
CC1C2(O)CC1(O)CC2,0.3145
c1coc2c1CCCC2,0.2323
COC(=O)C(CO)C#N,0.2761
CC1(C)NC1(C)C1CN1,0.3092
O=CC12C3C1C1CC3N21,0.2058
OC1(CCC=C1)C1CC1,0.258
COC=NC1CC1C,0.248
CC12N3CC1(C3)OC2=N,0.2239
c1c(nn[nH]1)C2CC2,0.2371
OC1C2CN(C2)C1C#N,0.2587
C1CCOCOCC1,0.3451
O=C1CC2CC3CC12C3,0.2203
CC(=O)C(C)(C)OC=O,0.2285
CC(=O)CN(C)CC#C,0.2116
CC1(C=CNC1=O)C#N,0.212
N=C1OC23CCC2CC13,0.2738
C(C(=O)C=O)NC=O,0.153
CC#CCC(C)(C)C,0.2979
OC1C(O)C11CCC1,0.2784
CCCC1OC(=N)C1C,0.2886
CC1(CC2C(O)C12)C=O,0.2276
CN=C1OCCN1C=N,0.2323
CC12CN1C(=O)C1NC21,0.2211
CC1CC23CC12OCC3,0.2907
CCN=c1occ(o1)C,0.2327
C1Cc2c(non2)C1,0.2459
CC1C2CC(=O)C(=O)N12,0.1564
CCCC1(N)COC1=O,0.2504
CN=C1NC(C)C1O,0.2579
CCCCC(=O)CC#N,0.2365
c1c(c(=O)onc1N)O,0.175
C1C2C3N1C1C=C3CC21,0.1241
O=C1C=CNC2CC1C2,0.1859
OC1C2OC2C2CC12O,0.3116
CC1OC2C3NC3CC12,0.3004
CC1C(O)C1(C)NC=O,0.2564
c1[nH]c(c(n1)CCO)O,0.2355
CC12OC1C(C#C)C2=O,0.2042
C1C=C(CO1)C(=O)N,0.209
CC1=CC(OC1)C1CN1,0.2503
CN1CC11CC=CC1=O,0.1791
O=CC#CCC1CCO1,0.2001
CC1CCC2OC2CC1,0.3344
C(CO)COC=O,0.2864
CC1(O)C=CCC1=NO,0.2471
OC1=NC=C2C3CC3N12,0.2219
OCC(O)C1=COC=N1,0.2354
N=C1NC2=C(N1)C=NO2,0.187
COCC1=CCOC1,0.2504
c1c(nc[nH]1)OCC#N,0.2304
CC1OCC(=O)NC=C1,0.2117
O=COC1C=CCC1=O,0.211
O=C1OCC1N1CCC1,0.2387
c1cnc-2cconc12,0.1435
C1COCC(=O)CN1,0.1973
CC1=CC2C3CCC1C23,0.2352
c1cnc(nc1C=O)N,0.1584
CC1(CO)OC1(C)CO,0.3334
CC1OC2CC1(CO)C2,0.2984
NC(=O)C(O)CO,0.2657
CC1N2C(=N)C(O)C12C,0.2397
C1CNCC(=O)CN1,0.1941
CC1C(CC=O)C1C#N,0.227
CC12CC1C=CCO2,0.2335
CCCC1C(O)C1CO,0.305
CCC(C)N=C(N)C=O,0.1858
CCC(C#N)C(C)C,0.3475
CC12CC1C1(CN1)C2=O,0.216
COCC(C)OC(C)=O,0.28
CC1=CCN2C(CO)C12,0.2292
COC=Nc1ccc[nH]1,0.1744
CC12CN1CCC21CC1,0.3081
CC12CCN1C2CC=O,0.2064
CC(C)Oc1cocn1,0.2181
c1c(c(cnc1F)F)O,0.2263
N=C1N=NON=CC1=O,0.1356
CCC1C2CCC12CC,0.3228
CCC12CC3C1C=CC23,0.2254
CC1C=C(C)CCC1=O,0.2218
CC([NH3+])C1(CN1)C([O-])=O,0.2519
N=COC12CN3C1CC23,0.2712
O=CC1C2OC1C2(C)C,0.2085
C1CC1C12CN3C1CC23,0.3145
CC#CC#CC(F)(F)F,0.2253
c1c(=O)c(c[nH]c1O)N,0.1883
c1c(ocn1)C(=O)CO,0.1976
c1c[nH]c(=O)nc1F,0.1933
CC1C2CC1(C)COC2,0.3278
CC1(CNC(=O)O1)C#N,0.2784
OC1C=CC2CCC1O2,0.2504
CC1OC(=N)C1C1CO1,0.2876
[O-]C(=O)C1C2C[NH2+]C12,0.2655
CC1=NCC(C)(CO)O1,0.2698
CN=C1OC2CC12C#C,0.2594
CCC1(O)C(O)C1(C)C,0.3055
C#Cc1nc([nH]n1)CO,0.2289
CC#Cc1ccco1,0.1944
CC1OC11CCC11CO1,0.3042
CC1=NC(=N)NC=C1F,0.1514
CC(O)C(=O)C1OC1C,0.2229
Cc1cc(=O)[nH]cc1C,0.1774
CC12CC(COC1=O)N2,0.2435
N=C1CC(O1)C1COC1,0.2797
CC12CC1C1(CO)NC21,0.2582
CC12CC3(CC1N23)C#C,0.2638
CC1CCOC2COC12,0.3261
C1C2OC3CC=CC3C12,0.2557
C#CC12C3C4C(CC14)N23,0.2605
CC1OC1C1CC(=N)O1,0.2908
CC1COC1C(O)CO,0.302
CC1(O)C2COC1OC2,0.3243
COC1C=CC2(C)CC12,0.2399
CCCC(C#N)C(C)C,0.3448
N#CC1CCN=COC1,0.2572
C1CC1CC2CC2,0.3641
CN1CC2(C1)C=CCO2,0.2291
CN=C1OC=NC=C1O,0.1744
C1COC(=O)NC=N1,0.2455
C1C(COCO1)(CO)O,0.3288
COC(C)C1C2CCN12,0.3035
OC1CC(=O)C1C1CN1,0.2111
C1CC1C12NC1C1CC21,0.2811
OC12C3OC(C13)C2C#C,0.2589
CC#CC1NC1C#C,0.2608
CC(C#N)(C#N)N1CC1,0.2614
CCC1=CC(O)C2NC12,0.2382
CCc1ncno1,0.2629
OC1C2C3OC2C13C#C,0.2657
CC(CO)C1C(C)C1O,0.3076
CC1(CO1)C1CC2CN12,0.3162
CC1(C#N)C(O)C2CN12,0.278
O=C1CC23CN4C2C1C34,0.21
O=CC12OCC1C2C#C,0.1975
CC12OCOC1CC2=O,0.1948
O=CN1C2C3CN=C1C23,0.1558
NC(=[NH2+])NCC([O-])=O,0.2648
O=CC1C2NC1C21CO1,0.2122
O=C1C2CCC22OCC12,0.2149
OC1C(C=O)C11COC1,0.2195
CC(=O)NCCOC,0.2784
CCC1OC1CC,0.354
O=C1C2NC1C(=C2)C#C,0.1902
C1OC23CCC(C2)OC13,0.3079
CC1CC2(C)OCC12O,0.3005
CC(C)C1(C)OCC1=O,0.2212
CCC1C2CC3CC2C13,0.3551
C#Cc1cnoc1CO,0.2161
C(C#CC#N)C(=O)CO,0.2271
CN1C2C3OCC2(O)C13,0.2608
Cc1cn(cc1N)C=O,0.1759
CCC#CC1OCCO1,0.2873
OC1C(O)C1(C)C1CC1,0.2782
CNC=[NH+][C-](C#N)C#N,0.1337
CC12OC3C(NC13)C2=O,0.1941
CC#CC(C)(N)CC#N,0.2734
COC1CN(C=N)C1=O,0.2102
OC1(C2CC2)C2CCC12,0.3083
C1C2OC3CCC3=CC12,0.2401
CCC12C3OC1C=CC23,0.2242
c1nc2[nH]c(nn2n1)O,0.256
C#CCC1CCC11CO1,0.3072
C1OC11C2CC1C21CO1,0.3485
CC1(C)OC2C1OC2=O,0.2478
COC(C)C12CC1OC2,0.3017
COc1c(nc[nH]1)C=O,0.2001
CC12CC1C1(CC1)C2=O,0.2284
C1CC1NC(=O)CO,0.2651
c1c(ncnc1O)N,0.2268
COC12C3CC1CC23,0.3205
NC1(CCO)COC1=N,0.2675
NC12CCC1C2(N)C#N,0.268
COc1cnnnn1,0.1747
NC1=CC(=N)C(F)=CO1,0.1913
CCN1C2C3CC3C12C,0.2799
CCC12N=COC1C2C,0.255
O=CC1NC11COC1=O,0.2163
CCCOC1C(C)C1C,0.313
CC1C(NC=O)C1(C)C,0.268
CC1(O)CC(C=O)C=C1,0.2151
CCOCC12CN1CC2,0.3184
COC1CC(C)C(C)=C1,0.2586
OCC1OCC(=C1)C#C,0.202
C#CC(=O)C(CO)CO,0.192
CC1CC2CC2C1(C)O,0.3297
N=C1NN=NC(=N)C=N1,0.1629
C(=O)Oc1nc(on1)N,0.2336
c1c(c[nH]c1CC#N)N,0.2123
COCC(=N)NC(=O)N,0.2541
CC(OCC(C)=O)C#C,0.2183
CCC#Cc1cc[nH]c1,0.219
C#CC1CCC11CO1,0.2915
CC1(CO)CCC=CC1,0.268
CC1C2NCC(=O)NC12,0.25
CCCC#CCC(C)C,0.2973
OCC1NC(=O)C11CC1,0.2791
CC(=O)C1OC1C=O,0.1993
CC1CC1C(C)(N)C#N,0.2958
COCC1OC(=O)C1C,0.2795
CC1=CCC(=N)N1C=O,0.2036
CN1CC1C(C)(C)C#N,0.2683
CCC1(CO)CCOC1,0.3153
NC12CN3C1CC23C#N,0.2542
OCC1=CCCC1C#C,0.2588
CC1CNC(=O)C1C=O,0.2174
CC#CC12CN1CC2O,0.249
CC1=C(C)C(=O)OC1=N,0.1972
OCCC1C2CC1CC2,0.3428
N=C1OCOCC2CC12,0.2685
C1C(=NO)COC(=O)O1,0.2512
O=C1C2CN2C1C1CN1,0.2122
CN=C1C=NNC=C1N,0.1564
CC(C)(C)C1OC1(C)C,0.3273
CCN=c1cccco1,0.1627
CC1CCCOC(=O)C1,0.2739
CCCC1(C)CC2OC12,0.3328
CC1=C(F)NN=CC1=N,0.1744
OC12CC3C=CC1(O)C23,0.2223
c1ccc(c(c1)N)F,0.2088
CC1CCOC2CN1C2,0.2853
C#CC1OCC11CN1,0.2639
Cc1cc2c(o1)ocn2,0.214
CNC12CCC1OC2=O,0.235
OC1C2C3CC2(O3)C1=O,0.2023
OCC1=NCC(N1)C#C,0.2491
Cc1cnn(c(=O)n1)C,0.1748
C#CC(CO)(C#C)C#N,0.2866
CC(=O)CC1(CN1)C#C,0.2077
CCN1C2C3OCC1C23,0.2816
N=COC1C2C3CC3C12,0.2381
C1C2C=CC3CC(C3)C12,0.2442
CN1CC11CN(C)C1=O,0.2571
CC1OC23CC12C=CC3,0.2333
CCC(C)(CC)NC=O,0.2768
[NH3+]C(CCO)C([O-])=O,0.2696
COC(C=O)C1CN1,0.2078
CC1C2NC2C1CC#N,0.2857
C1C2CCC3COCC123,0.3202
c1cocc1C(=O)C#N,0.1739
OC12CN3C1CC23,0.3163
C1CC12CC3(C2)CC3,0.3406
CCC1C2CC1COC2,0.3313
c1c(oc(n1)NC=O)N,0.2041
O=CCC1COC1C=O,0.2101
CC1CC(O)C(C1)C=O,0.2311
CC(=O)NC1CC1C#N,0.2659
C1CCN(C1)CC#N,0.2577
COC1(CO)CN2CC12,0.3033
Cc1nc(c(o1)C#N)N,0.1885
CC(=O)c1cnc([nH]1)O,0.1848
CC1=C(CO)COC1=N,0.218
COC12CC(O)(C1)CC2,0.3175
CN(C)C(C=O)C#N,0.2022
CC1N(C)CC1(N)C#N,0.2495
O=CC1C2C3CC2N1C3,0.2048
O=CNC12CC3C(C1)C23,0.268
CC1CC1CC1OC1C,0.3419
CN1C(=O)C2OC2C1=O,0.2244
C1CC1OC(=O)N2CC2,0.2883
CNc1c[nH]nc1O,0.2182
Cc1cccc(c1O)N,0.2036
c1c(c(oc1N)O)O,0.2166
CC12C(O)C3C1CCC23,0.3215
NC1=NOC(=N)C(N)=N1,0.1661
C1NC11C=CCC2OC12,0.2521
CCC(C)(O)CCC=O,0.2301
C1CC1C#CCCC#N,0.271
OCC12CN3C1C(O)C23,0.2896
CCC1C(C)C1C#C,0.2875
CC(C)C1C2C(O)CN12,0.2861
COC1C(NC1=N)C#N,0.2617
CC1(CC1)C#CC2CC2,0.2781
CC1(OC(=O)C1N)C#C,0.2461
OC1CCC2(O)CC1C2,0.3239
CCN1C2C3OC3C12C,0.2662
O=CC12CC3CCC1C23,0.22
CCN(C)C(=O)OC=N,0.2562
OC1C2C=CC3NC3C12,0.2229
OCC1NC11CCOC1,0.3111
CC1=CC(C)(O)C2CC12,0.2432
COC1OC2CC1C2=O,0.2152
Cn1c(c(cn1)C=O)N,0.1995
c1c(con1)C(F)(F)F,0.2559
CC1(CCC1)OCC#N,0.287
CC(=O)C(CC#N)C#N,0.2322
Cc1coc(c1CO)N,0.2178
CC12CN3C1CC23C#N,0.2547
C#CCOCC1CO1,0.2888
OCCCN1CC1C=O,0.2102
CC1C2C3C(C#N)C2N13,0.2711
COC1(CCO)CC1C,0.3262
CC1CC(O)(C=O)C=C1,0.2132
C#CC1(CC2NC12)C#N,0.2655
CC1=NC(CO)C(=O)O1,0.2439
C#CC(=O)CN1CCC1,0.1677
CC12CC1(O)C1COC21,0.3115
CC1CC(=O)COC1=N,0.2193
CN1C(C#N)C(O)C1=N,0.2504
CC(C=O)C#CC#N,0.2098
c1c[nH]c(c1N)N(=O)=O,0.1517
C#CCCC1CC2CC12,0.3098
C(=O)Nc1c([nH]nn1)N,0.2047
CC(CO)OC1CC1O,0.2965
OC1C2C3NCC1OC23,0.256
CNC(=O)NCC#C,0.2816
C1N2C3CC4CC2C13O4,0.2906
CC1CC(C)(C=O)C1O,0.2113
CCC1OCC1CC#C,0.2938
C(C#N)N(C=O)C(=N)N,0.2414
CC1N=C(NC1=O)C=O,0.1663
c1nc(c(c(n1)O)N)O,0.2048
N=C1NC=NN1C=O,0.1965
CC1CC1(CO)OC=N,0.2838
CC(C)(CO)C1CO1,0.3337
C1C=CC23OC=NC2C13,0.2294
CC(CO)C(O)C#C,0.2954
CC1(O)C(N)C1(C)C#N,0.2844
COC(C)C1CC1CO,0.3254
N=COCC1=CN=NO1,0.2326
CC1CC2(CC2O)O1,0.2935
N#CC1CC11C2CC1C2,0.3103
O=C1CC2CC1CCO2,0.2176
CC(=O)C1C2C(O)CN12,0.2013
CCC1OCCC1C=O,0.2232
CCC1OC2C(O)CC12,0.3057
O=CNCC1CC2CC12,0.2766
CC12NC1(CC2=O)C#C,0.2072
CC1(C)CC2CC12CO,0.3179
CCCN(C)C(=O)OC,0.2963
CC1C(CC1=O)C#C,0.2193
CC(C)(COCC#N)O,0.2838
CC(O)C(C)CNC=O,0.2815
c1cnn(n1)C(=O)C#N,0.2044
OCC1OC1CCC#N,0.3076
CC1C2(C)CCC1(C)O2,0.3196
N=C1NC2=C(O1)N=CO2,0.1899
COC12C(O)C1CC2O,0.2944
O=CC1NCCNC1=O,0.211
c1cc(oc1)N=CN,0.1759
CCC1C(C)C(=O)C1O,0.2237
CC1(O)CN=C(N)C1O,0.2489
CC12CC3N1CC23O,0.3146
OCC12CC1(O)C(=N)N2,0.2497
NC(=O)CN1CC1C#C,0.2578
CC#CC1C2OC1C=C2,0.2286
CCCC(O)C(=O)NC,0.2768
CC12OC1C1CC2O1,0.3093
OC12CC3C1C1(CC1)C23,0.325
CCC12CC1C1OCC21,0.3042
NC12C3CCN=C1OC23,0.1912
CCC1C2C3C4C3C2C14,0.322
CC(O)C1(C)COC1,0.3014
CC1=CC2C(CO)C2C1,0.2413
CC(C)OCC(C)(C)O,0.3257
CN1CCCC=CC1=O,0.2091
CC12OC1(C#N)C1NC21,0.2583
Cc1coc(c1O)CO,0.2284
C(=Nc1c(n[nH]n1)N)N,0.1794
COC(C#N)C(O)CO,0.2717
CC1CC2(CN2)C2OC12,0.32
CN=C1OC2(C)CC12C,0.273
CC1=C2CC3C4C(C14)C23,0.1766
CCC1(CC=CC1)C#N,0.2646
C1N2CC11CC3NC3C21,0.286
C#Cc1c(nc[nH]1)O,0.1957
CN=C1C2(CC2)N=CN1,0.2071
CCCc1cnoc1N,0.2241
NC(C#N)C1=COC=N1,0.2437
CCCNC(=N)C(=O)N,0.2024
CC1COCC(CO)=C1,0.2595
C1N2CCOC3CCC123,0.2997
C1C=C(CC(=O)O1)C#N,0.223
C1CC2(C1)COC(=N2)N,0.2748
COc1c(oc(n1)N)N,0.2179
OCCC12CC1CCC2,0.3361
CC1C2N1CC2(C)C=O,0.203
CC#Cc1c([nH]cn1)N,0.2112
CC12CN1C1CC1C2O,0.287
CC12OC1CC2(O)C#N,0.2729
CCOC1=CNC(=N)O1,0.2278
O=CC1=CC(=O)C2CC12,0.1534
C#CCc1nc(co1)N,0.2105
O=C1CN2C(C3CO3)C12,0.22
CC1OC2CC2(O)C=C1,0.2324
Cc1cc2c([nH]1)CCO2,0.2124
C#CCCC1COC1,0.298
CN1C2C3C=CC1C23C,0.2131
c1c(nc([nH]1)NC=N)O,0.1822
NC1(C#N)C2CCC1N2,0.2714
C1OC2C3C=CC2C3O1,0.2387
CC1OC(C)=NC11CC1,0.252
Cn1c(nc(=O)nn1)F,0.1744
CC12CNC1(CO)CO2,0.2853
CC12CC3N1C3(C2)C#N,0.272
CCCNC(=O)C1CN1,0.2703
C1CC2C1OC1CN2C1,0.2816
Cc1ccc(cc1)OC,0.2129
OC1CC2OC2C11CO1,0.3126
c1c(c(c(o1)C=O)N)N,0.1769
CC1C2C3C(N3C)C12O,0.2696
COC(COC=O)C#N,0.2837
CC1CCC1OCCO,0.3286
CC1(C)C2C3NC3(C)C12,0.3367
CCC#CC12CC1CC2,0.2613
CCC1(OCC1O)C#C,0.272
N#CCC1OCC2CC12,0.3069
CC12OC1C1C=CCC21,0.2631
C1C2C3C4CCOC13C24,0.3279
CC1(CCCC1)C#C,0.3134
CCCC(O)C#C,0.2979
NC1=COC(OC=N)=C1,0.2034
C1CC11C2C3CCC1C23,0.3322
C1OCC2CC=CCC12,0.2606
CC(=O)C1C(O)C2CN12,0.2092
CCN(C)C(=NC)C#N,0.1911
O=C1CCC(O1)C1CO1,0.2808
CC1CC11N=CNC1=N,0.2119
OC1C2OCCC=CC12,0.2397
c1c(c([nH]c1N)CO)N,0.2094
OC1CC2COC2C1=O,0.2037
CC#CC12CCC1N2C,0.2658
OC(C#C)C1=CCCC1,0.2503
Cc1c(c[nH]c1C#N)O,0.1933
CN=CNC(=NC)C#N,0.1826
CC1(C)OC2C(O)C12O,0.2929
OC1CC2CCCC1O2,0.3061
OC1C2CC1(O)CCC2,0.314
C1C2OC22C=CCCC12,0.2274
C#CC1C2C3N=CN1C23,0.2222
CC1(CC2COC12)C#C,0.2841
C#CCC1C2OC1C=C2,0.2361
CC1OC1CCN1CC1,0.3254
CCOC1C2COCC12,0.3068
C1C2OC3CC2C1OC3,0.3124
CC1(C)NC(=N)C(=O)C1,0.1769
OC1CC2CC12CC=O,0.2226
c1[nH]c(c(n1)O)N2CC2,0.2175
OC12CN3C4CC1C2C34,0.2969
CC1C2C3C4C3C2(O)C14,0.2776
CC1(CC#C)NC1C#C,0.2722
CC1COC2C1CC2=O,0.1954
c1nc(no1)C(=O)C=O,0.1462
COC1CCCC=C1,0.262
OCC1C2OC2C11CN1,0.304
CC(=O)NC=NC1CC1,0.2207
CC12OC1C(C=C2)=NO,0.1886
Cc1c(n(nc1O)C)C,0.2359
O=C1C2CC3C2OCC13,0.226
c1c(c(nc(n1)F)O)N,0.1882
CC(OC=N)C1(C)CO1,0.2782
CNC1=NC(=N)N=CO1,0.1999
CC#Cc1cnoc1,0.2117
CNc1c(non1)CN,0.2023
CC1=CC(CO)C(=O)N1,0.2138
CC1CC11OCC1C=O,0.2043
C1CC12CC(=CC2=O)N,0.2093
CC(=O)c1c[nH]nc1N,0.1768
CC1OC(=N)C(=O)C=C1,0.1736
CCCCC#CC(C)C,0.2993
CC1(CC(=O)C1)O,0.2203
Cn1c(cnn1)N(=O)=O,0.1864
OC12CCC(CC1=O)C2,0.2264
CN1CC11COC1(C)C,0.3099
COCCC#CCC=O,0.2196
CC(C)C1CC2OC12C,0.323
N#CC1CN=C2OCC12,0.2592
CCC(O)C1NC1C#N,0.2796
c1nc(nc(n1)O)O,0.2398
OC1CCCC1C1CC1,0.3298
OCCC1OC2CC1C2,0.3212
C1C23CC=CC12CC=C3,0.2416
N=C1OC2C1C=CC2=O,0.1802
NC(=O)C1NC(=N)C1O,0.2525
CC1COC(=N)CC1O,0.277
CC1(O)C(C=O)C1(C)O,0.2216
OC1C2CCC(O)C12,0.3051
CC#CC1C2COC12,0.2766
CCC(C)C(O)C=O,0.231
COC1C2CC2C2NC12,0.2949
CC(O)C1CC11CCC1,0.3266
CC12CC1CN2C(N)=O,0.2805
CC12CC3C1C3(CO)O2,0.3037
N=C1OCC(CO1)C=O,0.2023
N1C2C3OC=NC2C13,0.252
CCN(C)C(=O)C#CC,0.2218
CC12CC3C1C(C#N)N23,0.2612
CC1C2C3C4C2N1C34C,0.299
CC1OCC2=NON=C12,0.2213
CC1=CC2(O)COC1C2,0.245
CC1C2CC3C2C13CO,0.3058
C1C2OC3=CN=NN3C12,0.2412
CC(=O)NCC1CC1O,0.2781
CC1C2OCC2N1C=O,0.2643
CC1COC1=NC1CC1,0.257
Cc1c(nn[nH]1)C2CC2,0.2303
COC1C2C(N2C)C1=O,0.1947
CC1CCC(C=O)=C1N,0.1819
COC12CC(C1)C2C#N,0.2957
CCC(=O)C1CCC1,0.2292
C1C=CCOC12COC2,0.2604
CCCC1(C)C2CC1O2,0.3171
COCC1NC1(C)C=O,0.2229
O=C1C2CC1(CC#N)C2,0.2525
CC1(CCC1)NCC#N,0.267
OCC12CC(C1)COC2,0.3125
c1c(ocn1)C2CCC2,0.2364
CC(C)C12NC1CC=C2,0.2455
c1c([nH]c(n1)O)NC=O,0.1957
CCC([NH3+])C1=CN=N[N-]1,0.2537
CC1COC(=N)C11CO1,0.2629
CC1=CCCC1(C)C#N,0.2559
CC12NC1C(O)C=C2,0.2374
CC1OC1C1NC1C=O,0.2226
CC1CN(C)C1(C)C#N,0.2607
O=CC1=CCOC1C#N,0.1914
OC1C2CC(C2)OC1=N,0.2738
CC1C2C=CC1N2C,0.2141
OC1CC23OC4C2OC134,0.2554
CCOCC1CN1C=O,0.26
CC(C)(C#N)NC(=O)N,0.2866
CCC(C#C)C(O)C=O,0.2229
CC1CCOCCO1,0.3253
CC12CC3OC1CC23,0.3321
CC1COC(=O)C=CN1,0.2012
O=C1CNC1CC#N,0.2159
C#CCC12NC3C1NC23,0.2757
CC1CC2(C=O)C1N2C,0.218
CCC1CCC(=O)O1,0.2791
CC12OC1CC=CC=C2,0.1995
CN1C2C3C4C1CC2N34,0.2967
CC1CC2C(C#C)C12O,0.2817
N=C1OC2C3C4NC13C24,0.2603
c1c(con1)OCCO,0.2265
C1C(CC1=O)OCCO,0.2212
CCC12CC3CC1N23,0.3305
C1C2OC34CC3(CC4)C12,0.2927
CC1C(O)CCNC1=O,0.2645
CC12CC3C1N3CCO2,0.3094
CC(=O)N(C)C(=O)NC,0.2415
CC1CC2(O)CC(C2)O1,0.3151
C1C2OC3=C(N=NN3)C12,0.226
OC12CC3OC1CC23O,0.2825
CC12CCCC(O1)C=C2,0.2473
c1nc2c(o1)OCCC2,0.2247
CC#CC(C)(C)C(=O)N,0.2696
CC1CC(=O)C2NC12,0.2159
CC(CO)C1=CN=CN1,0.2501
NC(=O)C(CO)C1CN1,0.2694
CCC(C)(OC)C1CN1,0.3089
CC1CC(CO)C1O,0.3116
CC12COC1CCCO2,0.3189
OCC#CC1C2CC1O2,0.264
O=CC1C=CCC2OC12,0.2076
CC12OC1C1OC=NC21,0.269
CC1C=C2CC3C2C13O,0.1826
CCC(CO)CCCO,0.3371
CC1C(O)C1(CO)CO,0.3022
C1C(N1C=O)(C#N)C#N,0.2426
CCC1CC(C)C(O)C1,0.3264
C#CC(CO)(C#C)C#C,0.2873
OC1C2NC1(C#C)C2=O,0.2237
COc1c(c(c[nH]1)N)N,0.2272
CC1C2OC2C(=O)C1=O,0.1478
COC1CC1(C)OC=O,0.2572
c1c(=O)c(noc1N)F,0.1915
C(#N)c1[nH]c(c(n1)O)O,0.1747
CC1C2C3CC3C12C#C,0.2367
O=CCC1CNC(=O)N1,0.2092
CC1=CC2CC1(O2)C=O,0.1973
CC1(CCC1)C#CC#C,0.2263
c1(=O)c(=O)onc([nH]1)N,0.1885
CC12CC(C1)(CC2)C#C,0.3021
O=C1COCC1CC#C,0.2142
N=C1C2OC2CN1C=O,0.2235
CCC(C)(CC#N)C=O,0.2248
CC1CC(OC1C)C=O,0.2131
CCC1C2OC(C#N)C12,0.2578
CC1=C(CO)CC2CC12,0.237
COC1OCC2(C)OC12,0.3316
CN1CC11C2CC2C1=O,0.2112
c1c(c(c([nH]1)O)O)N,0.2242
C#CC12CC3OC3C1N2,0.27
CC1(CO)C2N1CC2=O,0.217
c1cc([nH]c1C#N)C#N,0.1887
N=C1C=COC(C=O)=N1,0.1539
O=C1OC2C3CC1CC23,0.2764
CCCC(O)CC(C)=O,0.2295
OC1CC11C2CN2C1=O,0.2275
CC(O)CC1CN1C=O,0.2524
OC1CC2CC2C1,0.3318
O=C1C2CC3C=CC2C13,0.221
CC1(CC1)C1OC1C=O,0.217
c1c(nc(o1)CN)CO,0.242
Cn1cc(nn1)C(=N)N,0.2196
CC12C3CC1(C)N=CN23,0.238
C1CN(C1=O)C2COC2,0.2677
CC1=NC2CC3C(O1)C23,0.2641
CCC12OC1C1CC2C1,0.3285
OCC1OC2CC3C2C13,0.3214
OC12C3NC3C3C1OC23,0.3124
N=COCC1CC2OC12,0.2838
N=C1C=CNN=NC1=N,0.159
CC1(O)C2C3CC2C13,0.3284
C#CCN=C1C=CCO1,0.2071
CC1(CC1)COCC#C,0.2885
CNC1=NC=COC1=N,0.1638
CN1C(C#C)C1(C)CO,0.2568
CN1N=NC(=N)N=N1,0.1638
CCCC(C)C1CCO1,0.3217
COC(=O)C1NC2CC12,0.2285
COC(CO)CCC#C,0.3076
O=C(C#C)C1CN1,0.1933
CC1[NH2+]C[C-](C=O)C1=O,0.1777
OC12CC3CC1OC3C2,0.3103
CC1(CCN=COC1)C,0.2592
Cc1c([nH]cn1)COC,0.2427
C#CC1CC2(C1)COC2,0.2914
OC1C2OC2C11CO1,0.3086
CC12C3CN1C(C3)C2O,0.3144
CC12C(CC1O)N2C=O,0.2435
COC(=O)C(=O)CC#C,0.1786
CC1CC2OC(=N)C2N1,0.2495
CC12CC1NC2=O,0.2532
CCN(CC)C(=O)CO,0.2687
O=CC1C2C3C4C3C2C14,0.2138
CCCC(C#C)C(N)=O,0.2676
CC(O)C1=CNN=C1C,0.2607
CC12C3CC1C3C21CN1,0.3065
COC1OCC2(C)NC12,0.3107
COc1ccccn1,0.2114
CCOC(C)(C)CCO,0.3231
CC1=C(N)N=NOC1=N,0.1452
COC(C)CNC(N)=O,0.3028
OC1CC2COC3C1C23,0.3196
O=C1OCC2CC1N2,0.2525
CC#CC1(C)OC1C=O,0.2141
CCC(C#N)C(O)C#N,0.3045
C1C2(N1CC=O)COC2,0.2203
C#CCC1(CO1)C1CO1,0.301
CC1OC1(C=O)C1CO1,0.2141
CCOCC1CCCC1,0.3341
CC1C2OC(C)C12C#N,0.2712
CC12CC3(O)CN1C23C,0.2904
CC1NC1C1=NON=C1,0.2265
CNc1nc(on1)CN,0.2237
ON=C1COC2CC2C1,0.2456
CC12C3C(CN13)CC2O,0.2948
CCC12CC(=NO)C1N2,0.2419
CC1CC(C#N)C(=O)O1,0.2687
c1c2c(n[nH]1)CN=CO2,0.2308
Cc1cccn1C=O,0.1843
CC1OC1C#CC=O,0.2009
CCCn1cnnn1,0.2673
Cc1c([nH]c(n1)OC)O,0.2414
CCC1C2CCC12C=O,0.2254
CC12NC1(CC2=O)C#N,0.2138
CC12CC1C1CC1C=C2,0.246
OCC12OC3C1C=CC23,0.223
CN=C(NC=O)NC=O,0.2013
C1OC23CN4CC2C4C13,0.2966
CC1OC(C)(C=O)C=C1,0.2
COCC(=O)C1CC1C,0.2309
CC1C2CC2C1C(N)=O,0.2591
CC1C=CCC11COC1,0.2602
C1CCN(CC1)C=O,0.2701
OC1C2C3CC3(C=O)C12,0.2138
CC(O)C(OC=N)C#N,0.284
CCOC1(CC)CC1O,0.2957
CC1=CC(=O)CCC1O,0.1884
C#CC12CC1CN=CO2,0.2628
N#CC12CN3CC1C23,0.2619
C#CC1CC=CC2CN12,0.232
CC(=O)NC(C)(C)C#N,0.2697
CCC(F)(F)F,0.4465
C1C23CCC12N=CO3,0.233
CC12CN1C1=NCCC21,0.2349
CC12CC(C1)C2N1CC1,0.3294
CC1CCOC(=O)C1O,0.2602
CCOCCOC(=O)N,0.3152
O=C1OC2C3C=CN1C23,0.2155
C(c1c(nc([nH]1)O)O)O,0.2296
CC1NC2COC=NC12,0.2551
Cc1cc(c[nH]c1=O)N,0.1588
OC1CC23OC(C=C2)C13,0.2201
CC1OC2CC2C2NC12,0.3028
CC1CC1C(O)C(C)=O,0.2316
COC12CC(C1)C2C=O,0.2183
COC12CC1(C)C1OC21,0.3162
C#CCCC#CC#N,0.236
C1NC11CN2CCN=C12,0.2304
CCC(OC)C#CC=O,0.2042
CC12OCC1C(=O)C2O,0.1967
CC1(OC(=O)C(=O)O1)C,0.2103
C1CC2OCC=C2C1,0.2429
CC1CCCC(=N)OC1,0.27
C(=O)NC=O,0.2191
CC12CCC(COC1)O2,0.3143
CCn1ccnn1,0.2585
CCOc1ccn(c1)C,0.2275
CC1C2OC(=O)C12,0.2772
CC(CCC(C)=O)C#N,0.2351
NC1CN2C1C(O)C2=N,0.2229
OC1CC2(C1)OC2C#C,0.2753
OC12COC(OC1)C=C2,0.242
C1CC1COCC=O,0.2291
N=C1OC2C(NC=O)C12,0.2542
CC1(C)C2OC1(C)C2O,0.3015
CCOCC(=O)NC,0.2709
C1CC1CCCCCO,0.3427
CC1=C(C)C(=N)N=NO1,0.1656
CC1C(C)C1(C)C(N)=O,0.276
c1cnc(c(c1O)O)N,0.2197
FC1=COC(=O)C(=N)O1,0.177
C#CC1=CCN(C1)C=O,0.2038
OC1CC1C1CNC1=O,0.2796
CNC1C2OCC12C#N,0.2385
OC1CC11N=COC1=O,0.2244
CC1CC2CC(=O)C1O2,0.2127
CC1CC2(O)C3CN3C12,0.2816
CC1C2CC2C11COC1,0.3146
c1(c([nH]c(=O)[nH]1)N)N,0.2326
OCC(O)(CC#N)C#N,0.3085
CN=C1ON=CN=C1,0.1608
O=C1COC(O1)C#C,0.276
COC1CNC(C1)C#N,0.2665
CC1=CC2OC2CC1=O,0.1865
OC1CN2CC3C1C23,0.2852
OC(CC#N)C(=O)C#C,0.1998
CC(C#C)C12CC(C1)C2,0.3128
CC12CC(O)C(O1)C2O,0.3215
CCC1(C)OC(=O)C1N,0.2491
CC1OC1(C)C(N)=O,0.2635
CC12CC3OC1C23CO,0.2995
CC12NC1C(=O)CC=C2,0.2096
CC12OCC1OC2=O,0.2513
OC1C(CC#C)NC1=O,0.2685
Cc1c[nH]c(n1)N2CC2,0.2446
OC(COC=N)C1CC1,0.2835
CN1C2C3OCOC2C13,0.3049
C#CCCC1(CC1)C#N,0.2954
OCC1C(O)C2COC12,0.2926
CC12OC1CC2CO,0.3231
CC1C2C(C)C(C#N)N12,0.2565
CC1C2C3CC2C3C1O,0.3256
CC1C(C#N)C(C)C1=O,0.2183
OC1CC2NC3C2OC13,0.2891
OC(C#CC#N)C1CN1,0.2023
C12C3C4C3C3C1C2C43,0.3249
C#Cc1[nH]c(=O)on1,0.2028
CCNC(=O)N(C)CC,0.2945
OCC1C2CC(=N)OC12,0.2739
OC1C2CC2(O)C1C#C,0.2802
CCc1c(nno1)C#C,0.2044
CC1CC(C1[NH3+])C([O-])=O,0.2726
CCC1(CC2CC2)CO1,0.3446
C1OC2CC3OC3C12,0.3222
OC12CCC1C2C#C,0.2832
C1C2CCC3=NC=C1N23,0.1861
O=CC12CC(C1)C=CC2,0.2166
CCc1c([nH]nn1)C#N,0.2178
CC12CCN1C(C2)C=O,0.2012
CC1(O)C=CCC11CO1,0.2653
O=C1CNC2CC1C2,0.2076
CC1=CCC(C1)N1CC1,0.2593
CC12CC1C=CC2,0.2478
COC=Nc1cn[nH]n1,0.2051
O=CC12CC1OC(=O)C2,0.23
COC(CO)CC(C)C,0.3168
C1OC2OCC1C1OC21,0.3365
NC1=NC(=N)N=C(F)N1,0.2196
O=CC1CC11CNC1=O,0.2252
O=C1OCC2CCC=C12,0.2129
OCC#CC12CCC1N2,0.2589
OCC1C2OC(=O)C12,0.2693
OC1CC2C3CCC1N23,0.2888
O=C1COC23CC12CC3,0.2046
ON=C1C2NC2C11CN1,0.2317
CC1CC2=C(N1)ON=N2,0.1654
CC1C2CC(CC#N)C12,0.3033
C#CC1NC11C2CC1O2,0.2657
O=CCNC12CC1OC2,0.2004
O=CC1C2CCCC1O2,0.2133
CC1C(CC1=O)C#N,0.2217
OC12C3CC1(O)CC23,0.2947
c1nc(no1)CNC=O,0.2206
O=CNC1COC(=O)C1,0.2673
OC(C=O)C1=NNN=C1,0.2177
Cc1cc([nH]c1C#N)N,0.1922
CC1OC2CC3C2OC13,0.2956
CC(N)(CC1CC1)C#N,0.3009
COC1CCOC1(C)C,0.3202
CN=C1NC(=O)C2NC12,0.2258
CCC1CC(CC#N)C1,0.333
OCC1=CCOC1C#N,0.2536
CC1C(C=O)N1C(C)=O,0.1964
CC12OC3CC1CC23,0.3324
ON=C1CC2(O)CC1C2,0.2576
OC1(CNCC1=O)C#N,0.1907
C#CCCC#CCCO,0.2912
CC12OC(C1C#C)C2=O,0.2384
CNc1cnc([nH]1)CO,0.2228
CCC#CC1CC1,0.2823
C1OC2CC1COCC2,0.3126
CCNc1cc(c[nH]1)N,0.219
CC1CC=C2COCC12,0.2507
C(C#N)NC(=O)NC=N,0.2558
O=CC1C2COCC1O2,0.2216
Cc1c2c(nno2)no1,0.1665
O=CCC1CCC1C=O,0.2167
CC1(O)CC=C2COC12,0.2418
CC1C=CC(O)C11CC1,0.2624
OC(C=O)C1(O)COC1,0.2129
COC1(C)CC2CC2C1,0.3263
COC1C2CCC12,0.3264
CC(O)CC1=NC=CO1,0.2434
COc1cc(=O)cc[nH]1,0.2028
CC(=O)C1OCC(=N)O1,0.2187
O=C1CCC2C3CC3C12,0.2064
C#CC1C2CN1C2C#C,0.2477
CC1C=C(C)CCC1O,0.2618
CCC(=NO)CCCO,0.2545
C1CCC(=C(C1)C=O)N,0.182
OC1C2OC(CC#N)C12,0.2817
O=CC1C2CC3CN1C23,0.186
O=CNC1CC1C#N,0.2682
CC12CCOC1C2O,0.3131
Cc1c(c[nH]n1)C2CC2,0.2432
CCCC1C(C)N1C,0.2873
CC(OCC=O)C1CO1,0.2288
CC1(C)C2C3C2N2C3C12,0.297
CC1OC(C)(C)C11CO1,0.3284
CC12CC1(O)CC(=N)O2,0.2687
N=C1OCC(O1)C#N,0.2655
c1nc(=O)nc(o1)N,0.2149
N#CC1C2CN1C21CC1,0.2621
CN=C1OC2CCC1C2,0.2759
CC1(C)C2N1CC21CC1,0.2976
CC1N2CC1(C2)C#N,0.2728
Cn1ncc(n1)N(=O)=O,0.2074
OCC1OCCOC1=N,0.2736
OC1C2CCOC12C#C,0.2623
CCC1(NCC1=O)C=O,0.1939
CC1COC(=O)C(=O)O1,0.2105
CN=C1CCOC(=O)N1,0.2479
CC1CC=CC(O)C1O,0.2555
CC1CC1C(O)C(N)=O,0.2733
OC12CC3C(COC1)C23,0.3019
C1CCC(CC1)(C#N)N,0.298
CCC1(CC1CO)C=O,0.2319
CC1=CC2COC1O2,0.246
CC12NC1C1(O)COC21,0.2856
Cn1c(noc1=O)C#N,0.1955
OCC(=O)C12CN1CC2,0.2174
OC1(C=CNC1=O)C#N,0.1969
CC1C2CCOC(=O)N12,0.2879
CCC1OC1C(O)C=O,0.2287
CC1NC(=O)NC2CC12,0.2895
N=C1NC(=O)CO1,0.2549
OC1(C#C)C2NC1C2=O,0.2313
CN1C2C3NC3C12C#N,0.2285
C1CC(C1)C(C#N)C#N,0.317
CCn1cc(nc1)NC,0.2171
NC(=O)CC1CC1CO,0.2734
O=C1C2CNC1COC2,0.2098
CC(O)C12NC1C1CC21,0.2744
O=C1CCC2C3CN3C12,0.2021
CC1CCCC(=O)CO1,0.2154
N#CC12CC1CC21CO1,0.2819
Cc1c(cnc(=O)[nH]1)N,0.1597
CC1CC1C([NH3+])C([O-])=O,0.2655
COC1C2OC3CC3C12,0.3035
CN1C2CC=CC(O)C12,0.2311
CCC([NH3+])(C#C)C([O-])=O,0.2657
CC1(C)OC2CCC1O2,0.3282
O=C1CC2CC1OCO2,0.2001
CC1OC2C3CC1C23,0.3135
CC1C2CCCCC1O2,0.3126
OC1(C#C)C2CCC12,0.2728
OC(C#N)C1OC2CC12,0.2803
Cc1c(oc(n1)O)N,0.241
C#CC12CCC1OC2,0.2769
CC1(OC2CNC12)C#C,0.26
N#CC1NC11CCC1,0.2831
CC1CC(C)C(C)CO1,0.3217
CC12COC3C(C=C1)C23,0.2299
CC1(CCCC1)C1CO1,0.3351
CC12CC(O1)C(CO)=C2,0.2334
CC1(CC2CC12)C#C,0.3042
CC(=O)n1c(=O)ocn1,0.2284
CC1CC1OC1CC1O,0.2938
CC(C#C)C(=N)NC=O,0.2279
COc1ccc(nc1)N,0.1816
CC12CCC3OC3C1N2,0.3007
C1C2OC3C2C2NC2C13,0.3026
CC1C2CC3N1C3(C)C2,0.3221
CC1COC2CC2(C)C1,0.2997
O=CC12NC(C=C1)C2=O,0.2086
N=C1CCC(O1)C#N,0.2841
CCC1C(C=O)C1(C)C,0.2235
CC1(OCCO1)CO,0.3231
COC(=O)NC1CC1C,0.3004
CCC1OCCNC1=O,0.2615
O=CNC1CC2CN2C1,0.2525
O=COCC(=O)C1CN1,0.2253
CN=C1C2CC2N1C=O,0.2319
CC(=NCC(=O)N)OC,0.2458
N#CCCC12CCC1N2,0.3033
CCC(OC)C(=N)OC,0.2697
CC1C=CC2CC1(C)C2,0.2527
CNC(=O)NC(=N)OC,0.2693
O=CC12CC(O1)C2C#C,0.2079
CC(C)COC1CC1O,0.3123
CC12CC3COC3C1N2,0.2997
OC1CNC2=NNN=C12,0.2056
OC12C3OC4C1C4(O)C23,0.2829
O=CC#CC1COC=N1,0.2036
C1C2C=CC11C=CCC21,0.2296
CCC1C=CCC1C#N,0.262
CC(C1NC1C)C(N)=O,0.2699
O=C1OCC11CCOC1,0.2714
CC1CC2C(O)C1C2O,0.299
CCCC(=O)C(=O)OC,0.1817
CC1NC(=O)C(C)=C1C,0.2232
CNC(=O)CC#CCO,0.2568
CC12CC1C1C(O)CC21,0.2932
O=C1NC23CN(CC2)C13,0.2287
OCC(C#C)C#CC#N,0.2311
N=C1CC2(CC2)O1,0.2777
c1c(n[nH]n1)N2CC2,0.2248
CC1CN(CCO1)C=O,0.2636
CC1C(=O)CC2CC12C,0.2228
O=C1NCC2COC1O2,0.2515
COC12CC(C1)OC2,0.3168
CC12CC3C4N3C1C24O,0.2823
C(CO)C(CO)(CO)O,0.296
CC1CCCOCO1,0.3339
c1c(c(nc(n1)O)O)N,0.1826
CC1C2CC1(C)C(=O)N2,0.2592
CC12CC1C1(CC1O)O2,0.2835
O=C1CC2C(N1)C2C#N,0.259
NCC1(CCO1)C#N,0.2595
N#CC12NC3COC1C23,0.2378
CC1C2OCC(O2)C1=O,0.2149
CCCCC(=O)OC=N,0.2536
CC1OC(=O)C1C#N,0.2779
CCCCOCC(=O)C,0.2324
C1CNC(=CC1=O)CO,0.1865
Cc1cccoc1=O,0.1787
CC1(OCCC1=O)C#N,0.213
CC1=CNC(=O)CC1O,0.2078
CN(C=N)C=O,0.2424
C#CC1OC2C=CCC12,0.2529
CC1C=CN2N=NC=C12,0.2104
OC1CNC=C(C1)C=O,0.189
NC1C(=N)N2CC12C#N,0.2393
c1cc(c(cc1F)O)N,0.1956
CC1C2CC(C)(C2)C1O,0.3261
C#CC1CC2(NC12)C#C,0.248
CC12CC1C(=O)N2,0.2549
CC12COC(C)(C1)C=C2,0.247
C1CC11CC2(CN2)C=C1,0.2352
CC1C2CC=CC12O,0.2459
OC1C2C3C1CC23C#N,0.2864
CC1C2N1C(C)C21CN1,0.2936
OC1CC2C3CC3C12,0.2973
c1cc(c(cc1F)N)N,0.1995
c1c(nc(=O)on1)F,0.1833
CC(=O)Nc1ncon1,0.2311
NC1(C=CNC1=O)C#C,0.2075
C1C(=NO)C=CC1=O,0.1711
CN1C=C(C)OC1=N,0.2163
CC#CCNC(=O)CO,0.2651
NC1(CCC1[NH3+])C([O-])=O,0.2601
CC1C2C3COCC2C13,0.3381
c1c(c[nH]c1O)NC=O,0.2014
OC12C3C1C1CC3C21O,0.2847
Cc1c(cnc(n1)O)N,0.1789
CN1CC(=O)C1C#N,0.2079
c1c([nH]nn1)CC#N,0.2574
C#CCCC(=O)CC#N,0.2275
CN=C1OC(=O)C2CC12,0.2424
CN1CC2(OCC12)C#C,0.2336
CC1C(C#N)C1N1CC1,0.2859
C#CCNC12CC1OC2,0.26
CC(C)C(O)CC(C)=O,0.2298
CC1(CCCC=C1)C,0.2677
c1c(c(n[nH]1)O)NC=N,0.2143
CC(C)C12C3CC1CN23,0.3095
N=C1ON=C(N=C1)C#C,0.1551
CC1C2CC(=O)C1(C)O2,0.2112
CC(=O)C1(C)OC1C#C,0.2193
c1(c(onn1)N)C(=O)N,0.2059
CC1C2CN=C(C)OC12,0.2756
CC(=O)C1CCC2CC12,0.2286
CCC1=NCCC(=O)O1,0.2482
CC(O)C1NC(=O)C1C,0.2778
CN1CCC(N)C1C#N,0.257
OC12C3CC4C(OC13)C24,0.2894
CC1CC2C3C1C(=O)N23,0.237
CC1(NC1C=O)C1CC1,0.2155
O=CNC(=O)C1CO1,0.2106
CC12CC1C1CC21C#C,0.2407
CC1OC2C(O)C12,0.3036
NC1=C(O)C(=N)C=CN1,0.1746
C#CC#CC1C2COC12,0.2135
COC1CCC2CC12O,0.3317
CC1NC2(C#N)C(O)C12,0.2471
CC1(C)CC2CC2O1,0.3132
CC(N)(CCC#C)C#N,0.2906
CCC1(OC1C#C)C#N,0.2657
CC1(COC1)NCC=O,0.2112
CC1OC2CCOC12C,0.3249
CC12CC=CC1C2O,0.2339
C1OC23CN(CC=C2)C13,0.223
CCC(N=COC)C#N,0.267
C1OC2COCCC12,0.3222
O=C1CC2CCOC2O1,0.2767
CC1(CC1(N)C#N)C#N,0.285
CC1CC2CCC2C1,0.3546
O=CCN1C2C3NC3C12,0.2005
OC1C2C1C1C2CC1=O,0.2056
N#CCC12CC1OCO2,0.2766
CC#CCC(C)C(C)C,0.3011
CC1(CO1)C1(O)COC1,0.3125
C1C=C(C(=O)O1)C=O,0.1755
CCCC1C2OC1C2C,0.3201
C1OC11C2NC2C11CO1,0.2927
CC1C2CN2C1C(C)=O,0.2187
OC1CC2OC=NCC12,0.2643
CCCc1ccncn1,0.212
OC1CC2(C1)COC=N2,0.2584
CC12CC(C1)C2(C)C,0.3609
CCNc1c([nH]cn1)N,0.2222
COC1COC(=O)CO1,0.2617
c1ncn(n1)C=O,0.223
CC1N2CC2(C)C1=O,0.2174
CC12C[NH+](C1)C2C([O-])=O,0.2079
c1c2c(ncn1)CCO2,0.1974
CC1CC(O)C(=O)C1,0.2231
C(C(CO)C#N)O,0.2959
OC1=C(OC=N)N=NN1,0.2202
Cc1cncccc1=O,0.1574
OC12CCCC3OC1C23,0.29
CN=c1[nH]c(no1)C#C,0.1731
CC1CC2=CCCCC12,0.2553
CN1CC(C)=CC1C#N,0.2287
OC12CC(C1)CC=CC2,0.2716
c1cc(=O)c(=O)onc1,0.1584
c1c(cnc(n1)N)C=O,0.1862
CCC1CCC2(CO2)C1,0.3282
CC(CO)C(O)CC#C,0.3044
CN1C2C3OC(=N)C1C23,0.2296
C1CN=CNC(=O)N1,0.2413
CCC(CCO)C#C,0.3091
C1CC11C=CC2CCC12,0.2437
CCC1CN1C(=O)C#C,0.2153
N#CC1COC(O1)C#N,0.3024
C(N1CC1)C12CC1CC2,0.3004
OC1C=CN(C=N)C1=O,0.1981
CC1N(C)C(C)C1=NO,0.2114
NC1=CC(=N)NN=C1O,0.158
COC1(C)CC(C1)=NO,0.2489
CC#CCn1cccn1,0.2609
CC1C2NC2C2CC12O,0.3053
ON=C(C#C)C1CCO1,0.2038
N#CC1OC=NCC=C1,0.2392
OC1CCCC=C1C#N,0.2246
CCNc1c(cn[nH]1)C,0.2331
CC(=O)C(CC#N)C=O,0.2055
OC1C=CC2OC12C=O,0.2146
CC1(CO1)C1OCC1O,0.3197
CC1=CC(=NO)CN1,0.1752
CC(=O)N1CCC1,0.2674
CC1COC2CCC=C12,0.2525
CN=CNc1conn1,0.1908
CC(C#C)C1=CC=CN1,0.2395
CC12CN1C(=N)OC2,0.285
OCCC1CC1NC=O,0.2742
c1c(cn[nH]1)NCC#N,0.2213
CC1(C=O)C2CC1C2,0.2221
O=C1OCC11OCC=C1,0.2298
O=C1OCC23CC(N2)C13,0.261
CC1OCC2CCC2O1,0.3196
CC1=CC2CC1(O2)C#C,0.2338
COC1C=C(C)C2NC12,0.2379
CC1=CC(=N)C(N)=NN1,0.1742
CC1C(=O)CN2CC12C,0.2038
CC1OC2CC(=N)OC12,0.2836
CN1C2C3OC2(C=O)C13,0.1885
c1coc(c(c1=O)N)F,0.1753
COC1(C)C2CC=CC12,0.2409
O=C1CC2C3CC12OC3,0.2283
c1cc(oc1)OC(=O)N,0.2392
C1NC1C1=CC=CC=C1,0.2318
C1CC2=CCOCC2O1,0.2533
CCC#CC#CCOC,0.2155
Cc1cc(oc1C#N)N,0.1866
O=CC12NC1C1CC2C1,0.2208
OC12CCC1C(=O)NC2,0.268
CN1C2CC1C2C(C)=O,0.2039
COC(=O)CC(O)C#C,0.2764
C#CC1(COC1)C1CO1,0.2873
CC12CC(O)(C=O)C1O2,0.2137
OC1CC(=O)C2OCC12,0.2013
NC(=O)C1CCNC1=O,0.2595
COc1cc(no1)O,0.248
CCCC1(CCO1)C=O,0.2111
CC1C(N1C)C1(C)CC1,0.3081
CC1CC1C1(C)CCO1,0.3228
CC#CC(=NO)CO,0.202
CC1NC(=O)N(C)C1=O,0.2546
CC(=N)OC1CC1C#N,0.2908
OCCC1OCCC1O,0.3048
O=CCC1C=CC2CN12,0.2121
CC1CC(C1)NC(N)=O,0.298
NC1=NC(C#C)C(=O)N1,0.2362
CN1CC2(C1)CN2,0.2882
CC(C)C1CCC(=O)N1,0.2733
N=C1NN=NC(=C1)C#N,0.155
O=CC1=CC2CN2C1=O,0.1617
CC12OC(C=C1)C21CN1,0.2322
O=CC1CC(C1)N1CC1,0.2231
C(C1CO1)N1C2CCC12,0.3288
CN1CCC(O)(C1)C#N,0.241
c1c[nH]cc1C2(CC2)O,0.2458
CN1CCCC(O)C1=O,0.2605
N#CC1COCCO1,0.2688
OC1C2CN2C2CC1C2,0.2903
COC1CC2(CC2)C=C1,0.2455
CC1(C)C2CC1(O)CO2,0.2988
COc1cccnc1O,0.2026
CC1(C)CC(C)(N1)C#N,0.2727
c1c([nH]c(=O)[nH]1)N,0.2338
CCc1cncn1CC,0.2436
CC1OC2CC3CC3C12,0.3206
CC1(CC1)O,0.327
C1C(=O)COC(=O)CN1,0.203
CC1CC2CC2CC1=O,0.2245
OCC1CC11CC(=O)N1,0.2762
CCCOC(C)(C)C,0.3248
NC1C2OC1(C#N)C2N,0.2438
CC(C#C)C#CC(N)=O,0.2335
N=C1OC2(CCC12)C#C,0.2714
COCCn1ccnn1,0.2576
CC12CC1OC21CC1,0.3039
NC1(C#N)C2CC1CC2,0.2914
CC1NC1C1CN1,0.3023
c1ccn(c1)CC2CC2,0.2455
CCC(C)OC(=O)C#N,0.2464
OC1C2CC3OC3C1O2,0.2986
CCC(=O)C(C)C#C,0.2253
OCC1C2CC2C1O,0.3017
CC12OC1C(C)(O)C2O,0.3197
OCC12CC1(O)C(=O)C2,0.2305
CC1OC=NC2CCC12,0.268
N#CC12CC3CC(N1)C23,0.2547
CC12CCOC1CO2,0.3264
C#CC1COCCC=C1,0.247
N=C1OC2(CCC2)C=C1,0.2072
c1c2c(no1)C=CC2,0.2155
CC(=O)CNC(=N)C#N,0.2129
COCC1(CO)CCO1,0.3082
NC1=NC(CC1O)C#N,0.2557
CC12CC1C1(CCC1)O2,0.3068
CC1OCC2CC(O)C12,0.3095
CN=C1CC(C)N1C=O,0.2247
CC12CC3C(O1)C3OC2,0.2973
[O-]C(=O)C1C2CC(=[NH2+])N12,0.2626
CC1CCC2(CC2)C1=O,0.2223
CN1CC1(C)C#CC#C,0.2163
CC(=O)C1(C)CC2CC12,0.2241
c1c(onn1)NC(=O)N,0.2141
OCC1(O)C2C3OC3C12,0.2801
CC1(C)CC(O)C2NC12,0.3099
C#CC1C2CN3CC1C23,0.2478
CC(C)C1(CN1)C=O,0.2232
CC1COC(C=O)=NC1,0.194
CCCC1(C)CC1OC,0.3175
COc1c(nc([nH]1)O)N,0.2294
C#CCOC1C2COC12,0.265
CCC(N)(C#N)C1CO1,0.2881
OC1CC1C1CN=CO1,0.249
N1C2C=CC3C4NC23C14,0.1694
c1c([nH]nc1N(=O)=O)N,0.1686
C1CC23C4CC12CC3O4,0.2867
C1OC2CC3C=CCC123,0.2556
CCC12CC1OC(=O)C2,0.2784
Cc1cc(cnc1)C#N,0.2105
CC(C=O)C1(C)CO1,0.2215
CC1=COC(=N)OC1=O,0.2019
CN1CC1CC(=O)CO,0.2042
CC(=O)NC1CN(C1)C,0.2516
CCOC1(CC1)C(C)O,0.3115
CC12COC1C1OCC21,0.2796
CC1C2C3C2C2C3CC12,0.3241
CC12CC3C4CC1N4C23,0.2808
CC12CC1(C)C1CC1C2,0.3336
C1CN1C(=O)C(=O)C=O,0.1411
CC1NC(=O)CCC1=O,0.215
CCC1C2OC2C1=NO,0.2448
CNC(=O)N(C)CC#C,0.2757
CC1OCC1(O)CC#N,0.2752
OC12CCN3C4C3C1C24,0.2757
OCC1CCN1C=O,0.2665
CCC12NC1(C)C1CC21,0.3386
OCC1CCC11COC1,0.3123
OCC(CCC#C)C#N,0.2898
CC12CC3C=CC1(C)C23,0.2346
COC(C)C1C2CN1C2,0.3128
CCC(OC)C#CCO,0.2869
CC1CC23OCC2CC13,0.298
[NH3+]CC1OC1C([O-])=O,0.2584
C1CC1CC#CCO,0.2749
CC[NH+](C)CC([O-])=O,0.2642
FC(F)(F)C1OC1C#N,0.3024
CC(=NCCO)OC,0.266
CNC12COC1C1NC21,0.2765
Cn1cccc1C(=O)N,0.2044
C1NC1C12CC(O1)C=C2,0.2355
NC(=O)C1NCC11CO1,0.2611
C1COC(=N1)C(=O)C#N,0.1605
N#CC1C2CCC1N2,0.271
CC(=N)OCCO,0.2984
OCC12CC1CCO2,0.3172
CCC#CCC(C)C#N,0.2856
C1C=CNC(=O)C1=NO,0.1756
C1C=CC2C=CC3C1N23,0.2249
C1C2C3COCC1OC23,0.2969
CC#CCC1(CC1)C#C,0.2898
OC1C2CC(=O)CNC12,0.2143
O=C1CC2OC(C#N)C12,0.2146
C1C2C3C4C5C(C1N25)N34,0.2678
O=CCC1OC1CC#C,0.2244
CC1(CN1)C1=NC=CN1,0.2444
C#CC1(CN=CO1)C#C,0.2551
CC1CCC2C1OC2=O,0.2792
CCC1(CC(N)=O)CO1,0.2692
CC1C2C(=O)C(O)C12O,0.2143
CN1CC1C(C)(C)C,0.2903
CCC#CC(C)C#CC,0.286
CN1CC(O)C1(C)C=O,0.1814
C1C(=O)NC(=N1)CCO,0.2348
CC1(CC=O)NC1CO,0.2086
Cc1c(cc(o1)C#C)O,0.1786
C1C2CC1C1=CC=NN21,0.2472
O=C1CCC2CC1C2,0.2274
CNc1nc(no1)CO,0.2425
OC12COC1CN1CC21,0.2953
CC(C)(C=O)OC=O,0.2242
CC1OC1(C)C1(C)CN1,0.3218
CC1(C)C2NC2C1C=O,0.2067
CN1C2CCOCC12,0.3034
NC1=NC(=N)OC(F)=C1,0.1923
CCC(CO)(C#C)C#C,0.2925
CC1(CCC2(C1)CC2)C,0.3358
C[NH2+]CC#CCC([O-])=O,0.1889
OC(C#C)(C#C)C1CO1,0.2762
CC12CC3C(CC13)C2,0.3624
CCC(C)C(=O)C(C)C,0.2257
C1C=CC23CC=CC12O3,0.2381
C1C2NC2C2=NC=NN12,0.2532
CCN=C1NC(=N)CO1,0.2436
FC1=CNC(=N)C=N1,0.1396
NC1=CC(=NO)C2OC12,0.1762
CC12OC1C(C)(C)C2=O,0.2106
CC12OCC3CC1CC23,0.3246
CC1CC2NC12C(C)=O,0.2104
CC1(C)OC1C(N)C#N,0.2844
CC1=CC2(O)CC2C1,0.2442
CC12NC(=O)C3C1OC23,0.2404
CC1CN1C1(CC1)C#C,0.2612
CC1CC(O)C2C1N2C,0.2903
Cc1ccoc1N(=O)=O,0.1774
O=C1COC1C#CC#N,0.2066
N=C1NC(=O)C(=C1)C#C,0.1688
CC12CC1(C)C1CC21,0.3361
Cc1c(coc1N)CO,0.2361
c1c2c([nH]n1)OC=NC2,0.2183
CCc1ccncc1F,0.2274
O=C1OCC11NC1C#C,0.2461
N=C1OC2CC2OC1=N,0.2132
C1COC=NCC1=NO,0.2454
COCC#CCOC=O,0.2627
CC(C)CC(=O)N,0.2784
O=CC1CC1(C=O)C=O,0.1834
CCC1(CC1)OC(=O)C,0.2764
OC1CCC(=O)C11CO1,0.2054
ON=C1C2C3CC1(O)C23,0.2571
COC(=O)c1ncno1,0.2216
Cc1cc(=O)[nH]c(n1)F,0.2055
CCOc1ccccn1,0.2111
OCC12COC3C1CC23,0.3019
O=CN1C=C2CC3C1C23,0.1442
CC12OCCC3C1CC23,0.3324
COCC1N=CNC1=N,0.2215
C1C=C2CCCC3C1C23,0.2354
C1CC(C1)CCCCO,0.3425
OC1CCC11CC(=N)O1,0.2894
CC1(CN=COC1)C,0.2713
CC(O)C(C=O)C#C,0.2201
C1C(=NCC=O)NC=N1,0.2112
CNC(=N)C#N,0.2121
OC1C2OC(=O)C1C2O,0.2669
Cn1cc([nH]c1=O)CO,0.2166
CC1(COCO1)C=O,0.2166
N#CC12CN3C1C=CC23,0.2084
N#CC1COC(C1)C#N,0.2999
CC12OCC1C2(C)C#N,0.277
CC1C2C3OC2C(=O)C13,0.2107
c1cn2cc(nc2[nH]1)N,0.207
CC#CCc1[nH]ccn1,0.2533
CC1(C#C)C2OC(=O)C12,0.2458
CCC1OC2C3CC3C12,0.3062
CC1C2COC(=O)NC12,0.2895
CN1C2C3NC2(C=O)C13,0.1757
CN=C1NC2CCC12O,0.2509
CCC1N=CNC1=N,0.2273
CC(=O)C12OC1C1OC21,0.2165
NC(=O)CC12CC(C1)C2,0.2769
C#CC#Cc1cc[nH]c1,0.185
CC(O)C1=CNC(O)=C1,0.241
CCCC(OCC)C#N,0.3034
CCC1(C=O)C2CCN12,0.2171
CC1OCC=CC1=O,0.1772
CC#CC1(O)CC1C#C,0.2568
C1C=CCN1C(=O)C=O,0.1728
OC1CC=CC(O)C=C1,0.2333
OC1(COC1=N)C1CC1,0.2815
CC1C(O)C1C#CCO,0.2666
OCCC1(CN1)C#C,0.2849
C1C2C3C4C3C1OCC24,0.3192
COC1C2C1C(=O)N2C,0.2476
Cc1coc(cc1=O)F,0.2067
c12[nH]nnn1c(nn2)O,0.1825
CCOCC(C)O,0.3364
CC1C2C(O)CC(C)N12,0.283
CC12CC(CC1)O2,0.3293
O=CN1CC2CC(C2)C1,0.2665
CCCCC(C)C(C)C,0.3755
CC12OC3(CO)C1NC23,0.2932
Cc1cccncc1=O,0.1541
CC1=CC(=O)C(O)CC1,0.1818
CC12CC3NC3C1C2O,0.2802
O=C1OC2CCCC2O1,0.336
CC(CO)OC(=O)CO,0.2731
CCOC1C(O)C1(C)O,0.2971
OC1CC11CC2(CC2)O1,0.282
CC1N2CCC2C1=NO,0.2157
N=C1OC2CC3CN3C12,0.257
OC1CC2C3CC1C2O3,0.3103
CC#CC(O)(CN)C#N,0.2479
CC1CC1C(CO)C#C,0.3005
CC1(C)OC(=N)NC1=O,0.2525
Cc1c(c(=O)[nH]nn1)N,0.1714
CCC(C)(C)C(C)C,0.367
CCC1CCOCC1=O,0.2092
CC(=N)OC(C=O)C#C,0.2214
CC12CC(C3CO3)C1O2,0.3266
O=CCC12CC3CC1N23,0.2166
CC1NC2CNC12C#C,0.2478
CC1C2OCOC1C2O,0.2995
NC1(CC#C)COC1=N,0.2648
CC1C2C3C(C)C1(C)N23,0.31
c1cn(nc1O)C=O,0.2049
Cc1[nH]c2c(n1)COC2,0.2334
CCCc1conn1,0.2308
C1CC1C2(COC2)CO,0.3038
CN1CC1C(CO)C#C,0.2716
c1[nH]c(c(n1)O)CO,0.2226
COC1CN2CC=CC12,0.2373
OC(C=O)C1CC(=O)C1,0.1956
CC1C=C(CO)C2CC12,0.2462
CC12CC1N1CC1CO2,0.2991
C1OCC11C2CCCN12,0.2992
C1Cc2c(noc2N)C1,0.2216
C1OC1C1C2C3NC3C12,0.2777
NC(C#C)C1=NC=NO1,0.2331
Cn1cc(cn1)C#C,0.225
CCC(C)C(=O)CO,0.2381
OC12CCC1OC2=O,0.2631
CC1=NON=CC1=N,0.1877
CC1OC(=O)CCC1=O,0.2206
CC1COC2(CC2O)C1,0.3002
C(=O)c1c(nno1)N,0.1639
OCC12CC1CC=C2,0.2503
CC1=CC(=N)C=NO1,0.1828
CC#CC1C2CCN12,0.2604
OC1CC(CC=C1)C#C,0.2575
C#CCC#CCCC=O,0.2213
CCN1C2C(C)C2C1=O,0.2472
CC1C(O)C1(C)N1CC1,0.2943
CN1CC2NC(=O)CC12,0.258
CC12CC(O)CC1O2,0.3197
CC1(C=O)C2CN2C1=O,0.1998
C[NH2+]CC1=C([O-])ON=C1,0.2327
CCOc1c[nH]cc1O,0.2406
N=C1OC2OC1CC=C2,0.2457
C1CC(C1)N=C(C#N)N,0.2159
N#CCC1CC2CC1O2,0.2996
ON=C1COCC1O,0.2505
C1CCC2OC3C(C1)C23,0.3112
CC1C(C)C1C1CC1,0.3244
CC#CC1(C)CC1C#C,0.2663
NC1C2CN2CC1C#N,0.267
CC12CC34OCC(C13)C24,0.3181
CC1OC(C#C)C(=O)O1,0.265
COCC1(CO1)C=O,0.2215
OC1C2C1N1CC(=O)C21,0.1987
CC(C#C)C1C2CC1C2,0.3137
C1C2OC34CCC23N1C4,0.2533
Cn1cc(ncc1=O)N,0.1371
C1C2CC=CC=CCC12,0.2221
Cc1c(nn[nH]1)C=O,0.204
NC(=O)C#CC1CCO1,0.2339
c1coc2c1CC(=O)C2,0.1976
c1c(nno1)CC#N,0.236
Cn1ccnc1OC=O,0.2125
CC12NC1C1(CO)CC21,0.2787
O=CC1CCC(O1)C#C,0.219
CC12CCC1CCCC2,0.3487
CC(C)OCC(=O)CO,0.2376
CCC1(C)C2C3NC3C12,0.273
CC1(C)C2NC2C1(C)C,0.3096
CN=C1OC(C)C=C1,0.2066
C#CCCC1CC1C#N,0.2932
OC1CC1C1=CN=NN1,0.2402
CC1CC2CCC12C,0.3366
CN=C1OC2C(C)C12C,0.2708
CC(CO)C#N,0.3246
N=COC12CC1C1NC21,0.2427
C12C3C1N1C2C31,0.2821
COC1CC2C3NC3C12,0.2895
CC12C3C4OCC1C4N23,0.323
CCC12CC1OC2=N,0.2796
CC1C2C=CC11CCC21,0.2261
OC1=CN=C(O)C(=N)O1,0.1586
CC1C(=N)OCC1(C)O,0.2847
CC12OC1(CC2O)C#N,0.2634
CCC1N=CNC1C#N,0.2445
OCC1C2C(O)C1C2O,0.317
CC1(C#N)C2C3CC1N23,0.2936
CCC(C)(CC=O)C=O,0.2102
CCCC12CC1C1OC21,0.2906
O=CCN1C2COCC12,0.2159
OC1C2CC1(CC2)C=O,0.2182
CC(O)CCCCC=O,0.2288
NC(=O)NC1CC1C#N,0.2689
c1cc(nc(c1N)N)F,0.1889
C(CC(=O)CCO)CO,0.2354
CC1NC1C1C2CCN12,0.2881
CC12CC(O1)C2C(N)=O,0.2593
CC(C)(C1OCCO1)O,0.3247
COC1CNC(=O)NC1,0.2987
N=COCC(=O)CC#C,0.2182
CC#CC1(CC1C)C=O,0.2225
CC12OC1C1(C)C(O)C21,0.2839
NC(=O)C1=CC2NC2C1,0.2074
CC(=O)C12OC1CC=C2,0.2191
CC12NC1C1CC21,0.2846
CCCC#CCC#CC,0.2874
Cc1[nH]c(=O)nc(n1)F,0.2135
c1c(onc1C#N)CO,0.2235
CN=C1CCC(O)CO1,0.2635
Cn1c(ccc1N)C#C,0.1875
CC1C2NC2C2OCC12,0.2963
CC(CO)C1=NCCO1,0.2707
c1c(nc([nH]1)CO)C=O,0.2052
CC1CC2OC3C2OC13,0.2993
OCC1OC(=O)C1C=O,0.2225
COC1COCC1C#N,0.2984
OC1CCC2CN2CC1,0.2858
CC12CC(CO1)C21CN1,0.2987
CC(C)C1CC2CC12C,0.322
CCC(CO)C(C)(C)O,0.3266
c12nnnn1nno2,0.2119
CN(CC#C)C(=O)C=O,0.1762
CC1(C)NC2C1OC2=N,0.2552
CC1CC=C(C)C1=NO,0.1947
CC12CC1(N)C(=O)OC2,0.2549
C[NH2+]CC(C#C)C([O-])=O,0.2743
C#Cc1cccnc1,0.2017
OCC1CCC1CO,0.3324
C1C2CCC3=C2N1C=C3,0.1937
NC(=O)OC1CCOC1,0.3013
NC12C3OC(C13)C2C#N,0.2605
OC12CCC11CC(C1)C2,0.3317
O=CC1OCCC(=O)O1,0.2185
CNC1C2NCC12C#N,0.2378
CC#Cc1[nH]ccn1,0.2034
CC(OC=O)C(=O)CO,0.2326
COC(C)(CC#C)C#N,0.2849
CC1=C(F)C(=N)ON=C1,0.1722
CCC12CC1(C)NC2=O,0.2515
CC1CC2(CC12)NC=O,0.2685
O=C1C2CC2OC1C#C,0.214
CC1C(=O)CC1(O)CO,0.2209
C[NH+]=C(N)C(N)C([O-])=O,0.2175
O=C1CC2C3OC3CC12,0.2231
CC1COCC11CC1,0.3276
c1(c(onn1)N)C(=N)N,0.2007
C#CC1=NCCO1,0.2173
c1c(c(on1)N)OC=O,0.2147
C#CC1=NCC2(O1)CC2,0.2077
[NH2+]=CNC[C-](C#N)C#N,0.1864
ON=C1C2CC3C2C13O,0.2507
C(C#N)c1noc(=O)o1,0.2658
CN1CC1C(C)=O,0.2032
CC(O)C1OC(C)C1C,0.3081
CCC1C2CC2C1OC,0.3205
C#CC1CC23CC(C2)N13,0.2431
c1nc(c(o1)CO)C=O,0.1959
NC(=O)C1=CNC(=N)O1,0.1817
COC1CC11OCC=C1,0.2251
CCC1(CO)CC(=O)O1,0.2841
C#CC(=O)c1c[nH]nc1,0.1944
CC1(C)C2CC3C(C2)N13,0.3199
OC1CC11OCC11CO1,0.2903
C1CC23CC(OC2)C13,0.3006
CC1(OCCCO1)C,0.3371
COC1COCCC1=O,0.2122
CCCC12CC3C(C1)C23,0.3246
C(CO)NCC#N,0.2708
CC1CC2(C)CC2C1C,0.3247
c1c(con1)NC2CC2,0.2039
O=CC1C2CC2CC1=O,0.2103
CC1CC1(C)C(O)CO,0.3093
CC1CC(=O)NC(=N)O1,0.2439
CC(C)C1N=COC1C,0.2667
OC1C(COC1=O)C#N,0.2724
CCOC1CC2(C)NC12,0.2999
CC1CCC2OC12C#C,0.2765
N=COC(=O)C1CCN1,0.2097
C1C=CC2C3OC1C23,0.2389
c1c(c(c([nH]1)N)C=O)O,0.1592
CC12CC(CC1N2)C=O,0.2224
Cn1cc(oc1=O)N,0.2331
C1OC1C1C2CC1O2,0.3222
OCCC1NC1CC#C,0.3037
C(CC(=NO)CO)C#N,0.2469
CC(CCC#C)CC#C,0.3084
CC1C(=O)CC1(O)C#N,0.2219
Cn1c(cnc1O)N,0.245
COCC(C=O)(C=O)O,0.197
CC(=O)C1COCC1=O,0.2123
OC1C2C1C1C2OC1=O,0.2597
CCC12CN1C(C2)C#C,0.2704
CC(=O)NC(=N)CC#N,0.2447
CCCC1C(C)C1C=O,0.2246
CCNC(=O)C(=O)C#C,0.1603
OC12CC=CC1C1OC21,0.2639
OC1(CCC11CC1)C#N,0.2912
CC(O)C(C)(CO)C#C,0.2941
O=C1NC23CN(C2)C13,0.2177
CNC1(CN(C1)C)C=O,0.1845
CC1C2CC3C(N23)C1=O,0.2211
CCC12CCCC1O2,0.3392
CCC1CC(O)C1C#N,0.2989
Cc1c([nH]cn1)CO,0.2402
CC1(O)C2C3CN=C1N23,0.1913
Cc1cc(=O)[nH]c(=O)[nH]1,0.2102
O=CC1OCCC1C#N,0.2206
CC12CC(C1)C(=C2)C#C,0.1908
C1CCC(C1)(C(=O)N)O,0.2776
CCNC1(CC1C)C#N,0.266
Cn1cc(c(n1)OC)O,0.2239
CC1CCC2C(C#N)N12,0.2623
c1c(ncn1C2CC2)O,0.2245
CC1=CC2(CC2C1)C#N,0.2423
COCC1C2CCCC12,0.3274
CC1C2(O)C3NC2C13O,0.2822
CC1CN2CC2C1(C)O,0.2944
CC1C2CC2OCC1O,0.3275
c1c([nH]c(c1N)O)C=O,0.1701
CN(C)c1cccnc1,0.1869
OC1(C#C)C2CC1OC2,0.2636
COC12CC(C1)C2=O,0.237
CCC1CC1(C)OC=O,0.2742
C(C#CC(=O)NC=O)O,0.1994
CCC12CC1CC2C#N,0.2994
CC1=CCOCC(O)C1,0.2464
CN=C1OCOC1C=O,0.214
OC1C2CCC2C1=O,0.2097
CCOC(=O)CCC#C,0.2746
CC1OC1(C)C1COC1,0.3167
CCC1C2COC12C#N,0.2517
OC1CCC(=CC1)C#N,0.2251
OC(C#C)C1CC2CN12,0.2624
N#CC1CCCN=CO1,0.2546
CCC1(O)CC1(C)CO,0.3179
CC(=O)CC1C2CCC12,0.2278
CC1C(CO)CC2CN12,0.2928
CC1=CCCC(=O)C1,0.2236
Cc1c(c([nH]c1N)O)C,0.2267
CC1C(O)C=CC1(C)C,0.2608
N=C1OCC2CN12,0.2857
CCC1C2C=CC(=O)C12,0.1847
CCOc1[nH]ccn1,0.252
CNC(=O)N(C)C(=O)N,0.2645
CC12CC3CCCC1C23,0.3208
CC1COCCC(=N)O1,0.2769
Cn1ncc(n1)NC=N,0.2127
C1C2C=CC3=C2N1N=N3,0.174
CC1C2CN2CCC1O,0.2707
CC1=CC2C3OC1C23O,0.2275
CC1=CNC(=N)C(O)=N1,0.1592
CCC1=NC(C)C(=N)N1,0.2286
CN1C2C(N)C2(O)C1=N,0.2372
O=CC12CN(C1)C21CC1,0.19
CC1C2C3OC1CC23C,0.3205
CC1CC(O)C2(C)CC12,0.3266
CC12OC3COC1(C)C23,0.2918
CCCn1ncnn1,0.2663
C1C2C3N2C1C31COC1,0.3134
CN1C2C3NC3C12C#C,0.2301
CC(OC=N)C#CC=O,0.2029
CN(C)c1c([nH]cn1)O,0.2085
c1cc(c(nc1)C=O)O,0.1768
NC1=C(F)C=NOC1=N,0.1636
CC12CC3CC(C)(C1)C23,0.3408
CNC(=O)C(C)C=O,0.2047
CCC(=O)NCCC=O,0.2222
CC1(CO)NCC1=NO,0.2293
C#CCC#CC#CC#N,0.1922
CCC1OCC1CC=O,0.2224
CC(C)(C(=O)N(C)C)O,0.2671
C1NC1C12C3C4C(C13)N24,0.273
c1c2c(cn[nH]2)[nH]c1O,0.2129
COCC(CO)C1CC1,0.3301
N#CCC1CCC2CN12,0.2817
CC1CC2CC2(N1)C#N,0.2607
Cc1coc(cc1=O)O,0.2058
OC12CC=C3C4C(C14)C23,0.1638
C1CN1CC(=O)C(=O)N,0.174
N=C1CC(OCO1)C#C,0.2692
CN1C2CC(O)C1C2=O,0.2334
O=CC1CC2NC12C#C,0.2027
OC1(CC1C#N)C1CC1,0.2912
OCCC1CCC2OC12,0.3348
OC1CN2CC=CC12,0.2255
CCCC(N)(CO)C#N,0.2866
CC12C3CCN(C13)C2=O,0.2419
CC1OCC(N)=CC1=O,0.1913
NC(=O)C1CC11COC1,0.2627
O=CC12OC3C4C1N4C23,0.2158
OCCC1CCNC1=O,0.2706
CN1CC1C1OCC1=O,0.1918
OC12CC3CC4C1C2N34,0.2861
CCC12CC1C(=O)C2O,0.2151
CCC(CO)C(=O)C=O,0.1522
COC1C2CC(O)C12C,0.3169
CCC(O)C1CCCO1,0.3279
CC(CO)COC(N)=O,0.3236
O=C1NC2=CCC3C2N13,0.1889
CC1OC(=N)CN2CC12,0.2612
CC1OC1C1CCC1O,0.3197
O=C(C#C)C1C2CN1C2,0.1746
c1nnnn1C=O,0.2166
CC1C(C)C1(CO)C#N,0.3033
CC1CC1NC(C)=O,0.2704
CC1C2CC(O2)C1CO,0.3183
NC1=CC(=O)C2OC2C1,0.189
CN(C)C(CC#C)C#N,0.2583
CC1(OCCO1)COC,0.3277
OC1(CC1CC#N)C=O,0.2216
CC1CC=CC11CN1,0.2462
C1CCOC(=NC1)CO,0.2632
CCC12C3CC1OC23C,0.3061
N#CC1CN=C(O1)C#N,0.2259
O=CCCC12CC1CO2,0.2195
CC1C(C=O)C11COC1,0.2212
C#CC1C2CCCOC12,0.2639
O=C1CC2OC3CC3C12,0.2129
CC1C(OC1=O)C1CN1,0.2581
Cc1c(n(cn1)C)OC,0.2414
C1CCC2(CC2)OCC1,0.32
C1NC11C2NC1C=C2,0.2184
N#CC1OC2CCOC12,0.2681
CC12CC3OCC1(O)C23,0.3005
CC1(OCC1CO)C=O,0.2122
CC(C)C1OC1CC#C,0.3068
CC1OCC1C(=O)C=O,0.1503
N=C1NC(OC=O)=NO1,0.1979
N#CC12CCC1N2,0.2902
O=CC1CC(O1)C1CO1,0.2197
O=CC1OCC2CC12,0.2249
CN1CCNC(=O)C1,0.2563
O=CC12NC3C4C1N4C23,0.1951
N#CC(C1CO1)C1CO1,0.3059
CC1C(C)(O)C1(C)O,0.3041
CC1=C(C(=O)CC1=O)N,0.1648
COC1C2OC2C1OC,0.3107
CNC(C=O)(C#C)C#N,0.1885
CCC1CC11CNC1=O,0.2797
C1CC1C1C2C3OC2C13,0.3082
OCC12C3OC1C1C3N21,0.3008
Cc1cc(ncn1)C=O,0.1713
N=C1OC=C(C=O)N=C1,0.1606
Cc1nc(cc(=O)o1)F,0.1978
CC1C2C3CC2C13C=O,0.2131
Cc1c(nno1)C(C)C,0.2248
c1nc([nH]n1)CN2CC2,0.2675
CC1CC1(C)C(C)=O,0.2314
COC1=NOC(=N)C=C1,0.1633
CC12C3CC4N(C13)C24C,0.2989
CCC(=O)OCC(C)O,0.2818
C#CCc1c(cco1)N,0.2139
Cn1c(=O)[nH]nc1OC,0.2572
NC1COC1=NCC#N,0.257
O=CC(C1CC1)N1CC1,0.2215
CC1C2CC1C2(C)C#C,0.3002
CN=C1OC(C)C1CO,0.2756
N=C1CN=COC(=O)O1,0.2522
OC1(CC=O)CC1C#C,0.2197
COCC(O)C(=O)C#C,0.192
CC1OC2C(O)C12O,0.2945
CCCC1(O)CCC1O,0.3227
CC1CC(C#N)C2CC12,0.3264
CC(C)n1cc[nH]c1=O,0.2308
OC1CC2(OCC12)C#N,0.2727
CC(C)N(CC#N)C=O,0.2674
CC12CC1C1(CO)OC21,0.2929
OC12CN3C4CC1C4C23,0.2744
COCCCOCC#C,0.2863
COC1(COC1C)C#C,0.2792
C1OC2CCOC1CO2,0.3252
OCC12CCC3CN1C23,0.3165
CCC1(CN1C)C#C,0.2734
C#CC12NC1CC=C2,0.2319
N=C1CCOC2CC2O1,0.2629
CC1C2OC2C=C1C,0.2409
c1c[nH]nc1N(=O)=O,0.2059
N#CC1NCC2OCC12,0.264
COC1COC1C1CO1,0.3106
CC12CC3(C)C(CC13)C2,0.3503
O=C1NC2C3C2C2C3C12,0.2572
O=C1OC2C3CC12NC3,0.2433
c1c(c([nH]n1)O)CO,0.2495
CC1=CCCC12CCC2,0.2559
N#CC12CCC1=CCN2,0.225
CC1=C([O-])OC(C[NH3+])=C1,0.1515
CC(C#C)C1(CN1)C=O,0.2219
OC1C2NC2(C#N)C1O,0.2583
CCN1CCC(C)C1=O,0.2702
COC1CC1OCC=O,0.2225
O=C1NC(=CO1)C1CN1,0.2311
O=CN1CC(C#C)C1=O,0.2129
CC(O)CCC(=O)CO,0.2421
OC12CC1C1(NC21)C=O,0.1876
CC(NC(N)=O)C(C)=O,0.2199
C1CC23OC4CC2CC134,0.2955
CC1CC1C(C=O)C#C,0.2185
O=C1NC2(CC2O1)C#C,0.2679
CC12C3C1C1C3C21C#C,0.2443
CC(C#N)N1CCC1C,0.2676
CC(O)C1CC1(O)C=O,0.2227
CC1C2CC11CC=CC21,0.2554
c1c(onn1)OC(=O)N,0.2325
OCC1=C(O)OC(=N)O1,0.2382
CCC1(CC1)C1CC1O,0.3161
N=C1OCC=C1C1CO1,0.2133
CC(O)C(CO)C(C)O,0.2973
OCC1OC1C(=O)CO,0.2281
NC1C(O)C(=N)NC1=N,0.2334
CC12NC1C(=O)C2C#C,0.2089
CC1(CCC1)C=O,0.2247
CC1(CC2(O)CC2)CO1,0.301
CC12CC1C1CN1C2,0.2977
CC1C2C3C4C3N2C14,0.2979
CC1=NOC(C[NH3+])=C1[O-],0.1563
CCC12NC1C(=O)C2C,0.2158
CCC1=CC2OC2(C)C1,0.2403
OCC(OCC#N)C#N,0.2762
CN1C=C(CC1=O)C=O,0.175
CC12CC(N1)C(=O)C2=O,0.1469
COC1C2C3CC1C23,0.3285
CC12NC1C1C2OC1=O,0.2532
C1CC12C(=O)C3(N2)CC3,0.2065
CC1=CC2C(O)CN2C1,0.239
COC=NCCOC=O,0.263
OC1C(=O)NC=C1C=O,0.1832
CN=C1ON=CN=C1C,0.1656
CN1CCC(O)C(=O)C1,0.199
N=C1CC2=C(NC=C2)O1,0.2049
Cn1c(nc(n1)OC)O,0.2498
CC1(C)OC1CC1CC1,0.3452
CC(C)OCCC#N,0.3031
OC12C3CC1CC2C3,0.3049
C1c2c(nn[nH]2)CO1,0.235
O=CCC1CC1CC#C,0.2254
CC1C2C3C2C1(O)C3O,0.3193
OC1COCC=C1C#C,0.2119
CCNC(=N)C#N,0.2115
CC1(O)C2C3C(O)C3C12,0.2673
OC12CC1CCCC2=O,0.2214
OC12C3OC1C(C#C)C23,0.2775
CC(C)CC1(CO1)C#N,0.3001
COC1C2COCC1N2,0.2937
Cn1c2ncnn2nn1,0.2209
COC1COCC1(C)C,0.3207
COCC1COC11CC1,0.304
CCC1C(NC1=O)C=O,0.214
CC1C=C(C)CC1C=O,0.2136
CC1C2C3C1C2C31CC1,0.3507
OC1CCOC2COC12,0.3128
CCC(CC)(CCO)O,0.3223
CC12C(O)CC1NC2=O,0.2685
CCN(C=O)C(C)C=O,0.2274
CC1CCC(=O)CC1C,0.2226
COC12C3C4C(C13)C24O,0.2724
CC1OC(C)(C=C1)C#N,0.252
CCC(=O)N(C)C=N,0.2356
CC1(C)C2CC3CN3C12,0.3018
C#CC1CC2C3CC2C13,0.3109
CC1C=CC(=O)C1C#C,0.1867
CCC1C2N1CC21CN1,0.2928
C#CCC1(CC1)C#N,0.3005
CC1CC2(O)C3CC1C23,0.3199
OC(C#N)C1=NC=CN1,0.2482
CC1=CC2OCC1CO2,0.2454
CC(O)CCN1CC1,0.3034
C1CCC2OC2C=CC1,0.2453
c1c(nc(c(n1)O)N)O,0.1719
CCC(O)(CC#C)C#C,0.2858
c1nc2c(o1)CC=CC2,0.2346
COC1(CO)CN=CO1,0.2721
CC1(C)C2CCC12C=O,0.2215
CC(=O)OC1CC(=O)C1,0.2213
C1CC2(C1)C(=O)CN2,0.2137
CC(O)(C=O)C1(C)CO1,0.2201
CC1OC(C=O)C1=O,0.198
C1CC11C2COC1CO2,0.3288
OC1=NOC(=N1)C1CN1,0.2256
c1c(c(ncn1)C=O)F,0.1664
OCC1C2CC1OC2,0.3068
CC(C)(CCC#N)C#C,0.3036
OC(C#C)C1CCC=C1,0.2553
N=C1OCC2COC1O2,0.2735
CC1OC1CNC=O,0.2823
OCC(=O)C1(CO)CN1,0.2287
CCC(C)CC1CC1C,0.3476
CN1CC1(C)CC=O,0.2095
CC1CC2C=C(C)CC12,0.2554
COC(C#C)C(=O)OC,0.2425
CCCCn1nccn1,0.2564
CN=C1C(=O)CCO1,0.185
C(CO)N=c1[nH]nn[nH]1,0.199
c1cn2c(c1O)CC=C2,0.1838
COC1CC(C)C11CC1,0.3251
OC1(CCOC1=O)C#N,0.2619
OC1CN2CC12C#C,0.2524
C#CC1=CC2OC2CC1,0.1948
CCC(O)(CO)C1CO1,0.312
CCCC1C2COC12,0.3102
OCCCCOC=N,0.2831
CC1C2CC1(O)C(=O)C2,0.2298
CC12OC3C1C=CC23O,0.2158
CC(C#C)C(O)CC#N,0.2887
C1C2CC1C1CC2C1,0.36
OCC1OCC1C=O,0.2154
C(C(=O)C#N)OC=O,0.1882
C1NC1C1OCC11CN1,0.2998
COC(=O)CC1CCO1,0.2622
CCC1(CCCC1)CC,0.3634
Cc1cnc(n1C)OC,0.2427
C#CC12OC3C1COC23,0.2478
CN(CC#CCO)C=O,0.2659
CC1(O)CC1OCC=O,0.2206
CCN1C(C)CNC1=O,0.2887
c1c(c[nH]c(=O)c1N)N,0.1598
OCC(NC=O)C1CC1,0.28
COC(C)(CO)C=O,0.2134
O=CC1OCC2CC1C2,0.2146
NC(=O)C1CC1C=O,0.2185
CCCC(C)(C)OC=O,0.2791
CC1C2C(O)C2OC1=O,0.2785
C#CC12CC(C=C1)C=C2,0.2186
CC1CC1C#CCC#C,0.2689
CC1CN(C)C1C(C)=O,0.2061
CC1COCCC2CC12,0.314
C#CC1OCC2COC12,0.2876
O=CC1OC=NC1C=O,0.2015
CN=C1CC(CC#N)O1,0.2777
O=C1CC2NC2C11CO1,0.2083
OC1=CNC(OC=N)=C1,0.1992
CC1CC(C)C(=O)O1,0.2774
COC(C)C1=CCCC1,0.258
COCC(N)C(N)C#N,0.2802
CC12CC3C(C1C#N)N23,0.281
CC1CC2OC12CO,0.322
C(C1CO1)C1=CCCC1,0.2576
CC12OC3(C)C1NC23C,0.3018
CCN1CC1C(=O)CC,0.2041
C1C2C1C1OCCC21,0.3168
CCNc1cnn(n1)C,0.2105
C(C1CO1)C1C2CC1O2,0.3246
C1CC1(c2nnon2)O,0.1978
CCCc1c(n[nH]n1)O,0.2336
NC1(C2CC1[NH2+]2)C([O-])=O,0.2565
CC(=O)C(O)CC(N)=O,0.202
OC1=NOC(=N)C(=O)O1,0.1866
C#CC1CC(C1)N1CC1,0.2858
COCc1cc([nH]n1)O,0.2543
CCC1CCC=CC1,0.2679
Cc1c2c([nH]nn2)n[nH]1,0.1956
COc1cc2n(c1)CC2,0.2312
CCC1CC(C)=CC1C,0.2585
Cc1c(oc(=O)o1)C#N,0.2058
CCC(O)CC(C)CO,0.3306
Cc1nc(=O)c(no1)F,0.1923
CC(C)n1c(cnn1)O,0.2465
FC(F)(F)C1C2COC12,0.3182
c1coc(n1)NC(=O)N,0.2266
C1COC2C3NC3C2O1,0.2987
COC12CC1NC2C#C,0.253
COCCC(C)OC=O,0.2656
NC(C#N)C1CNC1=O,0.2743
CC(=O)Cc1ncon1,0.2298
OCCC1C2OC2C1=O,0.211
CC1OC1(C)C(O)C=O,0.22
OC12CC3OC(=N)C1C23,0.2735
CC1=C2COC2C(=O)C1,0.2101
CCc1c(nccn1)C,0.1997
C1C2(CO1)COC(=N2)N,0.2771
OC12CN3C(C13)C2C#N,0.2617
CC12C3OC(C13)C2=NO,0.244
OCC12CC3C(C13)C2O,0.3177
CC1(C)COCC11CN1,0.3089
COC1(CC1)C(C)C#N,0.2951
OCC12NC1C1CCC21,0.2768
CCn1cncc1CO,0.2405
CC1CN2N=NC=C2N1,0.2303
COC1C2NC(=O)OC12,0.2949
CC12CC1C1CC21C,0.2905
CCNc1c([nH]nn1)O,0.2381
OCC12CCC1C1OC21,0.3104
O=C1OCC1C1CCC1,0.2781
C1CNC(=O)N(C1)C=O,0.2378
CCCC1(C)COC=N1,0.2714
OC1=NC=NC=CC1=N,0.1634
N=C1OC2COCOC12,0.2725
Cc1nc(cn1C=O)N,0.1604
C1CC23C1OC1C2OC31,0.2928
O=C1CCC2CC=CC12,0.2082
OC1CC2(NC12)C=O,0.2204
COCC1=COC(=N)O1,0.239
CC(C)C1COC(=O)N1,0.307
CC1N2CCC12CC#N,0.2732
CC1C2C3CC1(C)OC23,0.3093
c1c(=NO)c(non1)N,0.1598
CC1OC(OC1C)C#C,0.2933
c1c(ocn1)CCC#N,0.2412
OC1C=CC2=C1C=CO2,0.1677
COC(=N)N1C=NN=C1,0.2325
O=C1CCC2C3NC3C12,0.2084
C(C(=O)NC=N)OC=O,0.2246
NC(C#N)C1NC1C#N,0.2821
C1CC1(C=O)C2(CC2)O,0.2195
c1c2c(c([nH]1)N)nno2,0.1587
O=C1CC2C1CNC2=O,0.2139
CCN1CC12COC2,0.3039
C1C=CCOCC1=NO,0.2408
N#CCOCC1CO1,0.2859
N=C1OCOC2CC2O1,0.2834
CCCC(C)CCC#N,0.347
CC1(C)NC(=O)CC1O,0.2689
CCOC1CC2(C)CC12,0.3272
OC1=CC(=N)C(F)=CN1,0.1875
c1c-2cocnc2cn1,0.1415
Cc1cc(n(c1)C)OC,0.2379
CCNC(CC#N)C#C,0.2539
CC1(CO)C2C3CC1C23,0.3202
CC12OC3=NCC1C23,0.163
CC1=NCC(=NC)N1C,0.2155
COC12CC1C=C(C)C2,0.2436
Cc1cc(co1)NC=N,0.2109
COC1CCC(=N)OC1,0.2736
C1CC=CC2(C1)COC2,0.2598
CC12OCC3C4C(C14)C23,0.3248
NC=[NH+]C1(CC1)C([O-])=O,0.2528
Cn1c(ccn1)NC=O,0.2102
CC1C2CC1(C)OC2C,0.3199
CC(C)(C)CC1CC1,0.3454
CN1C2C(O)CCC12C,0.2814
CC1C(C#C)C1C(N)=O,0.2525
OCC1(C[NH2+]C1)C([O-])=O,0.269
CCOc1ccc(o1)N,0.2242
CC(=O)C1OCCC=C1,0.2124
N=C1OCCC(=O)CO1,0.2197
C(C1CO1)C1C2CC1C2,0.3629
CC12C3C4C1C4(O)CN23,0.2888
CN=COC1(C)CC1C,0.271
CCC1CC1(C)CC#N,0.3146
CC1CCC11OCC=C1,0.2417
C1CCC(C1)C#CC#N,0.243
OC1CC11CC2OCC12,0.3132
CC1=C(C)C(=N)NN=N1,0.1643
N=C1N=NNN=N1,0.1668
CCOC1CNC1=O,0.2564
COCCCC1CCC1,0.3379
CC(CO)C1C2COC12,0.3067
OC1CC(C=C1)N1CC1,0.2429
OCC1=NOC=NC1=N,0.2064
CC(O)C(C)C(O)CO,0.3102
OC12CC3C1CC3(O)C2,0.3267
Cc1cc(=O)c(no1)N,0.183
CC1C2C(C#C)C1C2=O,0.247
CC1=COC(=O)C(=N)N1,0.1695
CC1C2CCC(=O)C12C,0.2237
CNC1(CC1)C(N)C#N,0.2682
CC1CC1C1(C)CCC1,0.3361
CCNc1c(cc[nH]1)O,0.2318
N=C1OC2CC1C21CN1,0.2779
CC12C3CN1CC2(O)C3,0.2755
CC1CN(C1)C1COC1,0.2914
CC1CC2(C)OC2CO1,0.3373
CN1Cc2c(nc[nH]2)C1,0.232
CCCC1OCCC=C1,0.2651
CC(=NC)OCCO,0.277
COCC(C)C=O,0.2304
NC(=O)N1CC2CC12,0.2823
CC1CC1(C)C1CO1,0.3448
COCC1=CC(=O)CC1,0.1947
CCCCn1cccc1,0.2466
N#CC#CC1COC=N1,0.2292
CC1(C)NC1CC(N)=O,0.2692
C1CC11COC2CC2O1,0.3092
CC12CC1N1C(CO)C21,0.2802
OC1C2OC1C(O)C=C2,0.2326
CC12OC(=O)NC1C2O,0.2876
CC(=NO)C1OCC1O,0.2461
CC12CC3CCC1(C)C23,0.3298
CC(O)C1(NC1C)C#N,0.2778
CC#Cc1nccnn1,0.1641
O=C1NN=NC=C1C#C,0.1591
C(C#CCO)C(=O)CO,0.2271
OC12CCOC1C2C#C,0.2683
CCC(OC(C)C)C#N,0.3008
CC(C#N)C(=O)OC=N,0.2463
N#CC1=NC2CC2O1,0.2104
O=COC1C2OC1C2=O,0.2364
CNC(=O)CCCOC,0.28
CC1OCCC1C1CO1,0.3231
CN1N=CN=CC1=N,0.1492
C1CN=CN(C=C1)C=O,0.2054
CC1(CCC1C#N)C#N,0.3113
NC1=NC(=N)ON=C1,0.1639
c1cnoc1C#CC=O,0.1704
OCC1=COC(=N)O1,0.2321
CC12CC1C1(C)CC2C1,0.3365
C1C2OC3C4CC2C1C34,0.3012
COCC(=NO)CCO,0.2469
CC(O)CC1CCC1=O,0.2213
Cc1cnc(cn1)C=O,0.1688
COCC#CC(=N)OC,0.2355
CC(O)C1C2OC2C1C,0.3225
OC1C2CN2C2COC12,0.2828
OCC1OCC2OCC12,0.3257
COCCCCCO,0.33
C1CCC(C1)(C=O)C=O,0.1994
CC(=O)N1C=NCC1=N,0.2236
CC#CCOCC#CC,0.2679
COC(=NCCO)C=O,0.167
CCCNC(=O)N,0.3028
c1c(c(n[nH]1)OC=O)N,0.2084
CCC(N)C(=O)OC=N,0.2198
Cc1c(c[nH]n1)C(=O)C,0.2091
CC1(O)C=CCOC1=O,0.2536
C1C=CC2OC2C2OC12,0.2353
OC1C2C=CC(C=O)C12,0.2167
COc1ccoc(=O)c1,0.1907
O=C1ON=C(O1)C1CO1,0.2495
CCCCC#CC(C)O,0.29
OC1(C#N)C2C3CN3C12,0.2505
CC(C)C(C)(CO)C=O,0.2241
CC1C2OCC2C=C1C,0.256
Cc1ccn(c1)C,0.2455
OC1C2C3CC=C1C23,0.1801
CC12OC3COC1CC23,0.3005
CC1C2OCCC12C,0.3183
CCC(O)C(C)C(C)C,0.331
CC1(CC(=O)N1)C,0.2842
C1COc2c([nH]nn2)N1,0.2135
CC1C2OCC3CC2C13,0.3143
CN1CCOCC1C#N,0.2616
N#CCC1CC(O1)C#N,0.2841
CCC12CC1C=CCC2,0.2439
CC1(CN1)C(F)(F)F,0.3329
OC12C3C1N1CC2=CC31,0.1585
CN1N=CC(C)=NC1=N,0.1525
Cc1cnc(c(n1)C)F,0.2048
CC(C)C(=O)CC#N,0.233
NC1C(O)CCOC1=O,0.257
CC12CCCC1NC2=O,0.2782
CC12CC(C)(C1)N2C=O,0.2471
CC1CC2(CC=O)CN12,0.2123
CCC1CC2N=COC12,0.2618
O=C1CN2C1C21COC1,0.2176
CC1=CNC(=O)C1O,0.2059
c1cc(n(c1)C=O)C#N,0.182
CC1C(=N)OCC11CC1,0.2838
N=C1OCC(=O)CO1,0.2085
CCC(C)CC=O,0.2282
OCC1C2OC2C1=O,0.2117
O=CC1C2OC(C=O)C12,0.1955
COC1(CC1C)C(C)O,0.3097
CC(O)C1=CC(N)=NN1,0.2271
C1C2C3CC=C4C1N2C34,0.188
CC1C2C1C(=O)OC2C,0.2715
CC1C2OC1C2NC=O,0.2721
CC1C=CC(O)C1=O,0.223
C#CCOC1COC1,0.2764
OCC1(O)C=CC2CC12,0.2492
CC#CC#CC1CC1,0.2149
COC1COC(C)C1,0.3188
OC1COCC2(CO2)C1,0.311
CN1C(CCC1=O)C#N,0.2668
CCC1(NC1C=O)C#N,0.2136
O=CC1OCCC11CO1,0.2104
CC(C)(C)OCCC#N,0.3014
O=C1C2CCC1(O2)C#C,0.2259
CC1CCCC2(CO2)C1,0.3311
c1c(nc[nH]1)NCC=O,0.167
CC(=O)N1C2CC1C2O,0.2444
CC(C)(C(=O)NC=O)O,0.2119
CC1C(CO)C11CCO1,0.2889
O=CCC1CC1OC=O,0.2267
CCC1C(O)C1C(C)O,0.3071
CCOc1ccc([nH]1)C,0.2337
OC1CC2C3NC3C2C1,0.2926
CC#CC(C=O)C(C)=O,0.1918
CC1C2CC1(C)OC2=O,0.2755
CN1CC1(C)CC1CC1,0.3032
CC12COC(=O)C1O2,0.2494
CCC1CN1C(=O)CC,0.2554
C1C2OC1C21C2CN1C2,0.3103
Cc1ccoc1OC=O,0.2182
CC1=CCC2(C)CC2C1,0.2604
c1c(non1)OCC#N,0.2369
FC1=COC(=N)C=N1,0.1502
COC(C#C)C(N)=NC,0.2449
C1C2CCC3COC12C3,0.3044
CCC1CC(C1)C(C)C,0.3617
OC1C=CC2N3CC12C3,0.2135
O=C1NC2CCC2C=C1,0.2076
CC(C)(C)CC1CC1O,0.3275
N#CC1C=C2CC3C1C23,0.177
CCCC(CCC)C=O,0.2266
c1c(nc([nH]1)CC=O)N,0.1588
c1c(ncoc1=O)O,0.1941
CC(O)C1COCC1=O,0.2137
O=CC1CCC2CC2O1,0.2289
CNC(=O)C(C)N1CC1,0.2746
C(C1CCC1)C1CCO1,0.3264
c1cc(c(c(c1)O)F)N,0.2194
COC(=O)C1(C)OC1C,0.2678
OCC1OC1C(O)C#N,0.2756
CC(=O)C1(C)C(O)C1O,0.221
CC1(O)CN=CNC1=O,0.2263
CCC(O)CC1CC1,0.3245
O=C1CC=C2C=CCC12,0.1963
CN=c1c(cnn[nH]1)F,0.1646
CC(CC#C)C(N)C#N,0.2859
CC1=NCCN1C(=O)N,0.2407
CC12C(O)C1C1OCC21,0.2866
C#CC1COC(=O)OC1,0.3077
O=CCC12CC(CC1)O2,0.2235
C1C2CC3CC3OC12,0.3325
COC1(CC1)C(C)C=O,0.2142
C1C=CC=CCOC1=O,0.1927
CCC12CCC1(N2)C#N,0.2838
CC(=O)C1CN2CC12C,0.2114
N#CCC1COCCO1,0.2862
OC12C3C4C3C1(O)C24,0.282
CC(O)(CO)C(=O)CO,0.2333
O=C1NCC2C(C#C)C12,0.2608
CCC12C(C)C3C1CC23,0.3615
C1CCC(C1)CC2CC2,0.3526
C#CC(=O)CC#CC=O,0.1914
CNC(=NCC#N)CO,0.2482
COC1C2CC2C1OC,0.3191
CC1(O)CCC1(O)C#C,0.2764
OC1C2CC3CC1OC23,0.3086
c1c(c(oc1N)O)N,0.2141
CCCCCNC(=O)N,0.3023
CC1C=C(C)CC11CC1,0.2589
Cc1cc(c(o1)N)CO,0.2107
OC1CC(C1)OC1CC1,0.314
N#CC1C2CC1(O2)C#N,0.26
CC(CO)C1(C)CCC1,0.3404
CC1CC1N1N=CC=N1,0.2424
CN(C=O)C12CC1OC2,0.2601
CC1CC(=O)NC1C=O,0.2058
OCCCC1C2CC1O2,0.3097
NC1=CC(=NN1)C1CN1,0.2327
CC1CN1CC#CC#C,0.2089
CC1CC(C=O)N1C,0.2003
C[NH2+]C(CC#C)C([O-])=O,0.2607
OC1CC2(C1)NC2C#C,0.2741
CCC#CC12CC(C1)C2,0.2884
c1c(cnc(c1N)F)F,0.1953
CC12CCC3C1OC23,0.3074
N#CC12CC3CC1C23,0.2899
C1C(=O)CC(=C1C=O)N,0.1807
CC(O)C12CC3C(C1)N23,0.3025
COC1C2OC=NC12C,0.2521
CC#CCC(C)(C)CO,0.2963
CCCC12CC(C1)O2,0.3228
N#CC1C2C1C1CC2O1,0.3006
CC1C(O)C=CC1O,0.2588
CC1CCC(=O)C1C#N,0.2171
OC1CC=CC11CN1,0.2429
C#CC12CC3C4C(C13)N24,0.2599
CCC1=CCCC1C,0.2583
O=C1C2CC2OC1C#N,0.2164
CC(O)C#CC1(O)CC1,0.2703
CCCCC1CC2CC12,0.3372
CC1CC1CC1(C)CC1,0.3418
O=C1OC(C#N)C11CO1,0.257
CC1OC(C#N)C1=O,0.2214
C[NH+]=C(N)C(C=O)=N[O-],0.1281
OC1C2C=CC3(CC3)C12,0.2223
CC1OC2OC1(C)C=C2,0.245
CC(O)CNC(C)=O,0.2776
CC1CC(C1O)C(C)=O,0.2293
C1CC11CC2OCC2O1,0.3149
CCOC(C#N)C#CC,0.2678
O=C1C2CC1OC(=O)C2,0.2089
CC1CC2CC1C1OC21,0.3355
CC1C2(C)CC2C11CC1,0.324
CCCOC1(CC1)C#C,0.2798
CN1CCOC(=O)C1,0.2467
OC1CCC(=C1)C1CN1,0.2349
CC1(C)C2CC3CC1C23,0.3413
COC(C#C)C#C,0.2758
CC1CC2CC12NC=O,0.2669
c1c[nH]cc1O,0.2364
CCC1=CC(C)OC1,0.2477
OCC12CC1C1OC21,0.2917
C1C2CC=CC3OC2C13,0.2351
CCC(O)CCCC#N,0.314
C1CC1(CCCO)C#N,0.3067
C1CCC(C1)CCO,0.3412
C1C2CN1C1=NON=C21,0.2388
O=C1CC2CC1C2C#N,0.2247
CC1CC(C#C)C2CC12,0.3105
C1Cn2c1c(nn2)O,0.2293
OCC1CC=CC11CC1,0.2475
COC1C(O)COC1=O,0.2472
NC1=CC(=O)NC(=N)O1,0.2158
CN(C)C1CNC1C#N,0.2414
CC1(OC11COC1)C=O,0.2162
Cn1c(c(nn1)C#N)N,0.2282
CC1C2CC1(O)C2C#C,0.2879
CC(COC(C)=O)C#N,0.2867
NC(C#N)C1CN2CC12,0.2661
CC1OCOCC1CO,0.3301
CC1CC1(O)C(N)C#N,0.2948
c1c(=O)c(=O)cnon1,0.1502
CC1NC1(C)CC=O,0.2187
CC(O)C1OC1C(C)O,0.3296
CCOC(C)C1CC1C,0.3251
c1c(c(=O)[nH]nc1N)F,0.1634
CC1CC(O1)C(C)=NO,0.2552
O=C1CN=C2NC=NC12,0.207
CC12CCC1(N2)C#N,0.2851
C#CCn1ccc(c1)O,0.2171
C1C2CC3CC12CC=C3,0.2601
C#CC#CC1CC1,0.2179
CC1CC2CCC12,0.3436
CCc1cnnnn1,0.1654
OCCC1CC1OC=N,0.2787
CCC1OCC2CC1O2,0.3192
CC1C(=O)C2OCC12O,0.1984
OCC1C2CC2OC1=O,0.2581
C#CC12COCCC1O2,0.2725
COC1CCC(C)C1=O,0.2002
CCCC(C#N)C#N,0.3274
NC(=N)N1N=NOC1=N,0.1947
C1C(N1)(C(=O)N)C(=O)N,0.2621
Cc1c(c(c[nH]1)O)CO,0.2223
CCOC1CC2CC2O1,0.3286
CC(C)C#CCOC,0.2816
O=CN1CC2C3NC3C12,0.264
CCOC(=O)CC(C)C,0.2848
NC1CN(C(N)=N)C1=O,0.2263
c1cc(oc(=O)c1F)F,0.1753
CCCC1(C)NCC1=O,0.2172
CC1(O)CC11COC1=O,0.2532
CC12C3C4CC1C2(C)N34,0.3016
CC1(CC2(C1)CC2)C#N,0.3182
CC12NC(=O)C1C2O,0.2533
C1C2C3OC3C3CN3C12,0.3015
CC(COC=N)C(N)=O,0.2752
O=C1C2C3C4CC2N4C13,0.2228
O=C1OC2(CC2)C11CN1,0.263
CN1C(CC1(C)C)C#N,0.2501
CCc1coc(n1)N,0.2385
CC1COCCC(=O)N1,0.2646
CC12COC1CC2O,0.3152
CC(C)C[NH2+]CC([O-])=O,0.269
OC(C#N)C1=CON=C1,0.2463
c1nnc2n1nc([nH]2)N,0.2413
OC1C=C2CC3C1C23O,0.1775
CC12OC1C(O)C2CO,0.3028
CCC1=CC2CC1C=C2,0.2147
C1C(CO1)(CC=O)O,0.2206
O=CC12NCC3C1OC23,0.1952
OCC12CCC1=CCO2,0.231
COCC12CC1(C)CO2,0.294
C#Cc1ccn[nH]1,0.2132
CC1OC1C1=COC=N1,0.2392
C1C2CC3(CC4NC34)N12,0.3041
C1C=C(CC(=O)O1)C=O,0.1912
Cn1c(cc(c1N)O)O,0.2319
CC1C2C(C1CO)N2C,0.2985
CC1(CC1)C#CCOC,0.2752
C1COC(=N1)NCC#N,0.2517
CC12C3C4C5C3C1N5C24,0.2575
CCC(=O)C,0.2351
OC1CC(N2CC2)C1=O,0.1941
NC12CNC1C2(O)C#N,0.2605
O=C(C1CC1)C1CO1,0.2213
CC(=O)C1=CCOCC1,0.1949
CC12CCC3C1N2C3=O,0.2365
CN1CC(O)CC1C#N,0.2677
CN=COc1c[nH]nc1,0.239
C1CCOC(=O)C=CC1,0.2147
CN1C2CC(C2O)C1=O,0.2577
CC(C)C1(CCC1)C,0.3521
COC12CC3CC1(C)C23,0.3206
CCOC(C)C1(C)CO1,0.3354
CCCOCC#C,0.289
CCC1(CC(C)=O)CO1,0.2278
CN1C2CC=CC12CO,0.234
CCC(CC#N)OC=N,0.2817
C(C#CC1CO1)C1CO1,0.2748
CC1C2CC1C(=O)N2,0.2602
CC1C2C3C2C2(C)C1N32,0.3009
OCC1C2CC(=O)C12O,0.2222
CCOC1C2CC(C)C12,0.3243
CC12CC=CC1C2C=O,0.2092
OCC1OC=NCC=C1,0.2541
O=C1OC2C3OC12C=C3,0.2109
CN=C1OCC1C#N,0.2724
C1OC2COC3C1C3C2,0.3047
C#CC1OC(C=C1)C#N,0.2569
CC1C2(CO2)CC1(C)C,0.3291
CC1CC2OC12C(N)=O,0.2579
C1C2CC3CCC2C1O3,0.3064
c1c(c2c([nH]1)CC=C2)N,0.1879
CC(=NO)C1CO1,0.2432
ON=C1CC2CCC12O,0.2376
CCC1C2OC(=O)C12C,0.2734
CC1=C(COC1)CC#N,0.2388
O=C1NC2CC3OC2C13,0.2529
CNc1noc(=O)o1,0.2681
OCC1OC(=N)C11CO1,0.2666
CC(N(C)C)C(=O)C#N,0.1515
C1C2CCCCOCC12,0.3233
CC1(C)OC(=N)C11CC1,0.2813
O=C(NCC#N)C1CO1,0.2632
OC(CC1CN1)C#C,0.2711
O=CC12CCC1NC2=O,0.217
CC1(C)C(O)CNC1=O,0.2736
CCCC1(C)OCC1=O,0.2224
O=C1NC2CC12CC#C,0.2514
CC12CCC1CC(O)C2,0.3274
OC12CC1NCC2=O,0.191
N=C1NCC(=O)NC1=O,0.1859
C1CC11C=CC2CC12,0.236
CC(C)Nc1cnon1,0.2023
CC12C3C(CN13)C2(C)O,0.2978
N#CC12CC3OC1C3N2,0.2657
OC1C2NC2C1C#N,0.2851
CC1CCOC2CCC12,0.3201
C1C=CCC2C3OC2C13,0.2643
OC1C=C(C#C)C2CC12,0.1991
OCC1C=CCC1C=O,0.2154
OC(CCC#N)CC=O,0.2235
N#CC1CCCO1,0.2982
CCC(=NO)C1CCC1,0.2497
CCOC1(CC1)C1CO1,0.3186
CC1=CNC2(C1=O)CC2,0.1823
COC1C(OC)C1C#N,0.2797
CC(=N)NC(=O)NC,0.2437
Cn1c(cnc1CO)N,0.2206
CC1CCC(=O)C11CC1,0.2231
Cc1c(ocn1)CCO,0.2379
CC1C2C3(C)OC2(C)C13,0.3131
CCC1C2OC3C2OC13,0.3032
C1C2CC3CC1C23,0.3468
Cc1cc[nH]c1COC,0.2377
C1C2C1N1C3C4C(C13)N24,0.2638
CCc1c(nc[nH]1)O,0.2238
CC1C2OCC(=O)OC12,0.2528
CCC12CC1(N)C(=O)O2,0.2463
CC(=O)n1cnnn1,0.2207
CC1C2CC2C=CC1=O,0.186
CN=C1C(=O)CCCN1,0.182
CC1(O)C2NC1C2C=O,0.2199
CCC1CC1(O)C(C)=O,0.2245
CC1OCCC=CCO1,0.251
C1OC1C1=NC2CC2O1,0.2397
CC1CC(=NO)C1C=O,0.2154
CC1(O)C(O)C11CCC1,0.2935
C#CCC1OC1C1CN1,0.2975
CC1COC2OCCC12,0.3159
CC1C2COC1C=CC2,0.2496
OCC1CC2CC3C2N13,0.3335
CC12NC1CC2CC=O,0.2182
C#CCC1CCC1C#C,0.2918
N#CC1NC1CC1CO1,0.2848
OC1C2C3CC2OC1C3,0.2997
CC12CC3C1C1(CO1)C23,0.3473
N=C1C=CON=CC1=O,0.1646
CC1=CC2OCC1O2,0.243
OC1C2CC1C1CN1C2,0.2957
CC1(CCC#C)CC1O,0.3124
NC=[NH+]C1=C([O-])C=NN1,0.1085
CC1=CC(C)(C)C2NC12,0.2473
CN=C1NC(C)=NC=N1,0.1685
C#CC12CC3CC1C23,0.2729
CC12C3NC(C13)C2C#N,0.2553
N=COC1C2C3C1CN23,0.2626
C1COCC(=O)C1=NO,0.1663
C1C2OC3=NOC=C3C12,0.2399
CC12CC3OC1CC2O3,0.3332
C1CC1C2(CC2)CCO,0.3228
N#CCOC1CN2CC12,0.2523
CC1(C(=O)OCO1)C,0.2741
CC1CC1(CO)C=O,0.2253
CC12CN1CCC1OC21,0.2974
N#CCC12CC1C1CC21,0.2561
CC12CCC(CCC1)O2,0.3132
CC12CC3C(C1)C3C=C2,0.2477
c1ncnc(n1)C(=O)N,0.1774
C#CC(C#C)C(=O)N,0.2614
O=C1CN=C(N1)C1CN1,0.2257
CCC(CO)CC(C)C,0.3365
[O-]C(=O)C1[NH2+]CC1C#C,0.2594
CC12COC1(C)COC2,0.3158
CC1COCC1CC=O,0.224
C(CC(=O)CC=O)C#N,0.2114
CCn1c(c(nn1)C)C,0.2409
CCN(CC#N)C=O,0.2717
CC1CC1(C#C)C(N)=O,0.2707
N=C1N=NOC=C1C#N,0.1957
CCNc1ncc(o1)N,0.2272
CN=COCCOC=N,0.2731
CC(C)C1CCC(=O)O1,0.2788
CCOCC([NH3+])C([O-])=O,0.2726
CCC1(O)CC1(C)O,0.2864
C#CC#Cc1cnco1,0.172
CC12COC3CC3C1O2,0.3317
CCC12CC(O1)C2(C)C,0.3176
COCCc1c[nH]cn1,0.2529
N#CC1NCC11CCC1,0.2634
CC12CC1(CC2=O)C#N,0.2247
CC1C2CC11OC(=N)C21,0.2706
CC(=O)N1CCC1C#N,0.2661
N=C1CC(=N)OC(=O)N1,0.2459
C(=N)Nc1c(nno1)O,0.1792
CC12OC3=NC4C(C14)C23,0.1556
CCC1COC2COC12,0.3215
CC12CN1CC21CC1,0.3055
CN1C(CO)C=CC1=O,0.2115
c1cc([nH]c1)C2CCC2,0.2389
CN1C(=O)CC2CC12C,0.2579
c1c([nH]c(n1)C=O)CO,0.1809
OC1C=CCCCC=C1,0.2189
CC1CC2(N)C1OC2=N,0.2682
CCC(CC)(CO)CO,0.3079
O=CC1NC(=O)C2OC12,0.2099
C1C2CCOCC1C=C2,0.2594
CCC1(C=O)C(O)C1O,0.2179
CC1(CC1)C(=NO)CO,0.2519
CC(CC=O)C1OC1C,0.2279
CCC1CC1C(C)C=O,0.2244
COC1C2C3CC1C23C,0.324
C1CC1C1CC11CCO1,0.2954
CC(C)OC1CC2OC12,0.3177
OC1C=CCOC1=O,0.2516
CC1(CO)NC(=N)C1O,0.2617
CC12OC3C1C2C3(C)C,0.3108
C(N1CC1)C12CC1OC2,0.3084
c1c(nc([nH]1)O)NC=O,0.2074
OC12CC3C4CN(C14)C23,0.2973
COC(C)C1CCC1,0.3308
CC#CC12CN1CC2,0.2502
OCC1CC2CCC12,0.3352
CCC1C(O)C1C=O,0.2225
Cn1c(c(nc1O)O)N,0.2359
CN(C)C(=O)COC,0.2697
Cc1cc(ncc1C)F,0.2223
OCC12CC3NC3C1O2,0.307
CC(O)C1CC1(O)C#C,0.2709
CC1OC2CCC=CC12,0.2584
CNc1cn(cc1O)C,0.2252
C1CC=CC=CC=C1,0.1784
CC12NC1(C#N)C1OC21,0.2778
O=C1C2CCC1C1NC21,0.2254
CC(CC#C)C1OC1C,0.3091
CC12OC1(C)C(O)C=C2,0.2311
CC1COCCNC1=O,0.2625
Cn1c(cc(n1)N)C#C,0.1877
O=C1CC2(CO2)C11CN1,0.2059
O=CC(C1CO1)C1CO1,0.2144
O=C1COC2C3NC2C13,0.2049
c1cnn(c1)C(=O)C#N,0.1897
CCC1C2CC2(O)C1=O,0.2265
CC1C2C1C(C#N)C2O,0.2901
Cc1nc(no1)C#N,0.2366
Cc1cc(on1)C(=N)N,0.2016
CN1C=NC(=N)C=C1O,0.1878
CC12COC(=N)C1O2,0.2676
O=CCC12CCC1N2,0.22
CN=CNc1nc[nH]n1,0.2195
CCC1CC(=O)N2CC12,0.2406
CCc1[nH]nc(n1)N,0.233
NC(C#N)C1(N)CC1,0.2806
CCC1OCCC(C)=C1,0.2598
c1c[nH]c(c1O)C(=O)N,0.1872
OC1CC2CC2C2CC12,0.3137
O=C1CCC11NC1C#C,0.2019
CN1C2CCC2C1C=O,0.1919
CCC(C)C1CCC1,0.3666
CC1COC=NC1C#N,0.2694
CC#CC12CCC1C2O,0.2616
NC(C#N)C1CC1CO,0.2945
OC1CC(O)C(O)C1,0.2934
CC1OC2(COC12)C#C,0.2593
CC1(CO1)C(C=O)C#N,0.2266
CCn1c(ccc1O)O,0.2289
CC(C)C([NH3+])CC([O-])=O,0.2768
OC1COCC2COC12,0.2968
CC1(CN1C(=O)C#N)C,0.2178
CCOC(=O)CN,0.2621
c1c(c(c(nn1)O)N)F,0.2028
CC12CC1CC1C(O)C21,0.3017
NC1=NOC(=O)C(=N)N1,0.1902
CCC1OC1(C)CC=O,0.223
CC(C)(C1CO1)C1CO1,0.3428
c1c(cc(=O)[nH]c1N)F,0.1867
NCC(N)(C#N)C1CC1,0.2665
N=C1OCOCCC1=O,0.1937
CC1OC(CO)C(=O)O1,0.2674
CC1=NC(F)=NNC1=N,0.1519
CC1(CN1)C1(CO)CO1,0.3142
CNc1coc(n1)O,0.2286
CC1CC2C(O)C(=O)N12,0.2242
CCC1CC1C1(C)CC1,0.3266
CC1(O)C2CC1(N2)C#C,0.265
CN=C1NC(=N)C(C)O1,0.2435
CN1CC1(C)C(O)C=O,0.1985
Cc1cnn(c1)C,0.2534
Cc1c([nH]cn1)O,0.2407
CN1C=NCCOC1=O,0.2404
COC12CN(C1C)C2C,0.3199
N=C1NCC2=C1OC=N2,0.2021
CCC(C)N1CCC1=O,0.2748
CCn1cccc1C#N,0.2077
CC1(CC1)OCC#C,0.2874
N#CC12CC3CC1C3O2,0.2659
O=C1C2CC1NC(=O)N2,0.1941
CC#CCC1(CO1)C#C,0.27
O=CC1OCCC=C1,0.2144
CC1N2CC1(C#N)C2C,0.2702
CC12C=CC3C1N3C2=O,0.2073
c1c(c(nc(n1)O)F)F,0.2079
c1nc(on1)C2(CC2)N,0.2379
Cc1ncc(o1)N(C)C,0.2125
CCCC(C)OC(C)C,0.3232
OCCC1CCC1=O,0.2197
CC1N2CC1(CO)C2,0.2894
COC1(CC=O)CC1O,0.2074
C1NC1C1=NC=NC=C1,0.2125
CCC12COC(O1)C=C2,0.2449
C1C2OC3C=CC1C3O2,0.2422
CC1(C)NC1C#CCO,0.2623
CC(CO)CC#CC#C,0.2307
OC(C#C)C1=NOC=C1,0.2522
C(C1CO1)C1=CC=NN1,0.2565
C1CN1C12CCC1CC2,0.3071
CCn1ncc(n1)C#N,0.2344
CC1C2C=CC3OC3C12,0.2387
CC1CCC2CC1C2=O,0.2209
C#CCn1cccn1,0.2606
C1OC2C1C1C=CCC21,0.2564
OCC(O)C1=CC=CN1,0.2366
N=C1OCC2CCC12,0.2786
c1cc([nH]c1)CCC#N,0.2346
OC1CCN=C2OCC12,0.2711
N=C1OC=NC(=O)N=C1,0.1867
CC1C2C(=O)C3N1C23C,0.2269
CC(O)C1OC1(C)C=O,0.2203
OCC(CC=O)C=O,0.2247
CC12CC1(CO)CC=C2,0.2478
CC1(O)CC1C1CO1,0.328
c1nc2c(o1)OCOC2,0.2264
OCC12OCC1NC2=O,0.2481
CCCC1C(O)C1O,0.2782
OC1CCC(CC1)C=O,0.2264
OCC1(OCC=C1)C=O,0.2014
O=CNC12C3CC1OC23,0.2496
Cc1c(oc(n1)O)C,0.2413
CC1C2CCC1C(=N)O2,0.2856
c1cnoc1CCC=O,0.2206
c1cncnc1N2CC2,0.2139
CC(C)CCCCC=O,0.2289
CC1=CC(CC=O)CC1,0.2162
CCCC1C2N1CC2=O,0.2184
COC1=NC(C)C(C)N1,0.274
CC(=O)c1cc(no1)O,0.1941
C#CCCOCC(=O)N,0.2745
CCC1CC2CCC=C12,0.2467
COC1C(C=O)C1C=O,0.2093
ON=C1CC=CC2CC12,0.2368
OC1C(C=O)C=CC1=O,0.1927
C1C=CC23OC4C2N1C34,0.216
CC1(C)CC1C(=O)C#C,0.2024
CC1(CO)CC2C(O)C12,0.3088
CCOC(C#C)C#N,0.2756
CCC1COC1C1CC1,0.3193
N#CC1COC2COC12,0.297
CCNC(=O)C#CC#N,0.1969
CC12CC(C1)(C2)C(N)=O,0.265
OCC1CN2C=NC=C12,0.2536
CC1(O)C2COC12CO,0.2898
CC1CN2N=NC=C2O1,0.2388
CC12CC(C)(OC1)C2=O,0.2064
CC1COC2(CC2)C=C1,0.2421
COC(=O)CCC=O,0.2304
CC12CC(CO)C1C2O,0.3053
CC1COC11CC1CO,0.289
CC(C)C1OCC1=O,0.2237
CC1C2C3CC1C23C=O,0.2264
CC1(CO)CC1(C)C#C,0.292
CC1CCCCOCO1,0.3343
CCCN=c1occo1,0.2316
C1OC11C2COC1C=C2,0.2406
COCC(=N)OC(C)=O,0.2321
c1c(c(c[nH]1)O)CO,0.2374
Cn1ncc(n1)N(C)C,0.2042
CC(C(O)C#N)C(N)=O,0.2671
CN1CC2OCOCC12,0.3006
CC1C2CC3CCC13O2,0.3101
CC1CC(O)C(C)C1O,0.3133
C#CC#CC1CC2CC12,0.2263
CC1CN=C2C1C1CN21,0.2456
Cc1cc2n(c1)CCN2,0.2281
CCOC1(CC1)CCO,0.3263
CC1CC1C(=O)CC#N,0.2273
CN1C2CC3C1C2N3C,0.2877
CC1C=CCCC1C#C,0.2636
CC12NC1C1CCC=C21,0.2362
CC1CC2C(C1O)N2C,0.2804
c1coc2c1cc([nH]2)N,0.2133
c1ncn(n1)C(=O)C=O,0.1641
CN(C)c1c(c[nH]n1)N,0.2188
CCC(C)(O)COC,0.3304
c1c(=O)c(non1)CO,0.1674
O=CCOCC1CN1,0.2233
O=C1CC23NC4C2NC134,0.1852
CC12C3C1C1(C)CC2N31,0.2992
NC1C2NC(CO)=NC12,0.2191
CC1OCC=C1C#C,0.2048
C#CC(=O)C#CCC=O,0.1817
c1nc(on1)C2CC2,0.2469
CC1C(O)C1CC1CO1,0.3164
Cc1c(=NC)cn[nH]n1,0.1712
c1[nH]nc(n1)NCCO,0.2247
CC1CCC11CC1(C)O,0.3111
OC1C(=O)C2CC12O,0.2148
C1C2COCOC1C=C2,0.2547
OC1C2C3C1N2C31CC1,0.2986
CC1C2CC(C2)C=C1C,0.247
OC1(C=O)C2COCC12,0.2152
CC(C)C(CCO)C#N,0.3073
CN=C1C=NNC=N1,0.1792
CC(C)(COC)C#C,0.3132
CC1CC(O)C(O)C1C,0.3022
CC1COCC1OC=O,0.2632
C1OC2C=C3COC3C12,0.2415
O=CC1CN=C(O1)C#C,0.212
N=C1ON=C(C=C1)C#C,0.1556
CCN(C)C(=O)CO,0.2694
CC(C1CN1)C(=O)CO,0.2197
CC(O)C1C(O)C1(C)C,0.3053
OC1C2OC2C1C1CO1,0.3184
CC(OC(C)C#N)C=O,0.2267
CCOC1C2OC2C1C,0.3215
CC12CC3CC1(C#C)C23,0.2702
OC12C3CC1N3C2C#N,0.2754
C#CCCC=O,0.2247
O=C1CC(C#N)C2OC12,0.2133
CN=C1OCC2C(O)C12,0.2646
OC1(CNC1=O)C1CO1,0.2672
CC1(O)CC(=O)C=C1N,0.2033
c1nc(no1)OC(=N)N,0.2327
CC1C(O)CNC1=O,0.2748
CC1(O)C2CC2NC1=O,0.2594
N=C1OCC11OC1C#N,0.2568
CC1CNC(=O)OCO1,0.2864
N=C1CC(O1)C1CC1,0.2899
C1CC2=CCOC2O1,0.251
OCCC(=N)OCC=O,0.2228
CC1COC2CC2C1,0.302
CC12COC1CC21CN1,0.303
CCC1CC(C=O)C1O,0.2127
O=CNC12CC1OC2=O,0.2507
CC1(CCO)C2CC1O2,0.3179
O=CNC1=NC2CC2O1,0.2249
OC1CC2CC2CC1O,0.3134
CC(=O)CC1OC1C=O,0.2161
O=CCCC12CN1CC2,0.2144
CC(O)C12CN1CC2=O,0.2221
CCN1C2CC(O)C12C,0.2938
CC1C2NC(=O)C(C)C12,0.263
COC1OC2CC2C=C1,0.2461
c1ncn(n1)CC(=O)N,0.2444
CNC(=O)C(=O)COC,0.1799
OC12CC1(CC2=O)C#C,0.1992
CC1C2OC1(C#N)C2=O,0.2381
C#CC1OC2=NCCC12,0.2535
CCC12CC=C(C)C1O2,0.2445
CC1NC11CCC1C=O,0.2134
CC1CC=CNC1=O,0.214
CC(C)OCC(C)(C)C,0.3247
CCC(C)(CO)C=O,0.2236
CCCc1ccc(o1)C,0.2281
ON=C1COCC1=NO,0.1854
CC1(CC(O)C1)C#N,0.3099
CC(=O)COC=NC,0.2136
NC1=COC(=N)N=C1F,0.1536
CC1=CC2OC1C1CC21,0.2461
CC(=O)C1CCOC=N1,0.2227
CCC(=O)C1CCOC1,0.2306
C1CC=C2C3NC3C2C1,0.2405
OCC1CCC1=NO,0.2451
CNC1C(OC1=N)C#C,0.2429
CCc1cc[nH]c1,0.2504
CCC1COC2(C)CC12,0.3087
CC(=O)C(O)C1CC1,0.2329
CC1=CCCC2NC12C,0.2527
CC12C3C1C1(C)CC2C31,0.3229
OC1COC2OC=NC12,0.2585
COC12CC3C1C2C3C,0.3304
CCC(NC1CC1)C#N,0.2658
CC12C3OC(CC1=O)C23,0.2228
CC12NC1COC2C#C,0.2782
NC(=O)C12CC(C1)OC2,0.2663
C1C2CC=CCC1C=C2,0.2571
CC1OC(CC=C1)C#C,0.2645
CC#CC1C2CCC12,0.2842
OCC12OC3C1COC23,0.3035
CC1C2COC22COC12,0.2967
Cc1nc(=O)c(co1)O,0.202
CC1(NC11COC1)C#C,0.2686
CC1C2NC2(C)C11CN1,0.3056
CC1CC2C3C(O)C3C12,0.2983
OC1CC1C1CC1C#N,0.2976
Cc1ccon1,0.2566
CC(C)(C)c1ccco1,0.2365
CC1(C)C(CO)C1CO,0.3025
CN1CC2NCC1C2=O,0.1931
C1C2CC=CC3CC12O3,0.2186
OC1CCC(C#N)C1=O,0.2194
CC(C)(CO)OC1CC1,0.3068
CCC1=COC=NC1=N,0.2059
Cc1cc(c([nH]1)NC)O,0.2247
CCC#CC1OC1CO,0.2729
CCOc1cn[nH]c1O,0.241
O=CC1NC11C2CC1O2,0.2184
CC1C(=O)OCOC1=O,0.2633
OC1CC2(O)COCC12,0.3095
CC12CC(CO1)C2C=O,0.209
CC#CC(=O)COC=N,0.1921
OC1C2OCOC12C#C,0.2565
CCCC1(OCCO1)C,0.3318
CCC1CCCC1CO,0.338
CC12COCC=CC1N2,0.2345
CC1OC2(C)CC2C1=O,0.2179
COC1CCC(C)O1,0.3397
O=CC1=CCC2CCC12,0.1936
CC12OC1C1OCC21,0.2971
CN1C(C#C)C1C(C)=O,0.2005
C1OC11C2C3C=CC1C23,0.2287
O=C1C2C3CCC1C23,0.2351
CCC(=O)CN1CCC1,0.2138
CCC(OC1CC1)C#N,0.2876
CC12CC3C1C3(O)C=C2,0.2377
C1OC2OC1CCC=C2,0.2445
N#CC12OCC(O1)C=C2,0.2421
C1C(CO1)(C#N)C(=O)N,0.2581
C1CCC2(C1)CC(=O)C2,0.2213
CCc1cc(nn1C)C,0.255
CCC1C2CC1(C)C2=O,0.2478
C1OC23CN4C(CC124)C3,0.2759
CC(CC#C)C(C)C#N,0.298
CCOC1(C)CC1C#C,0.2895
O=COC12CN(C1)C2,0.262
CCN=C(N)C(O)C#C,0.2467
CCC1(O)C(C)C1C#C,0.2792
CC(C)C(C#C)C#C,0.294
CC(O)C12COC1CN2,0.2759
CC(C)CC(=NO)C#C,0.2034
CCC1C2CC1N2C=O,0.2497
CCC1C(O)C1CC#N,0.2993
CC1(NC1CC#C)C#N,0.277
OC1C2CC3CC1C2C3,0.3246
[O-]C(=O)C12[NH2+]C3CC1C23,0.2596
CC1=NC(CO1)(C)C,0.2725
CC12C3CC4CC1C4N23,0.302
COCC1(C)CCC1=O,0.2164
OC1CN2CC2C1C#C,0.2675
CN(C=O)C(=O)N1CC1,0.2375
N=C1ON=CC(=O)C=N1,0.1532
CNC(=O)C1CCN1C,0.2241
C1C=CC23NC4C2N1C34,0.2116
OC12CC(C1)C(C=O)=C2,0.1861
C#CCNc1nc[nH]n1,0.2284
CC1=C(CN(C1=O)C)N,0.2092
CC(C)(C(F)(F)F)OC,0.345
C1N=COC2C3NC2C13,0.2631
CN1CC2CC12CC#N,0.2521
CC(C)C(=O)C(C)(C)C,0.2239
CCc1cc(oc1N)C,0.2153
OCC12CCC1NC2=O,0.2736
CC(C)(C)CC(F)(F)F,0.3901
OC1CCC2C3CC2C13,0.3211
CCC(C)OC(C)C,0.3235
C#Cc1ccc(cn1)O,0.1911
CCCC1C(O)C1CC,0.3036
C#CCC1CCOCC1,0.2992
O=CN1CC23CC(O2)C13,0.2592
COC(CO)C#N,0.2974
COC(=O)C(O)C#CC,0.2504
CN(C)CC(C=O)C#N,0.1772
C1OC1C1OC1C1CO1,0.3263
CC1N=COC(=O)C1O,0.2399
Cc1cn[nH]n1,0.2596
CC#CC1CC2CN12,0.265
C1CC1C1(CO1)C1CN1,0.3191
COC(C)CC(O)CO,0.3158
CN1CCCC1(C)C#N,0.2687
OC12CC3C4C(C14)N3C2,0.2896
CC#CC1CCOC=N1,0.261
COCC#CC1CCC1,0.2781
CC1(NCC11CN1)C=O,0.1979
COc1c(onn1)OC,0.1878
CC(C)CCC1COC1,0.3168
CC(C)C1(CO1)C#N,0.3025
CCC1=C(C)COC1=N,0.2169
COc1c(c[nH]n1)CO,0.2462
CC(O)C1CCCC1C,0.3332
CCCc1nnn(n1)C,0.256
CC1=CCC2CC2C1,0.2606
CC12CC1CC(C2)=NO,0.2509
O=C1NCC1CC1CO1,0.281
CN1CC(N=C1)C#N,0.2384
CC1C(C)C2(CN12)C=O,0.2023
c1nc(on1)C(=O)N,0.21
Cn1c(c(cn1)N)C=O,0.1571
CC(C)C(C#C)C(C)C,0.3121
CC1C2C=CC1C21CO1,0.2395
CC(CO)(NC=O)C#C,0.2716
CCCC(C)C1COC1,0.3146
CC12CCC(C1)C1OC21,0.3383
CC(=O)c1cc(no1)N,0.1771
Cc1c(oc(=O)cn1)O,0.1556
C1N2C3C4OCC13C24,0.3071
CC1CC(O1)C1(O)CC1,0.3143
COCC(O)C(C)O,0.314
C1NC1C12OC1CC=C2,0.2458
C1OCC1C1CCCO1,0.3152
CN=COC(=O)CN,0.2331
c1cnc([nH]c1=O)F,0.2035
N=C1OCC2OC3C2C13,0.2638
CC(O)C(C)CCC#N,0.3149
O=C1C2C3C=CN1C23,0.2005
CC#CCCC(=O)N,0.2689
COC1CCC1C1CO1,0.3245
COC12OC(C=C1)C=C2,0.201
CC1(C#C)C2CC1C2=O,0.2485
COC1(COC1C)C#N,0.2777
CCN=C1C=CNN=N1,0.1609
CC1C2OC1C(=C2)C#N,0.1991
O=CCC1OCC(=O)O1,0.2259
CCC1(O)CC2CC12C,0.3064
CC(CC(=O)C#N)C#N,0.2106
CN1CC(O)C1C#N,0.2562
COC1CC2OC3C2C13,0.3059
COC1OCCC=C1,0.2657
OCC(O)C1NC1C=O,0.2211
CC(=O)c1nccnn1,0.1613
OC1C2CCOC1C2O,0.3045
CC1CC11OCCC1O,0.2909
N#CCC12CN1CCC2,0.2803
OCC(O)C1C2CC1O2,0.2975
O=CCC1(CO1)C#N,0.2223
CC(O)C1(CO)CN1,0.3105
COCC1(C)COCO1,0.3326
CCC(C#C)C(=O)C#C,0.1949
NC1(COC1C#C)C#N,0.2639
CC1COC2CC1C2O,0.304
O=C1NC2CC2N1,0.2843
ON=C1C2CC(N2)C1=O,0.1712
CC12CCCC(CO1)O2,0.3285
CCCC(=O)NCC=O,0.2193
N=COC1COCOC1,0.2741
OCC(O)C1(CN1)C#N,0.2889
O=C1OC2OCC3C2N13,0.2763
CCC1(CCOC1)C=O,0.224
CCCC1CC1(O)C=O,0.221
COC1CCC11CCC1,0.3295
C#Cc1c(nn[nH]1)N,0.1839
CC1C(O)C2(O)COC12,0.2948
CC1C(=O)C=C(C)C1=O,0.158
c1cc([nH]c1CO)C=O,0.1801
CC1CC2OC2C=C1,0.2457
NC1=C(O)OC(=N)N=C1,0.1572
OC1C2CC(O)(C2)C1=O,0.2178
COCC(CO)OC=N,0.2813
OC1C2CCOCOC12,0.3132
CC1C(C)C1C(=O)CO,0.2289
C(CO)C(=O)C(=N)N,0.1817
C1CC2C3C4C(C13)N24,0.3138
CC1=CC2NC2(C1)C#C,0.2344
CC(=N)OCC(=O)C#C,0.2063
CC12COC(=N)C1N2,0.2693
c1c(nc([nH]1)O)CC#N,0.254
OC1COC2C3CN3C12,0.2886
O=C1OC2CC3CNC123,0.2383
C#CCc1cc(c[nH]1)O,0.226
CC12CC1OCC2C#N,0.2768
O=C1NC2C3C4C1C2N34,0.2506
c1cncc(c1F)C=O,0.1815
O=CC12CN(C1)CC=C2,0.1858
CC1CCC(C)(C)C1,0.3749
NC(C#N)C1COC1=N,0.2748
C#CC1(COC1)C1CN1,0.2825
CC(C)(C)C1CC1(C)C,0.3276
CC(C)OC1(CC1)C=O,0.2182
CC1OCCC1(O)C#N,0.2724
CC1OC2(CO)CC12C,0.2992
OC1C2CC2C(O)C1=O,0.2185
C#Cc1cncn1C=O,0.1745
O=C1COC(CN1)C#C,0.2581
C1C2CC3CC12C=CC3,0.2364
CC1CC2(O)C1C2(C)O,0.2897
NC(=O)C(O)C1CN1,0.256
CCN1CC1C(O)C=O,0.1951
c1c(c2c([nH]1)[nH]nn2)N,0.1921
CCC1(O)C=CC2NC12,0.2389
CCNc1cc[nH]c1O,0.219
OCC1C2CC2C2OC12,0.321
NC(=O)C1CC(=O)C=C1,0.1897
C#CC1(CN1)C#C,0.2549
[O-]C(=O)C1=CC[NH2+]CC1,0.129
C(CO)C(=O)OCC#N,0.2707
OC(C=O)C1CC2CC12,0.2194
CC1(C)C2C1C1CC2O1,0.325
c1cnc(c(n1)O)O,0.1921
NC(=N)C(O)C#N,0.2534
CC1=CCOC(=O)OC1,0.2495
CC1N2C3CC2C3C1=O,0.2035
CCC(C)(CC)O,0.324
CNc1cc(n[nH]1)CO,0.2341
OCC(O)C(=O)NC=O,0.2201
CCC1=CC(C)CC1=O,0.1957
CC(=O)NC1C2CCC12,0.2698
c1coc2c1NC(=O)C2,0.1978
NC(C[NH3+])C#CC([O-])=O,0.2103
CCC#CC1CC(C)C1,0.2923
CCC1C2OCCC12C,0.318
N#CC12CC(C1)CC2,0.3305
CC1CC2OC1C(C)=C2,0.2515
CC12C3C4CC1C4C23O,0.304
OC1C2C3NC1(C#N)C23,0.2506
OCCC1CC(=O)CO1,0.2196
CC1(C(O1)(C=O)C=O)C,0.1874
C1CCCC(CC1)C#N,0.3491
CN1CC(=O)C1CC#N,0.2031
OCC(O)C1CC2OC12,0.3061
OC12CC1NC(=O)C2=O,0.1714
CCC(=O)c1ccoc1,0.2031
CC12C=CC3OC1C23C,0.2215
N#CCC1CCC11CO1,0.306
O=CC1C2NC1C21NC1,0.2108
C#CCOC(=O)C#N,0.2195
OCC1OC2OC1C=C2,0.2383
OC1CC1NCCC#N,0.2626
CCC(=O)NC(=N)C#C,0.2025
C1CC2C3OC=NC23C1,0.2495
CC(C)CC1CCO1,0.3255
CC1(CCC=C1)C1CO1,0.2614
[NH3+]CC1=N[N-]N=NC1=N,0.1427
CCc1[nH]c(=O)on1,0.2563
C#CC1N=COC2CC12,0.271
N=C1OCC11CN=CN1,0.2405
O=CC12CC3CC1C3O2,0.2188
C1CC23C1OC1C2CC31,0.3131
CC(C)(CCO)C1CO1,0.3384
CC1CCC(C)N1C=O,0.264
c1nc2c(o1)OC=NC2,0.2099
COCC1(NC1C)C#N,0.2867
CC(C)CCC(O)C#N,0.3128
c1nc(nnn1)CC=O,0.1628
C(=O)c1nc(=O)[nH]nn1,0.1379
CCCc1c(nno1)N,0.197
CC12OC3C(C1O)C23O,0.2949
O=CC12C3CC1C(=O)C23,0.2092
C1OC2C3C4C1C2N34,0.32
CC(CC#C)NC=O,0.2755
Cc1cnc(n1C=O)N,0.1617
O1C2C3OC1C=CC23,0.238
O=CC1C2CC3C2OC13,0.2184
CC1(C(=O)CC(=O)N1)C,0.2071
CC1COC2COCC12,0.3123
CC1OC2C(O)CC12O,0.3026
CCC1(O)CC2CN2C1,0.2898
N=COCC(C#C)C#N,0.2731
O=C1C2CC1C1NC1C2,0.2265
CC12C=CC3C4C3C1C24,0.2399
CCOC1=NCCCC1,0.2723
CC1C=CC2(C)CC12C,0.2442
CC1OCC1(C)CCO,0.3158
CC1=CCC(=O)NCC1,0.244
C(C#CC#CC=O)C#N,0.1827
C1CC1OC(=O)CC#N,0.2781
OC12C3CN(C13)C2C#C,0.2464
O=C1NC=NCC2OC12,0.2217
CC1(CCO1)C#N,0.2852
CC1CC2(CC2C#C)O1,0.2716
CC(O)C1=CC(N)=NO1,0.2319
N=COC(=O)C1CCC1,0.2474
c1cc(ncc1F)F,0.213
CC1COC1(C)C#C,0.2767
CC(C)C12CC3C1OC23,0.3057
CN1C2C3C2(C)CC13C,0.2909
CC(C(C)=O)C(C)(C)O,0.2288
CC1(O)C2CC(=O)C12O,0.2287
c1cn(cnc1=O)C=O,0.1775
CC1CCC11CCCO1,0.3121
CC1(NC1C#N)C1CC1,0.2838
CN1CCC(=O)C1,0.1935
O=CN1C2CCC12,0.2447
CC12CCC3C(O1)C23O,0.2823
C#CC1=CC2CC3C1N23,0.1827
c1nc(c(o1)CO)N,0.2048
CC1OC(=O)NC1CO,0.3054
OC1C=CC2C3CC3C12,0.2562
CC1OCC11CC(=N)O1,0.281
CC1=CC2NC2C1O,0.2401
CC1OC1C(O)C1CC1,0.32
OC12C3CN3C3C1OC23,0.296
OCC(C#C)C1CCC1,0.3016
CCC1OCC2CC12C,0.3327
CC1C2(O)CC(O)C12C,0.309
O=C1CCC2CC2NC1,0.2118
O=C1C2CC1N1CC21,0.2057
COC1CN2C(C)C12,0.2971
CC1C(C(C)=O)C1(C)O,0.225
C1CC11C2C3C2C2C3C12,0.3079
CC(O)C12CC1C(C)O2,0.305
CC(O)C1=NNC=C1C,0.2547
N#CC1OC11C2CC1N2,0.247
CC#CC(C)C(C)C#C,0.2887
C1CNC(=NC1)C=O,0.1707
CCCC1(CC1C)C#N,0.3146
CNC(C=O)C(C)C#N,0.1988
CC12CN1C1CCC21O,0.277
CCCC1CCC1OC,0.3258
CC12CC=C(C#C)C1N2,0.1954
CC(C)C#CCC#C,0.2874
C1C=C(CO1)CC#N,0.2386
O=C1CC2CC1C=C2,0.2052
C1C2CC1C1=C2ON=C1,0.2199
CC#CC1=CCCCC1,0.2089
CC1(CO)C2CC1C2O,0.3207
OC1CC11CCOC1=O,0.2764
OC(CC=O)C#CC#N,0.2098
OC1=NC(=N)N=CC=C1,0.1628
[NH3+]C1CN2N=CC([O-])=C12,0.231
CC1OC2CC(O1)C2O,0.3147
c1cc2c(cco2)nc1,0.1988
CC12CCC1=CCO2,0.2337
c1c(c[nH]c1C2CC2)O,0.2217
CCC12OCC1CC=C2,0.251
Cc1[nH]cc(n1)CO,0.2457
OC(C=O)C1CC1C#N,0.2309
CC1C2CC1C1(O)CC21,0.326
N=COCCOCC#C,0.2772
CN1CCCOC(=O)C1,0.2253
OC1C=CC2C3OC2C13,0.228
CC1CC(=N)OCC1=O,0.219
CC1(CO)CC1O,0.3205
CNC(=O)OCC#N,0.2766
CN1CC1C1C2CC1O2,0.3006
CC1C2CC2N1C=O,0.2616
OCC1(O)CC2OC12,0.3073
N=C1OCOC1C1CN1,0.261
CC#CC1CC2(C)NC12,0.2793
CC1OC2CC1C2C#N,0.2859
N#CC1OCC1C1CC1,0.2796
C#CC1CC23CC(O2)C13,0.2732
COc1[nH]c(cn1)CO,0.2383
OCC(=O)C1CCOC1,0.2279
CCC1CC1C(C)C#C,0.311
C#CC12CCC(CO1)O2,0.2834
NC=[NH+]C1=C([O-])ON=C1,0.1242
CC(C[NH3+])C([O-])=O,0.1383
Cn1ccc(=O)nc1F,0.211
O=C1CCC11COCO1,0.2037
CC(C)([NH3+])CC([O-])=O,0.1469
CCC1C=CC2NC12C,0.2407
CC(C)OC1CC1C=O,0.2236
c1nc([nH]n1)O,0.2703
CC12CC(C1)C=C2C=O,0.1867
CCC12C3CN=C1OC23,0.16
CC1OC1C#CC#N,0.2244
Cc1c(cc[nH]1)N(=O)=O,0.1758
CC1=CC(=N)NC(O)=N1,0.1911
CC(=O)N1C2CC2C1=O,0.2309
CCC1C(C)N1C,0.2892
CC1CC[NH2+]C1C([O-])=O,0.2618
C#CC1C2NCC12C#N,0.2461
C#CCOC(=O)N1CC1,0.2843
CC1(O)COCC2CC12,0.3203
C1CC12C(=O)C(=O)CN2,0.1283
CC1(C)CC1NCC#N,0.258
CC1OC11CC2(C)CC12,0.3311
CC1C2CNCC(=O)C12,0.1954
OC1COCC(O)C1,0.3065
CCC(C)C1C2CC1O2,0.3085
CNc1c([nH]nn1)N,0.2283
O=CCC12CC1NC2=O,0.2228
CC12CC1CCC2(C)O,0.3243
CN=C1OC2CC3C2N13,0.2737
NC1C(=N)OCOC1=O,0.2293
C[NH2+]CC(=O)[N-]CC#N,0.2745
COCC1NC1CO,0.3232
CC(C1CN1)C(F)(F)F,0.3198
O=CCCC1NCC1=O,0.2108
CCC(OC=NC)C#N,0.2692
CC#CC1C2OC2C1=O,0.1982
N#CC1C2CN1C2,0.2577
NC1(CC2OC2C1)C#N,0.2904
CN1CC1(C)C(O)C#N,0.2828
CC1(CO1)C1=CN=CO1,0.2324
c1cncnc(c1=O)N,0.1707
CC(O)C1=C(C)C=CO1,0.2295
CC1CCC(N1)C#N,0.2725
CC(C#C)C([NH3+])C([O-])=O,0.2654
OCC12C=CC3C1CN23,0.2128
CC1CC2OC1C(=N)O2,0.284
OC1C2COCC12C=O,0.2213
Cc1coc2c1[nH]nc2,0.2129
CC#CC1(OCCO1)C,0.2926
CC(C)(O)C1COC1=O,0.2792
O=C1OC2C3CC3CC12,0.2759
CC(C)N1CCNC1=O,0.2911
CC1=COC([O-])=C1C[NH3+],0.2282
O=C1CCCC11CN1,0.2192
CN=c1[nH]c(=O)cno1,0.1765
CC1=CC2COC2CC1,0.2558
CN=COc1cn[nH]n1,0.2271
CC1C(=O)C(C)C1(C)C,0.2213
CC1COCC2OC2C1,0.3249
CCC1(CN1)C1CN1C,0.2904
CCCC(C)COC=O,0.2862
CC12CC1C=CC=CC2,0.1953
CNCC(=O)C#CC=O,0.1499
OC1C2C3CC1(O)C2O3,0.2958
O=CC1CCCCC1=O,0.2149
CCCn1cc(nn1)O,0.2263
OCC(O)C(O)C1CC1,0.3052
CCC12CC3OC1C23O,0.2895
CC1NC1(C)C(F)(F)F,0.3473
CC(C)C(=N)OC(C)=O,0.2422
C1CC2(CC2)COC1=O,0.2719
CC1OC(=N)C11CC1O,0.2796
CC(C)C(=N)OC(N)=O,0.2678
CC1C2C3CC2C1(C)C3,0.3539
CC(CC1CO1)C#C,0.314
OC1C2CC2CC1C=O,0.2264
CCC1CCC1CC#N,0.338
OC1C2OC3CC(C3)C12,0.3063
OCC1C(O)C1C=O,0.2219
CC(=NO)C1OC1(C)C,0.2371
CC1NC2=NCC(O)C12,0.2534
CNC1=CC(=N)OC=N1,0.164
CC(O)C#CC=O,0.2047
Cc1cc(=O)n(cn1)C,0.1989
CC12OC1C(O)C2(C)C,0.3208
C#Cc1[nH]cc(n1)C=O,0.1979
OC1(CC2CC1N2)C#N,0.2829
CC1OCOC1=N,0.2878
OC1C2C1C1=CC=NN21,0.2385
CC(=O)C(=O)C(=NC)N,0.1683
O=CC1(CCC=C1)C#N,0.2203
CC#CC1(CCC1)C=O,0.216
O=COCC1(CO1)C#C,0.2799
CC1(CC1)C(CO)CO,0.3291
CC12CC3(C#C)C1CC23,0.291
CCC(OC=O)C(C)C,0.2855
CC12OC3CN(C13)C2=O,0.211
CC1CCOC1CC#N,0.2986
C1C2OC3CC4C2C1C34,0.3102
OC1CC(NC=O)C1=O,0.2147
CC1C2CC1(C)CC2O,0.337
Cc1cnoc1C(=O)N,0.2131
COC1C(C)C1(O)C#C,0.2551
CCC1=CNC(=N)C1=O,0.1491
CNC1=CC=NOC1=N,0.1572
c1c(nco1)OC2CC2,0.2199
C#CCOCC#CCO,0.2702
CC1OCCC11CN1C,0.3062
CC#CC1OC1C1CC1,0.2711
COC=NCCC#C,0.2656
CC1OC1(CO)CC=O,0.2251
CC12OC1C1CCC21O,0.3064
CC1OC1C1CN1,0.3387
CCC1(C)CC1(C)C#C,0.2906
O=C1OC2CCC12,0.2795
C[NH2+]CC(C)(N)C([O-])=O,0.2614
CCCC#CCC(=O)N,0.2681
C[NH2+]CCC(O)C([O-])=O,0.2727
CC(=O)CC1=CCCC1,0.2079
OC1CC11COC2CC12,0.2997
CC12CC1CC(CO)=C2,0.2436
CC(CC#C)C1(C)CC1,0.3103
C1C2C1C13CC21CC=C3,0.2089
N#CC#CCCC1CO1,0.2435
CC12CC(C1)C1CC1C2,0.3341
CCN1C2CC2OC1=O,0.2922
CC(CCO)C#CC=O,0.205
CC1OC2CC1C2(C)O,0.3181
CC12NC1CCC=C2,0.2509
Cc1c(c(co1)C=O)N,0.1632
OC1C2CN2C2CCC12,0.2824
CC1NC2C1OC2=O,0.2429
CC1=C(OC=N)C=CO1,0.2232
CC(CO)C(O)C(C)=O,0.2294
C1OC2C3C4C1C2CN34,0.3247
c1c(oc(=O)c(=O)[nH]1)O,0.1574
CCC12CC=CC1N2,0.2337
CC(=O)Cn1ccnn1,0.2154
OCC1CC1OC=N,0.276
COC=NC1C(C)C1O,0.2348
C1OC2CC3NC3C=C12,0.2438
CC1CC2CC(O)C2=C1,0.2409
CCC12CC3CN(C1)C23,0.2769
COCCn1nnnn1,0.2356
OC1CC2CC(=O)C1N2,0.2192
CC(C#N)C#CC1CO1,0.2683
CC(C#C)N1CC1,0.2845
c1nncn1CCCO,0.2657
CC#CC(=NO)C1CN1,0.1986
C#CC1C2C1C1OCC21,0.2848
CC1CNC(=O)C(C)N1,0.2427
Cn1ccc(=O)c(c1)O,0.1851
OC1C2C3(O)CC2(O)C13,0.3062
CC#CC12CC1C1CC21,0.2407
O=CC12CC(O1)C2=O,0.2116
CC12OCC1(CO)C2O,0.2762
CC(O)C(C)(CO)C#N,0.3184
NC1=CC(=N)ON=C1,0.1592
CCC12CN3CC1(C)C23,0.2933
OCC12CC1(O)CO2,0.2955
CN1CC11CC2NC12C,0.3017
CC12COC1(CO)CN2,0.2791
CC1C2C1C1=CN=CN21,0.2305
CC1C=CCC1CO,0.2611
CC1CC2CC1CC2=O,0.2231
CC12COC1C(O)C=C2,0.2544
CC#CC1COCC1=O,0.2077
CCN(CCC#C)C=O,0.2671
CCC1(C)C(O)C1O,0.2815
CC1(C)CC2C1N2C=O,0.244
CC12CN1C1C2CC1=O,0.1969
C1C2CC(C12)C1COC1,0.3222
N=COC1=CNC(=N)O1,0.1987
CN1N=NC=C(C)C1=O,0.1832
N=C1OC2C=CCCC12,0.2561
CC1CC2CC(CO2)O1,0.3199
OC12CC1C1CCCC21,0.3193
OC1CCOCC2NC12,0.3005
c1cncc(c1F)CO,0.238
O=CCCC1CCOC1,0.2231
OC1C2CC2OC1C#N,0.2695
OCCC12CN1CC2=O,0.2232
OC12CC1COC2=N,0.2635
COCCC1COC1,0.3204
CCC1=CCC(=NO)C1,0.2425
CC1(O)CC2(O)CC12,0.3191
c1c(nno1)C(=O)CO,0.2015
COC1C(O)C1O,0.2886
CCC(C)OCC#N,0.295
CC(C)CN1CCC1=O,0.2752
FC1=CC(=O)ON=N1,0.1746
CNc1[nH]c(=O)ccn1,0.1948
CC12CC1C(O)C1CC21,0.3093
CC(CC#C)C1(C)CO1,0.3118
OC1=NC(=N)C=NC=N1,0.1626
CC1CC1(O)C#CC#C,0.2092
CC(C)OC(=O)NC=O,0.2454
CC(O)CC#CC(C)C,0.3006
O=C1CC2C1OCC2=O,0.1902
CC(O)C1CC2CC1O2,0.3177
Cc1cnc2n1cn[nH]2,0.2045
C(C=O)OCC(F)(F)F,0.2298
COCC1CC1(C)C#C,0.2945
O=COC1=NCCC1,0.2449
C1C2CC3CC1C2O3,0.3332
C1OC11CCOCOC1,0.3369
CC1CN=C2NCC12O,0.2396
CC12CC3C(C1C=O)N23,0.2093
CCc1c(nc[nH]1)N,0.2183
CCC1C(C=O)N1C=O,0.2047
CCC12CC(O)C1C2O,0.2921
c1c(coc(=O)c1N)N,0.1552
O=C1C=CCCN2CC12,0.1841
OCC12CC3C1C(=O)C23,0.2466
CC1(C)CC1(CO)C#N,0.3022
CC1NC11COC1(C)C,0.3068
C(C#N)C(=O)NC=O,0.2226
CC(C)C(=O)C(=O)CO,0.1579
C1C(CN1CCCO)O,0.2974
CCC(=O)C(C)C(C)=O,0.2021
CCC(=O)N1CC1C=O,0.2201
c1c(c(no1)O)N,0.2193
OC12C=CC3(O)C1NC23,0.2227
C1C2N=C3OC4C(C12)C34,0.1859
CCOCC12CC(C1)O2,0.3081
O=CC1=CCC2CC1C2,0.1943
Cc1[nH]ncn1,0.2675
NC(=O)CC(O)C1CO1,0.2736
CC12CC(C)(O1)C21CO1,0.3267
CCC1N(C)C2CC12O,0.2623
N#CCC12CC1CC=C2,0.2504
OC1CC11CC=CC1O,0.2621
CC12OCCC1C1OC21,0.3092
[NH3+]CC(O)(CO)C([O-])=O,0.2598
CC(C=O)C1CCC=C1,0.2217
CC12CN3CC1C23C=O,0.2083
COC1CC(CO)CO1,0.3338
CC#CC1(C)COC1C,0.2936
N=COC1=NC=NC=N1,0.2163
CCOC(C[NH3+])C([O-])=O,0.1657
CC(C)(C)C#CC1CN1,0.2693
CNC(=O)NC(=O)NC,0.2683
CC#CCN1CC1C=O,0.2104
COC1CC(C#C)C1O,0.2889
CC1(CNC(=O)N1C)C,0.2949
CC1C2OC1C2N1CC1,0.3084
CC1(CN(C1)C=O)O,0.2667
CCC(=O)C(NC)C#N,0.203
C1CC1C(=O)OCC#N,0.2852
CNC1CC1(OC)C#N,0.2421
CN1CC1CCN1CC1,0.301
CCC1CC2(CO2)C1O,0.3206
C1OC1C1NC11CCC1,0.3161
OC1CCCOC11CC1,0.3265
C1C2C3OC4CCN2C134,0.1689
CC1CC2(C)OC12C,0.3252
CC1(O)CCC2OC2C1,0.3185
O=CC1C(=O)OC11CC1,0.2242
CC(O)(C#N)C(N)C#N,0.2751
N#CCC12NC3C1OC23,0.2752
CC(C=O)C1(C)CCO1,0.2217
CC(CCO)(CO)CO,0.3047
CCc1c[nH]nc1OC,0.2437
C1CN=CNC(=O)C1=O,0.1734
CC1=CCC(O)C(=O)N1,0.2137
c1[nH]c(=NCC#N)on1,0.228
O=CC12C3OC4C(C14)C23,0.2233
NC1=CC(O)=NNC1=N,0.1664
CCC1CC(C)CO1,0.3217
CC(CO)C1(O)CC1C,0.3229
CCC(C)(CC)C(=O)N,0.2727
Cc1cc(noc1=O)N,0.1675
CC1OCOC11CCC1,0.3272
CC1(OCC1=O)C#N,0.2213
CC(=O)Cc1cnco1,0.213
CC1C2C=CC(=O)C12,0.185
CC12C3CN1C3C2C=O,0.2067
C1CC1OC12CN(C1)C2,0.3234
CNc1c[nH]nc1C#C,0.1909
OCCN1C2C3OC3C12,0.2649
OC1C(=O)C(O)C11CN1,0.1964
CC1=CCC23CCC12O3,0.2342
O=COC1C2C3CC3C12,0.2274
[O-]C(=O)C[NH2+]CCC#N,0.2705
Cc1[nH]c(=O)n(n1)C=O,0.2138
CC1=CC(=O)OC(=N)O1,0.2084
CC1=CC(=O)C(=O)N1,0.1503
CC1(C)C2NC2C2NC12,0.2904
C1C2NC2C11OCC=C1,0.2339
CC#CC12CC3CC1N23,0.2593
C1C2CC11OCCOC21,0.3331
NC1=CC(=O)N(C1)C=N,0.2104
CC12NC3C1CC23C#N,0.2591
OCC12CC(CC1)C2O,0.3196
CCOC1COC1,0.318
C1NC23C4C5C4C12OC35,0.267
C1C2CCC3(CCO3)C12,0.3117
OCC1OCC1(O)C#N,0.2606
C#CC1=CC2OCC2C1,0.2066
CC1CC(C)=C(CO)C1,0.249
NC1=CC(=O)C(O)C1=O,0.1697
OC12CC3(O)C1NC23,0.2915
CC1(O)C(O)CC1CO,0.3244
c1cc(n2c1NCC2)O,0.2291
O=C1CC2NC2C2CN12,0.2524
C#CCC1=CC2OC2C1,0.2414
O=C1OC2C3CC1C23,0.2708
CC(C)(O)C([NH3+])C([O-])=O,0.2618
CC1C(C=O)N1CC=O,0.1974
CC1OCCNC1C=O,0.193
CC(CO)C1(CN1)C#C,0.2847
CNc1c(nc[nH]1)CO,0.224
CCC1NC(C)(C)C1=O,0.2165
CN=CN1CCOC1=O,0.2414
C1CC1(C#N)C(F)(F)F,0.3239
C#CC1(CN1)C1CCO1,0.2736
OC1CC1C12CC(C1)C2,0.3308
N=C1OCCCC11CN1,0.2549
CC1(CNC1=O)NC=O,0.2664
OC12CC1OCC1OC21,0.3118
NC1(C#N)C2CC(O)C12,0.2825
ON=C1COC(=N)C1O,0.2416
FC1=C(F)C(=N)NC=C1,0.1702
CC1NC1C1CC(=N)O1,0.2892
CC1OC(=N)NC1=O,0.2538
OCC1(C#C)C(O)C1O,0.2588
CC12CC1CC=CC2,0.2657
C1NC11COCC11CN1,0.2903
CC(CO)N=C1CCO1,0.2641
CN(C=O)C1CCCC1,0.2623
CC1CC(C)C1,0.3739
CC(C)COCC(C)O,0.3302
CC1(OC1C=O)C1CO1,0.214
OC1=CN(C=O)C(=N)O1,0.1905
CN1C2C3C=CC1C23,0.2134
CCC1OC2C3OC3C12,0.2994
CC1CCN2C(CO)C12,0.2875
CC#CCCC1CO1,0.3051
CC1OCC2CC2C1=O,0.2136
C#CCCC#CC1CN1,0.2622
OCCCC1NC1CO,0.3182
N#CCOCCC1CO1,0.2863
OC12C3CCC1COC23,0.3012
COC1C(C)OC11CC1,0.3001
C1C2COC3OC12C=C3,0.2238
[NH3+]CC1=C([O-])ON=C1,0.2327
CC1=CCC2CCC12,0.2578
CC1C2C3CC2(C#N)N13,0.2553
CN1CC2C(C#N)C12C,0.2474
COC1CC2C(C)C2C1,0.32
N=C1N=CNN=N1,0.1795
O=CC1C2N1CCC2=O,0.192
CN(CC=O)C(=O)C=O,0.1704
CCC1NC1(C=O)C#N,0.2229
OCC1(NC1C#N)C#N,0.2624
N=CN1C=NCC1C=O,0.1853
CC#CC#CCC(=O)N,0.2245
CCN1CC1(CC)CO,0.2941
CCC(C)C1C(C)C1C,0.3321
CCC1CCOC(=O)O1,0.3193
OC12CC3(O)COC1C23,0.2932
O=C(NCC1CO1)C#C,0.2324
CC1(CO)CC(O)C1O,0.3018
C1CC1C12CC3CC1C23,0.329
COC(CO)C1(O)CC1,0.3148
CC12CN1C(=O)C2CO,0.2296
CC12CN1CC(O)CC2,0.2885
CC1C(=O)NC=C1C#N,0.1895
NC(=O)NC1CCC1=O,0.2194
N#CC12COC3C1OC23,0.271
CCN1CCC(O)C1=O,0.2721
C#CC(=O)C(=O)CCO,0.1515
O=CC1OCOC2CC12,0.2212
CN1N=NC(=N)NC1=O,0.1816
CC(=O)OC(C)(C)CO,0.2792
CC12OCC=C1C1NC21,0.2209
CC1CCN(C=N)C1=O,0.2198
CC(C)Nc1cn[nH]n1,0.2119
O=C1C=CON=N1,0.2023
C1OC1C12CC(CC1)O2,0.329
OCC12CC1CC1CN21,0.3163
CCc1c(nccn1)F,0.2096
Cn1c(cnn1)CCO,0.2501
COCCCC1CC1C,0.3391
CC12CN1C1CCC=C21,0.2333
CCOC(CO)C(C)=O,0.2214
CC12CN1C1CC21O,0.285
COc1[nH]c(=O)[nH]n1,0.2615
CC(=N)Nc1c[nH]cn1,0.2147
CC(CCO)OC1CC1,0.3183
Cc1c(n[nH]n1)NC,0.2162
CC(=O)C(C)(C#N)C#N,0.2257
CC1CC=CC11CC1,0.2475
OC12CCCC1CCC2,0.3329
N=COC1CC1CC#N,0.2807
O=C1CC23NCC2OC13,0.1811
Cc1[nH]c2cc[nH]c2n1,0.2044
OCC1CC2CCC2C1,0.3366
CC1(COC12CC2)C,0.3034
CC1NC1C1COC=N1,0.269
CCc1nc(co1)C,0.2405
Cc1c(nc(cn1)O)N,0.1838
CC(=O)C1OCC1O,0.2059
CC(N)(C#N)C1(C)CO1,0.2874
CC1OCC=CCC1=O,0.2152
CC12CC1(C#N)C1CC21,0.2883
OC1CC2C3CCC2C13,0.3393
CCOCC(O)C1CC1,0.3258
C1CC1CC2COC2,0.3235
NC1=NCC2(CO)OC12,0.2449
O=C1CNC1CN1CC1,0.2102
N=C1CC2N3CC2(C3)O1,0.2603
COCCc1cnco1,0.2426
OC1(CC#N)CC=CC1,0.265
[NH3+]C1C(C#C)C1C([O-])=O,0.2582
OCCC(=O)C(O)C#C,0.2253
CN(C)c1cc(co1)N,0.2145
CCC(C=O)C(=N)OC,0.2218
CC12C(C#C)C1N1CC21,0.2573
[NH3+]CC(NC=O)C([O-])=O,0.1893
c1c([nH]nn1)N,0.236
CC(CO)C(C)(C)C#N,0.3193
CN1C2CC1(C)C21CN1,0.2917
CN1C(C2CO2)C1(C)C,0.2982
CC1=CCC(C)(O)C1O,0.26
CCC1(CO)NC1C=O,0.2178
C1OCC2COCC1O2,0.2978
OCC1OC=NC2CC12,0.2507
OCCCC12CN1CC2,0.3047
CC1COC2OC=NC12,0.2741
C1CNc2c1n[nH]n2,0.2085
CC12CC1(CO)C1CC21,0.3184
OC1CC(=O)C1OC=O,0.2149
COCCCCO,0.3305
NC1=CC(N)=NNC1=N,0.1632
CCC(OC)C(O)C#C,0.2708
COC(=O)C1=NCCO1,0.2101
CC(=O)c1c(ocn1)N,0.189
Cc1cnc([nH]c1=O)C,0.1941
CCc1ncccn1,0.2086
CC12C3CC1(O)CCC23,0.3102
O=C1CCC(N1)C#C,0.2652
O=C(CCC#C)C1CN1,0.2278
CC(O)C(CO)C1CN1,0.3056
CC1(O)CCCC2OC12,0.3281
CN1CC1C(=O)C(C)=O,0.1414
OC12CC3OC4C1C2C34,0.2993
OC1C2C3CC1(O)CN23,0.2852
c1[nH]c(=O)nc(n1)O,0.2149
C1C(CC1=O)C#CCO,0.2167
CC1CNC2=CN=NN12,0.2308
CC12CC1(CO2)NC=O,0.2499
Cc1cc[nH]c1CO,0.234
CC(=O)C(CO)CC#C,0.2278
CC1=C(C#N)C(=N)OC1,0.1962
Cc1cnc([nH]1)COC,0.242
C1C(CC1=O)CC(=O)N,0.2223
Cc1cc(co1)C=O,0.187
C#CCC(=O)C#C,0.2029
CC(=O)OCC(=O)C#N,0.1976
CC1(COC1=O)OC=O,0.2608
CC1C2C3N1C3(C)C2=O,0.2287
CCC1C2C=CC(O)C12,0.2354
CC#CCCCO,0.3035
Cc1cn(c(=O)n1C)C,0.225
CCCC(C)C(C)=O,0.2299
CC1CC2(CC1O2)C#N,0.2711
CC(C)(C#N)C(O)C#N,0.3045
O=C1C2CC1C(=O)OC2,0.2225
CC12CC1(O)C1NC21C,0.2991
CC(C)C(=O)COC=N,0.2186
CCCOC(CO)C#C,0.2883
COC12COC1C2C,0.3047
OC12COC1C(C2)C=O,0.2167
N#CC1NC=NC11CC1,0.2329
CCN=C1COC(=O)O1,0.2652
COC1(CC1)C(=O)C=O,0.1552
O=C1CC2CCN2C1,0.195
CN=COC(=O)C=O,0.1714
CC1=Cn2ccnc2C1,0.1986
CC#CC1CC1(O)C#C,0.2534
C#CC#CC#CC1CN1,0.1731
CNC1C(C#C)C1C#N,0.237
Cn1cnn2c1nnc2,0.2212
N=COC1CC1N1CC1,0.2361
CC(=N)Nc1ccno1,0.2109
N=C1C=NC=CNC1=O,0.1529
ON=C1C2CN3CC2C13,0.2355
CCC1CC=C(CO)C1,0.2594
CC1(O)C(=O)CNC1=O,0.2099
OC1C2N3C1CC23C#C,0.2638
COC12CC1(O)CC2C,0.2919
CC1CC2CC(O)C1O2,0.3131
CCC1(C)CN(C)C1=O,0.2795
CCOC(=O)N(C)C,0.2995
N=C1CC2CC2(O1)C#C,0.2634
OCC12CC1C1CC2O1,0.3118
CCOC1(CC1)C=O,0.2208
NC(=O)CC12CC1OC2,0.2632
N=C1C2OCC3CN1C23,0.2321
C1CN(C1)C(=O)NC=O,0.2382
CCC(CCO)CC#N,0.3101
COC1C2CC1(CO)N2,0.3204
OC1CCC2CC12,0.3301
c1cc([nH]c1C(=O)N)N,0.1839
CCOC(=O)C(=NC)N,0.206
CC12NC1CCC2C=O,0.2147
CCCOC(=O)CC#N,0.2867
CC(C)C(NC=O)C#N,0.2752
CCOC1C(C)CC1=O,0.2012
CN1C=CC(=C1)C1CO1,0.2415
CC12C=CC3=CCN1C23,0.1705
C1OC11CCC2OC12,0.3327
CC1CC(C)(C)OC1C,0.3111
CCC(C=O)(C=O)NC,0.1894
CC1C(O)CC11CN1C,0.2905
CC12CC1CCC(=O)O2,0.2692
CC(O)C12CN1CCC2,0.3
CC12NC34CCN(C13)C24,0.2772
CCC1(CC1O)C(C)=O,0.2308
c1c(c(coc1=O)N)N,0.1781
COC1CC(CCO)C1,0.3232
OC12CC1C=CC1NC21,0.2343
c1c(c(c([nH]1)O)C#N)N,0.2034
NC12COC(C1)OC2=O,0.2564
CCC1C=CC2OCC12,0.2494
COC(=O)C1=NCCN1,0.1839
NC1C2NC2CC1C#N,0.2788
Cc1c(n[nH]n1)C#C,0.2202
CC(CC1CC1O)C=O,0.2257
ON=C1CC=CC11CN1,0.2186
CC1OC(C)(C)C1=O,0.2194
OC1CC2CNC12C#N,0.2617
CN=C1CN=C(N1)C#N,0.1817
c1cn[nH]c1CC=O,0.207
OC12COC1C1OC21,0.2871
CCCC(CC#C)OC,0.2897
CC1=CCOC(CO)C1,0.2621
C1CC(O1)C1=CNN=C1,0.2544
C1CC11CC2CC2CO1,0.3234
OC1C2CN(C2)CC1=O,0.1841
CC1(O)C2NC2C2OC12,0.306
c1coc2c1cno2,0.2209
CC1(O)C2OC(=O)C12O,0.2468
CC12NC1C1(CC1)C2=O,0.2161
OC(C#N)C1=NNC=C1,0.2634
CC(NC(C)=O)C(C)=O,0.2151
CC#CC12COCC1N2,0.2789
CC(C)C1C2CC(C)C12,0.326
CCC12C(O)C1OC2=N,0.2626
C#CC(=O)C1(CC1)C#N,0.2061
CC1CC2CC(=O)C12,0.2159
CC1C2C3C4=CCC13C24,0.1498
CCCCC(C)CC#C,0.3136
CCC(=O)C(=O)COC,0.1574
CC1=C(N)OC(=N)C=N1,0.1486
CNC=Nc1cnco1,0.1803
C1C2CC(C12)C1CCO1,0.3256
C1OC1C1C=CC2CN12,0.2286
Cc1nc(c2n1CC2)O,0.2258
OC12CC1(O)C1(CC1)C2,0.2923
C1CN=C(C(=O)N1)N,0.2014
CC1(N)C(C#N)C1(C)O,0.2645
c1c2cnoc2[nH]c1N,0.2035
CCC1N=C(N)OC1C,0.2763
c1c(nc2n1cn[nH]2)N,0.1998
Cc1c(ncoc1=O)C,0.1948
C1CC2CC3C1C3CO2,0.3061
C#CCN1CC1C#C,0.2585
CC1NC(C)(C#C)C1=O,0.2102
CC1=CC(O)C(C)(O)C1,0.256
O=C1C=CCN2CCC12,0.1559
CC1OC23CC4C2CC134,0.2764
Cc1coc(c1C)C#N,0.2034
OC1CC2C(C3CO3)C12,0.3227
CC1OC1C1(O)CC1O,0.3108
NC1=C(O)C(=N)NC=N1,0.1652
COC12CC1CC=C2C,0.2472
OCC1OCOC1=O,0.2737
c1c(c(no1)N)CCO,0.2268
COC1OC2CC3C2C13,0.338
COC1CCCC(=O)C1,0.2228
CCC#CC(=O)OCC,0.2341
OC1C(NC1=O)C=O,0.213
N#CCCC1CCO1,0.3002
CC1NC(=O)CC1(C)C,0.2716
c1nc(no1)CCCO,0.2468
CN1CC(=O)CC1C#C,0.1962
Cc1c(cn(n1)C)N,0.2218
CN=COC1(CC1)C#C,0.2684
CC12CCC3C(C=C1)C23,0.2404
C#CCC1NC1CC#N,0.2952
C#CCOC(=O)CN,0.2574
O=C1C2C3CC1C=CC23,0.1988
COC1CC=CCO1,0.2672
Cc1c[nH]c2c1COC2,0.2408
Cc1c(c(=O)cco1)O,0.1842
Cc1cc(c([nH]1)C)C=O,0.1897
CC1=CC2OC2C1CO,0.24
C1OC23COCC2OC13,0.2933
OC1C2N=COC(=O)C12,0.2381
C1C2CC3COC1C2O3,0.2954
NC1(CC2COC12)C#N,0.2618
OCC12CC(C1)OCC2,0.3028
CC1CC2OC3CC2C13,0.3169
CC1CCCC2CCC12,0.3503
CC12CC3(C)CC1C2O3,0.3113
C#CCNC(=N)C#N,0.213
C#CC1CC2CC2O1,0.2731
CC1CC2NC2C(=O)N1,0.2483
CN1CC2(C#N)C(O)C12,0.2346
CC1(O)C(O)C1C=O,0.2202
CC(C)Cc1ccco1,0.2344
CCC(C)(O)C1CO1,0.3424
CCOC(CC#N)C=O,0.2217
O=C1CC2NC2(C1)C#N,0.2272
OC1CCC=C1CC#N,0.2619
CC12CCC1COCC2,0.3219
CC1(OCOC1=O)C=O,0.2067
CC#Cc1c[nH]c(=O)[nH]1,0.1859
O=CCCC1CN2CC12,0.2149
CC(C1CC1)C(F)(F)F,0.3768
CN1CC1C(=O)CC=O,0.1918
CN1C2CCC(=O)C12C,0.2062
CN=c1oc(no1)O,0.2597
CN=C1CN2CC2CO1,0.2554
COC(C)C(=O)C1CO1,0.2073
CCC1CC2CC2(C)O1,0.3076
C1C(=O)CC12CN2,0.2165
C#CC1CCC2OCC12,0.2983
N1C2C1C13OC4C1C2C34,0.2898
C(C1CCO1)N1CC1,0.3179
OC1CCC2=C1OC=N2,0.2324
NC(=O)C1OCCC=C1,0.2477
OC1COC11CCOC1,0.3038
CCC1C2C3CC2(C)C13,0.3679
CC(C)N1CC1(C)C#C,0.2752
[O-]C(=O)C[NH+]1CC2CC12,0.2625
C1CC11CC2(CO2)CO1,0.315
CC1(C)CC2CCC2C1,0.3538
CC1COC2=NNC=C12,0.2328
c12c([nH]c(=O)[nH]1)nn[nH]2,0.2035
CN1CC11CC2NC12,0.3019
CC12NC1C1NC21C=O,0.1787
CC12OC1(C=O)C1CC21,0.2144
CC12OC1CCC2(C)C,0.3279
C1C2C=C3CCC=C3C12,0.1889
N=C1OC2CC1OCC2,0.2651
CCn1c(=O)nccn1,0.1688
CC1N(C)C1(C)CO,0.2973
OC12CC3CC1OCC23,0.3137
CC12COC3CC1C23C,0.3175
COC(CC1CC1)C#C,0.2997
C1C=CC(=O)CNC1=O,0.1747
CCC12CC(OC)C1O2,0.3236
CC12COCC1COC2,0.3256
CCC(C)(C)NC(=O)C,0.273
OCC(O)(C#N)C1CO1,0.2982
N=C1CCN=C(N1)C#N,0.1984
CC1C2C(CO)C2C1C,0.3184
CCC1(C)OCC1O,0.3066
N#CC12CC(C1)(N2)C#N,0.2608
COC(C)C1=CN=CO1,0.2419
CC1C(C)C2CCC12,0.3327
CC(CC#N)N(C)C,0.2568
C1CC11C2CC1CC2,0.3619
OC1CC(C=O)C2NC12,0.2152
CC1OC2C(C3CO3)C12,0.3109
C#CC(=O)C(=O)C(=O)N,0.1532
NC(=[NH2+])C[N-]C(=O)C#N,0.217
O=CN1CC2C1CC2=O,0.2112
c1c(c([nH]n1)N)N,0.2386
CCCC1CCOC1C,0.3189
O=CN1CC2CCC2=C1,0.199
c1c(noc1N)CO,0.2277
C1C2CC1C1OCCC21,0.3352
CCC12CCC1(O)CO2,0.2979
CC12CC1C1CC(C1)C2,0.3316
CC1(O)CC2CC12CO,0.3021
CCOC12CCC1OC2,0.3018
CN1C2C=CC3(CO3)C12,0.2171
CC1C2CN1C2C#C,0.2562
CC1(C)C2C3C1CCN23,0.315
CC#CC1(CO)CN1C,0.2656
CC(=O)C(OC=O)C#N,0.2195
C#Cc1ccoc1N,0.2044
CCC1CC(C)C1OC,0.3161
c1c([nH]cn1)OCC#N,0.2149
CC#CC(C#N)C1CO1,0.2816
N=C1OC2CC(=N)OC12,0.2676
O=C1C2CC2C1CC#C,0.2234
CCCC12CC3C1OC23,0.3083
c1cc(oc1)C2COC2,0.2301
OCCC#CC1CC1O,0.2797
CNc1c(c(c[nH]1)N)O,0.2268
CC1C2CC(C2)C1C#C,0.3094
OC1CC2(CO2)CC=C1,0.2606
N#CC1=CC2CC3C2C13,0.2021
CC1OC2=NNN=C2O1,0.2142
OCCC1C(O)C1O,0.2932
O=C1COC2OC=NC12,0.2071
CC#CC1C(C)C1C#N,0.2636
COC1CC1C(O)C#N,0.2715
OC1(COCC=C1)C#N,0.2556
CC12N=CN3CC1(O)C23,0.2129
CC12CC1CC21CCO1,0.3179
CNc1cc(c[nH]1)N,0.2228
Cc1c([nH]cn1)CC=O,0.1697
FC1=C(F)C(=O)ON=N1,0.1801
CC(CCCO)N1CC1,0.3077
CC1(O)CC(O)C2OC12,0.3221
CC1C=CC2OCC=C12,0.2447
NC(=N)C(=O)CC1CO1,0.1782
OC1CNC2=C1C=NO2,0.2193
CC1NC(=O)C1N1CC1,0.2485
CCC(=O)N1CC=CC1,0.2401
CC1(CC(=NC)O1)C,0.2789
C1CC23OC12CCC=C3,0.2333
OC1C=CCC2COC12,0.2585
CC1=NNN=C1C1CO1,0.2449
CC1(OC1C#C)C#N,0.2661
CC12OC1C(=O)C=C2,0.1723
CC(C)C(O)CO,0.3184
CC12C3C4C1N4C(=O)C23,0.2217
CC(=N)OCCCC=O,0.2302
CN(CC#N)C(=O)OC,0.2805
C1CC2(C1)COC2=O,0.2763
CC1C2C3CC(O3)C12O,0.315
CC1NC1C1OC1(C)C,0.3189
CCC1C2COC(=N)N12,0.2778
FC(F)(F)C1CN=CN1,0.2545
CC1=CC2COC1C2=O,0.2169
CCCC1CN1C,0.3043
C1CC1N=C(N)NC=O,0.2046
OCC12CC3CC1C2C3,0.3295
OC12CCC1(CC2)C#N,0.2753
O=C1NCC2OCC2O1,0.3013
OC1CC2C1OC21CC1,0.2835
CC1OCC=CC1CO,0.2572
C1C2OC3C4OC(C24)C13,0.309
CC1CC2CC2(C1)C=O,0.2262
CC1CC(=O)C(=O)O1,0.1726
CCCCCC(O)CC,0.3327
C#CC1CCC=CC1,0.267
CC1(CC(N1)C#C)C#N,0.2628
CC12CC1(CO2)C1CC1,0.3036
CC(O)C12CC(C1)C=C2,0.2378
N=COC1(COC1)C#C,0.2737
OC1CC(=N)OCC1=O,0.219
CC1(C)C2CC(CO)C12,0.324
OC1CC23CC(C2)CC13,0.3229
CC1(O)C2C3NC3C12C,0.2726
CC(=NCCC#C)OC,0.2739
CCC1CCC(C)(C)O1,0.3171
CCNc1cccn1C,0.2365
C1OC23CC(OC2)C13,0.2821
CC12CC1(O)CC21CC1,0.3134
COCC1C2CCC12C,0.3272
COC(=O)C(C)C1CN1,0.2557
CN1CC2OCC12C,0.2753
O=CC1C2CC3CN3C12,0.1967
COC1C2OC1(C)C=C2,0.2382
COC1CC2CC12OC,0.3249
C1C2CCC3C4CC23N14,0.2497
CC1CN=C(N1)C(C)=O,0.1709
C1OC1C1CCCCC1,0.3468
OC1CNCC(=C1)C#N,0.1952
OCC1NC2CC12C#N,0.2578
CC12CC(O)C3C1CN23,0.2936
CNc1c(cccn1)O,0.1897
NC1(COC1=N)C1CN1,0.2635
C1CC2(C1)CC23CCC3,0.3327
CC(O)C12OC1CC=C2,0.2474
CC(O)C(CC=O)C#C,0.2249
CC1=CCCC1C=O,0.206
OC1C2CC11OCC1O2,0.2798
CC(NC(C)(C)C)C#N,0.2757
CC12C3C4CN=C(C14)N23,0.1549
N#CC1CN1CC1CC1,0.2689
CC12CN1CC2(O)C#C,0.2619
CC12C3C4CC1N=C4N23,0.1222
CN1C2C3NC2C13C=O,0.1882
COc1ccc(cc1)O,0.1966
OC1CC11OCCC1O,0.2914
CC1CCCC1C#C,0.3062
O=CC1C(OC1=O)C#C,0.2232
CC1CC1C(=O)C(N)=N,0.1949
CC1N(C)C(C)C1=O,0.1923
ON=C1C(O)C2COC12,0.2249
CNCC(=O)C#CC#N,0.1337
OC1COC1(C=O)C#C,0.1943
N#CC1CC2C=CCC12,0.2626
CC(O)C1NC1(C)C#C,0.2744
CC(C)C1CC(CO)C1,0.3383
CCCn1cccc1C,0.2388
CCC1CN1C1CCC1,0.3026
C#CC#CC1(CN1)C#C,0.2062
CC12CC(C1)C1C(O)C21,0.3105
CC(O)C1CC(C)(C)O1,0.3224
CCCOC1CCC1,0.3313
Cc1ccc(o1)CC=O,0.1882
CCN=C1C(=CCO1)C,0.2102
CC1C(N1C)C1(C)CN1,0.3067
CC12CN1CC(O)C2,0.2905
COC(=O)CC#CCO,0.2612
CC1OC2COCC12,0.3315
CCCC1C(O)CC1O,0.3055
CC(O)C12CC1CC2O,0.3154
CC1(CO)OCOC1=N,0.2839
OCC(C=O)C1CC1,0.225
O=CC1CC(=O)NC=N1,0.2181
O=C1C2CC3CC2C1C3,0.2222
OC1CC2OC1C2C=O,0.2177
COC(=O)CC(=O)CO,0.2312
O=C1CC2CC(C#C)C12,0.2148
C1CC1(C2COC2)O,0.295
OCC12CC1CC(=O)O2,0.2778
Cn1c(ccnc1=O)F,0.186
OC1CCC(=N)OC1,0.2754
CCC1(CCC1C)C#N,0.3282
OC1(CC#C)CCC=C1,0.2632
CC(C(N)=O)C1(O)CC1,0.2714
OCC(C#C)C(O)C=O,0.2217
CC(N)C(C)(N)C#N,0.2828
CC1NCC1=O,0.2182
OCC1CN2C(C#N)C12,0.2631
CN=C1COCCCO1,0.2628
C1C(CO1)(C(=O)C#N)O,0.1698
[NH3+]CC1=N[C-](CO1)C#N,0.1459
OC1C2OCC(O)C12O,0.2694
CC#CC12CN1C(C)C2,0.2514
CC(=O)C1(C)CN=CO1,0.2197
CC1(O)C2C=CCC12C,0.2352
COC=Nc1cnoc1,0.2101
c1cn[nH]c1C2COC2,0.2529
COC(=O)NC(=O)N,0.2734
c1cc(=O)onc1N,0.1625
C1C(=CC(=O)C1=NO)N,0.1725
Cn1c(cc(n1)N)OC,0.2403
CCC12CC1NC(=O)N2,0.2829
C1NC11C2NC1C21CO1,0.3094
c1[nH]c2c(n1)C(=O)C=C2,0.1303
CN1C=C(C=O)C2CC12,0.1726
O=C1CCC11OC2CC12,0.2008
OC1C2CN2C1C#N,0.2607
[NH3+]CC(C1CO1)C([O-])=O,0.2758
OC12C3CC1N3C2C=O,0.2147
CCCNc1cnon1,0.2032
CC1CCC2CC=CC12,0.2628
CCCC1COCC1=O,0.2151
CC1COC2(C)CCC12,0.3178
C1CN1C(C=O)C=O,0.2029
CC(CC1CCO1)C=O,0.2254
N=C1OC=CN=C1C#N,0.1467
CC(C)(CC1CO1)C#C,0.3156
c1cc([nH]c1CC#N)N,0.219
OC1C2C3CN3CC12O,0.2753
CCOC1CCCC=C1,0.2615
CCC(C)(C)C(O)C=O,0.2304
CCC1OC11CCC=C1,0.2507
N=C1OC=NC(=N1)C#N,0.1675
Cc1cc(oc1)C#N,0.2027
COC1C2COCC12O,0.3042
COC12CC1CC2(C)O,0.3037
N=C1OC2CC(=O)OC12,0.2726
OC12CCCC3CC1C23,0.318
CCN1CCC(=O)C=C1,0.1822
CC(CC#C)OCC#C,0.2859
[NH3+]CC1=NOC([O-])=C1,0.2058
CC1(CC(=O)O1)C,0.2846
C1CC12CCN2CC#N,0.2499
Cc1cc(=O)cnn1C,0.1866
COC(CO)C(N)=O,0.2598
CC(=O)CN1CCC1,0.2135
CC12OC1C(C#N)C2O,0.2893
CC1CC(=O)C(=C1)C#N,0.1841
CCCOC(=O)C#C,0.2379
OCC1C2OC2C1C#C,0.2802
CC1OCOCC1C#C,0.3013
CC1C=C(C)C2C(O)C12,0.2324
OC12C3CC1CC=CC23,0.2392
C#Cc1c[nH]nc1N,0.2081
CCC#CC1CC(=O)N1,0.2729
CC(=O)C1=CC2CC1O2,0.1811
CC12OC(C=C1)C2CO,0.2308
C1CC(=O)NC=C1C#N,0.1894
O=C1C2CC1(CC#C)O2,0.2433
NC(=O)C(C=O)C1CC1,0.2067
OCCC1C2C3OC1C23,0.3048
CC1C2C(C1O)C2(C)C,0.3113
C1CN1C2=CC(=O)NC2,0.2151
C1OC2=NCCOC12,0.2635
O=C1NC2C3CC3C2O1,0.3171
CC1CC2OCC12C#C,0.2767
CC1(C)CC1C(=O)CO,0.2372
COC1CC2CCC1C2,0.3246
N=C1OC2CC1COC2,0.2855
C#CC1CC2CCC=C12,0.2443
CC(=O)CN1CC1C#C,0.2248
OCC1CC2C(C#N)C12,0.2936
CC1OC1C(=O)C(N)=N,0.188
ON=C1COCC2OC12,0.2433
NC12C(OC1=N)C2C#C,0.2508
CN1CC1C(C)(C)C#C,0.2665
N#CC1OC2COC12,0.2641
COCC1(C)OCC1C,0.3186
CC(C)(CC#C)NC=O,0.2764
CC(C)C(=NC)OC=O,0.2382
NC(=O)C12CC1CC2,0.2662
CCOC1CCCC1,0.3267
C1C2C1N1C3COC3C21,0.2622
CC1C2COC2C1=NO,0.2285
CC1CC2CC1OC=N2,0.2682
CCC(C)C1(O)COC1,0.3087
OC1CC2CC1(C2)C=O,0.219
CC(O)C12NC1CC=C2,0.2416
CCn1cc(c(c1)O)O,0.2316
CC1(O)CCCC=CC1,0.2514
OC1COC1CC#N,0.3005
COCC(CO)CC#N,0.3042
COCC1(CCO1)C#N,0.263
CC1(C)CC2(CN12)C=O,0.2136
C1CC1(CN2CC2)C#N,0.2862
CNC(=O)C#CC1CN1,0.2231
CCN1C=NCC1=N,0.217
NC(=O)CC1NC1C=O,0.2036
NC1=NC2CC1OC2=O,0.2315
CC1([NH3+])CC1(C)C([O-])=O,0.2727
OC(C=O)C#N,0.234
C1N2CC=CC3OCC123,0.2421
CC(C#N)N1N=NN=N1,0.2668
O=C1CC2CC2C(=O)N1,0.2325
C1OC11C=CC2CC1O2,0.2268
OC1=C(F)N=COC1=N,0.1712
CNc1c(n[nH]n1)C#C,0.1891
CC1C2COCC12C,0.3276
N=COC1=NC=CO1,0.228
C1C2CC3OC2C13,0.328
OCC1(O)CNC(=O)C1,0.2749
Cc1cnc(o1)N(=O)=O,0.1754
CC1C2(C)COC12C#C,0.2411
CC(O)C1COC11CC1,0.2877
NC1=NOC(=N)C(=O)O1,0.177
CC(CO)C12CCC1O2,0.315
CCC(C)(CC)OC=O,0.278
CC1(CO)CC1(O)CO,0.3014
Cc1cnc(=O)ccn1,0.1642
O=C1CCC(OC1)C#C,0.2111
OC12C3OC4C(OC14)C23,0.3037
CN=c1n(nno1)C=O,0.1865
Cn1cccc1CCO,0.2383
CC12C3C1C1N2C3C1=O,0.2109
N=C1COC(=O)C2CN12,0.2367
CC1C=CC2CN2C1=O,0.2333
C1C2C3OC4CN2C13C4,0.2988
CC12C3CC1C(=O)CC23,0.2234
OC1C2CC1N2C1CC1,0.2773
CC1COC2(C)COC12,0.3182
CN=C(NCC#N)OC,0.251
COC1(C)CC=C(C)C1,0.2602
COC(C)(CO)C#CC,0.2819
C(=O)Nc1c(nno1)N,0.199
C1CC1C12NC3C1OC23,0.2903
CC(C)C(=O)CCO,0.2309
C(C#CC(=O)N)C(=O)N,0.2174
CC1OC2CCC1(C)O2,0.3218
CC1NC1C1COC1=N,0.2781
OC12CC(O)(C1)C=C2,0.2383
CC1C2CC2C=C1C#N,0.2062
CC1(CC#N)CC(=N)O1,0.2877
CC12CC(CCO)(C1)O2,0.3105
CC1C2CC1C(C)O2,0.3283
CC1OCOC2COC12,0.327
CC(=NO)C1(C)CN1,0.2392
CN=C1OC=CC(N)=C1,0.1646
COCC1OC1C(C)O,0.3314
CN1C(=N)C=CC1=O,0.1742
O=CCC1C2C3CC1C23,0.2243
C#CC1CC2=CN=NN12,0.2548
OCC1=NC=NC(=N)O1,0.1858
O=CN1CC1C1CO1,0.2552
c1c2c(n[nH]1)OCOC2,0.2408
C1CC1CCC(=O)C#N,0.2033
OCC12CN(C1)C21CC1,0.2929
c1coc(nc1=O)C#N,0.1792
c1([nH]c(=O)nc(n1)N)N,0.2277
C1OC2C3CCOC2C13,0.3027
OC1C2CC(O)C=CC12,0.2357
FC1=COC(=N)C(=N)O1,0.1796
N#CC1NC11C2CC1O2,0.2641
CC#CC1N=CNC1=O,0.2198
COC12CC1C1C(C)C21,0.2784
N=COCC1C2CC1C2,0.2825
C#CC12CC3(CC3)C1O2,0.2611
CCN1CC2OC(=N)C12,0.2433
NC1=C(N)C(=O)NC1=N,0.1439
OCCC1(CC1O)C#N,0.295
CC12CC(CNC1=O)O2,0.25
C1CC1n2c(=O)onn2,0.2159
O=CC12CNC1C(=O)O2,0.1936
CC#CC1(C)CC1O,0.2807
CNc1ccoc1OC,0.2086
CCC12CCC1OCC2,0.3176
CC1OC=NCC2OC12,0.2668
Cn1cnc(cc1=O)F,0.1991
CCCN=C(C#N)N,0.2179
COC12CC3(C)C1OC23,0.3067
CC#CC12NC1C1CC21,0.232
O=C1NC2CCOC12,0.2561
O=CC1C=CCOC1=O,0.2241
OC12CC=CC1OC2=O,0.2528
CC12CC3CC(O1)C23C,0.3148
CCC1NC11CCC1O,0.3084
C1CCOC2(C1)COC2,0.3131
C1CC(C1)OCC(=O)N,0.2676
O=C1NCC1N1CC1,0.2475
CC1CC2C(OC=N)C12,0.274
COC1OCCC2CC12,0.3321
C1OC2C3OCOC2C13,0.3116
O=CC1=NCC(N1)C#N,0.1756
CC12OC3C1CC=CC23,0.2379
CC1(CC1)OC=NC,0.2735
CC1OCCC2CC12O,0.3098
CCC1=CON=CC1=N,0.1809
CC12CCC1C2OC=N,0.2729
CC1=CC(=[NH2+])O[C-]1C=O,0.169
O=C1C2CC3OC2OC13,0.2222
OCC1CCOC1C#N,0.2838
CC1CC2C(CN2C)O1,0.2855
O=C1CCC=C2CNC12,0.2019
CC1OC=NC2C(O)C12,0.2456
C#Cc1cc(on1)CO,0.2218
Cc1c(nn(c1O)C)O,0.2515
OC1C2CC3CC1(O)C23,0.3137
C#Cc1ccccn1,0.2011
O=CNC1=CCC2CC12,0.2055
CC1OCCCC11CO1,0.3215
CC12NC3C1OC23CO,0.289
CCC(CC)C#CC#N,0.2457
O=C1OCC2OC12,0.2509
C1CC2(CC2)CC1=NO,0.2499
CC(C#C)C1CC2CC12,0.3047
CC12OC1C1CCC2O1,0.3224
CC1(CCO)CCC=C1,0.2626
C#CCNCC=O,0.2205
OC1CC11C2CC2C1=O,0.2257
O=CC1NC2(CC12)C=O,0.1956
c1c(nc2n1cno2)O,0.195
CCOCC1(CO)CN1,0.3261
CCc1cc(no1)C,0.2476
Cc1ccc(nc1O)C,0.2086
CCCC1C2C3CN2C13,0.3054
CCC1(C)OC1(C)C#C,0.2834
CC(O)C1C2C3CN1C23,0.2855
CC1=CCC(=O)CC1,0.2231
Cn1cc(cn1)CC#N,0.2565
CC(C)C(O)C(O)C#N,0.2869
CC1CC1(CC=O)C#C,0.2172
CC1CC2=NC(N)=NN12,0.2257
CC12CN1C1CC21CO,0.2783
CCC1(C)CC(O1)=NC,0.2788
OC12C3CC3C1OC2=N,0.2595
CC1(O)C2OC(=O)C12C,0.2662
COC12CC1C(C)C2=O,0.2142
CCC1CC1C,0.357
CC(C)C(=O)C(=O)OC,0.179
CCC(CC=O)NC=O,0.2282
COCC(C)(O)C(C)O,0.3283
CC(C)C1(C)CO1,0.3432
CCNc1c[nH]cc1C,0.2302
CNC(C)(C#N)C(C)=O,0.2231
CC1(C=O)C2C=CCN12,0.1987
O=C1C2CC2OC2CC12,0.2241
CC1C2CCC3CC3C12,0.3068
OCC(O)C12CC1CC2,0.3071
CCC(=O)C(C)CC#C,0.2283
CC1=CC2C3CC1(O)C23,0.238
CC1CC(O)CC2CN12,0.2959
c1c(c(no1)O)C#N,0.2339
CC1C2CCCC(C)C12,0.3277
Cn1c(c(nn1)N)O,0.2387
Cc1c(nccc1F)C,0.2384
C#Cc1conc1O,0.2173
CCC12OC1CC1NC21,0.3085
CC12CCOC1C(=N)N2,0.2613
C1C2CCC=CC1O2,0.2481
NC(=O)C1COC(N)=N1,0.2564
CCC1C2N3CC2(C)C13,0.3143
CCCc1cn[nH]c1O,0.2511
CC1C2N3C1CC23CO,0.3269
CC1(CC2(CO2)C1)C#N,0.305
CCC(C)OC(C)CO,0.3189
OCC1CCC2CCC12,0.337
NC1C2C3CN3C12C#N,0.2405
OC12CC1NC(=O)OC2,0.2861
OCC(NC=O)C#C,0.2752
CC1(C)CCC1C1CO1,0.3428
CC(C#C)C1CC(O)C1,0.3096
N#CCC12CC1CCC2,0.3144
CC(C)C(=NO)C#C,0.2092
N=C1OC2COCC2=C1,0.2112
NC(C#C)C1=CN=CO1,0.239
CCC(CO)OCC#C,0.2821
CCN(C=O)C(=N)C#N,0.2075
CN1C(=O)CC=C1CO,0.2101
CC12C3OC1C3C21NC1,0.307
CCC1(C)C(C)C1(C)C,0.3224
CC1=CCOC11CC1O,0.2309
CC12CN3C(C13)C(=O)C2,0.2142
c1ccoc(=O)c1,0.1788
C#CC#CCC#CC#C,0.2163
CC1CC(O)C2(C)NC12,0.3055
CC1CC=C(C#N)C1C,0.2199
O=CC12CC1CC1CC21,0.2261
OC12CC3C(C1)C23C#N,0.2727
OC1C(O)C1C1CN1,0.2792
CC1(C)C2CC(O)C12,0.3197
OC12COC3CC1CC23,0.3017
CC#CC12NC3C1NC23,0.2534
OCC#CC(O)C#C,0.2662
C1C2N1CCC21CC1,0.3139
CC12COC(C=C1)C2=O,0.2145
CCC1(CC2CO2)CO1,0.3424
CCC(COC=O)OC,0.2737
OC1(COC1C#C)C#N,0.2593
c1coc2c1C(=NC2)N,0.2153
CC1C2CC1(C)NC2=O,0.2603
CN=COCCOC,0.277
CC1(COCC1=O)C,0.2157
COCC1(OC1C)C=O,0.2209
CC12CC1C1NC1C=C2,0.2426
OC1C2C3CN3C12,0.2807
CN1CC2OC2C1CO,0.2989
NC(CO)C(O)C#N,0.294
c1c(c(c([nH]1)O)N)O,0.2131
N#CC12OC3=NCC1C23,0.1607
CC1C=CCC=CC1C,0.2545
CC(COC=N)C(C)=O,0.2311
CC1=CC2(CO2)C(=O)N1,0.1946
COC1(C)C2OC1C2O,0.2952
CC12CC1N1CC21,0.2909
O=C1CC2C3CN3C2=C1,0.1969
C1CNC(=O)C12COC2,0.2675
C#CC(=O)n1cccn1,0.1942
N#CC1C=CCC11CO1,0.2661
OC1CC(C#C)C(=O)C1,0.2164
C1C2CC3OC3CC1O2,0.3254
CN=C1OC=COC1=N,0.1886
CC1C2OC(CC#C)C12,0.2879
OC1(CC2CO2)CCC1,0.3172
C1C2OCC3=C2N1C=C3,0.1911
CC1=NC2=C(ON=N2)O1,0.1454
OC12C3CC4CC1C4C23,0.318
NC(CO)C1=NC=NO1,0.234
CCc1nc(on1)NC,0.2436
N=C1C=CN=NN1C=O,0.1545
CC1CCC(=O)C11CO1,0.2033
CC1=COC(=N)N=C1N,0.1777
C1OCC11OCC2NC12,0.3102
CC1CC1C1OC1C#C,0.2746
CC#CC1NC1CC=O,0.2172
c1c(c(=O)c(c[nH]1)O)O,0.1792
CC1CC(=O)NC1CO,0.2705
CC(OC1(C)CC1)C=O,0.2177
Cc1cc(ccc1N)F,0.1978
CC(C)C1OC2CCC12,0.3105
C#Cc1cccnc1F,0.1936
c1c(c[nH]c1O)CC#N,0.2327
CC12CC(CO)(C1)OC2,0.3232
CCC1CCCC(=N)O1,0.2772
CN1C2COCC12C#C,0.2641
CC(=O)Cc1ccco1,0.2054
OC1C(=O)CNC11CC1,0.2014
N=CN1CCNCC1=O,0.2101
N=C1NC2=C(O1)N=NO2,0.1353
CN1N=CC(=N)N=C1F,0.1848
CCC1CCC1OC=O,0.2862
c1ccc(cc1)C#N,0.2156
OC1CC=CC1O,0.2612
CN1CC23NC(C=C2)C13,0.2196
CC1CCCC1(C)CO,0.3338
OC1CC1(O)C1CN1,0.2852
Cc1cn[nH]c1NC,0.2353
c1c[nH]c2c1C(=O)C=C2,0.1257
c1c2n(cn1)CCO2,0.236
CC(O)C1(O)CC1C#C,0.2835
N=C1CC=CCO1,0.2595
CC#CC(C)NC(C)=O,0.2692
CC12CCCC1N=CO2,0.2716
CN1C2(C)CC1(C2)C#N,0.2466
CC12C3CC1N(C=O)C23,0.2491
c1cc(oc1CC#N)N,0.2112
CC1NC1C(=O)CC#N,0.2172
CC12COCC(O1)C2=O,0.2313
O=CC1CC=CCCO1,0.2146
CC(C)C(C(C)C)OC,0.3201
CCC1(O)CCC11CC1,0.3167
CC1C2NC3C2OC13,0.297
CC#CCC1NC1CO,0.2999
CC(C)C1CC(=O)C1C,0.2226
N#CCC12OC1C1OC21,0.2799
NC1=CC(O)=CC(=N)O1,0.1758
N=C1OC=C(OC=O)O1,0.2079
O=C1C2OC1C1CCC21,0.2333
CC(C)(C=O)C1CCC1,0.2231
CC1=NOC=C1C1CN1,0.239
OCCC1CCN=CO1,0.2722
CCC(O)C#CC=O,0.2047
CC1(O)CCC=C1C=O,0.1888
COC1(C=O)C2CC1N2,0.1841
N=C1OC2CC1OC2=N,0.2703
CC1OC2C3CCN3C12,0.2661
CN=C1COCC2CN12,0.2342
COC(CO)C#C,0.2891
CC12OC3CCC1CC23,0.3125
CC12OC1CC2CC#C,0.3025
CC12C(O)C1OC2=O,0.2576
CC12CN3CC(=O)C1C23,0.2048
CC1CC11C2OC2C1=O,0.2132
CC1=C(C(=O)OC1)C,0.2324
NC(=O)C1CC2CC2C1,0.2737
C(CO)Nc1n[nH]nn1,0.206
CC1CC(CC#C)C=C1,0.2613
CC1OC(C)=NCC1O,0.2663
CC12CC(C1)NC(=O)C2,0.2684
CC1CNC(=O)C1(C)C,0.2726
CC#CC1OC1C(N)=O,0.2504
CC1OC2C=C(C)CC12,0.25
CC1=CCC(CCO)C1,0.2597
CC1NC1C1NC1(C)C,0.3073
CC12CC(O)C(O1)C2=O,0.229
FC1=CON=CC1=N,0.1793
CC1N2CC1(C2)OC=O,0.2598
C#CC(CO)(CO)O,0.2759
OC1C2CC(=O)C1CO2,0.2246
CC(C)CCOC(C)C,0.3283
CN1C=CC(=NO)C1=O,0.1448
OC1CC2NC(=O)OC12,0.3022
CC(O)C(=O)CCC#C,0.2299
C1CNc2c1n[nH]c2N,0.2185
CN1C2CC11CCOC21,0.2832
OC(CNC=O)C1CN1,0.2789
CCCCN(C=N)C=O,0.2232
CN=c1[nH]c(n[nH]1)C#C,0.1647
CC1CN=COC1(C)C,0.2756
COC12CCC1(C)CC2,0.3223
C1NC11C2C3CN2C13,0.3065
OC1CC2(CC#N)CC12,0.2966
CC1C2C3C4C2C1C34O,0.3073
CCCOC12CC1OC2,0.3073
CC12CCOC1C1OC21,0.3075
OC12CC1C1CC21C#N,0.239
O=C1CC2CC2C2CC12,0.2205
CCC1(CCN1)C#N,0.2678
CCC1CC2OC2CO1,0.3382
c1c[nH]nc(c1=NO)F,0.1592
CCn1cnc(n1)C=O,0.2001
NC(=[NH2+])NC(=N)C([O-])=O,0.2016
CC(O)C#CCO,0.2867
O=CC1CC2COC2C1,0.2222
OC1CC(=N)OC2CC12,0.2695
CC1CC2=NOC(=N)N12,0.224
OC1CC2COC1C2,0.3224
COC(=O)CNC1CC1,0.2267
OC1=CC(F)=NC(=O)O1,0.2029
CCCC1CCC1=O,0.2193
CC1C(O)CC1=NO,0.2475
CC1=CCCC=CCC1,0.2528
OC1CC2CN3C2C13,0.2904
CCOc1c(n[nH]n1)C,0.2317
OC12CC1C(=N)OC2,0.2772
N=COC(=O)NC1CC1,0.2683
N=C1CC(CC=O)CO1,0.2262
O=C1C2CC1C1CCC21,0.2283
CC1CC2CCOC2=N1,0.2729
CC1OC2(C)CCC1O2,0.3282
[NH3+]C1C2CC1(O2)C([O-])=O,0.2577
COC12C3OC1C=CC23,0.2276
N#CC1NCC2CCC12,0.2708
COc1cnc(nn1)N,0.1612
O=C1C2CC(C2)C11CC1,0.228
NC(=O)C(O)CCO,0.272
CCc1conc1C=O,0.1991
CC1C=C(C)CC11CO1,0.261
CC1(CN1)C#CC1CC1,0.2733
C[NH2+]C1COC1C([O-])=O,0.2615
OC1CC2CCC12C#C,0.2788
CC1CC(C)NC(=O)C1,0.2676
CC12CCC1OC2C#N,0.2667
CCCCCC#CC#C,0.2315
CC1C(C)C11COC=N1,0.2482
C#CC1OC1CCC#N,0.2808
COC1CC(C)CO1,0.3427
CNC(=O)COCC#C,0.2651
CC1CC1C(C)(C)O,0.3251
CC#CC1(O)C2CC1C2,0.283
CCC(=O)N1CC(C1)O,0.2679
CC(C)C1(C)NC1CO,0.3136
C1C2C3OC3C3CN2C13,0.2838
COCC12C3C4C(C13)N24,0.2746
COC1CNC(=O)C1O,0.2704
COC12CC1C(O)C2=O,0.2045
Cn1cnc(c1N)C=O,0.1927
CC12CC3OC4C(C14)C23,0.308
CC(O)C1=C(C)NN=N1,0.2439
c1c(ncc(n1)F)O,0.1878
COC1CC2(CC12)OC,0.3243
CC1(CCC1O)NC=O,0.2748
Cc1c(nco1)CO,0.2349
C1CN1C1C2CC=CC12,0.2475
NC(C([O-])=O)C1([NH3+])CC1,0.2562
C#CC1OCOC11CC1,0.2795
CC(C)(C)C#C,0.3214
CCCCC(OC)C#C,0.3014
CC(=NO)C1=CCCC1,0.1946
CC(O)C1CC1CC=O,0.2271
O=CC1OC(=O)C1C#C,0.2248
c1c(nn[nH]1)CO,0.2514
N#CC12OC1C1OCC21,0.2495
CC1C(O)C(O)C11CO1,0.2851
CC12COC(C)(C)C1N2,0.3233
CC1(CC=O)CCO1,0.2213
NC(=O)C(O)C(O)C#C,0.268
CC1NC(=O)CC1C#N,0.2695
CC1=CC(=N)OCC=C1,0.1748
CC(C)c1c(cc[nH]1)N,0.2237
COC(CO)C(C)CO,0.3224
CC(O)C1CC1C#N,0.3056
CC12CC34N=CN(C13)C24,0.2126
O=COC1C2CCOC12,0.2514
CN1N=NC(=N)N=C1C,0.176
N#CCC12CC3CC1N23,0.2904
N#CC12CC1C=CCC2,0.2435
CN=c1n(c(no1)N)C,0.2357
C#CC1CCC2(CC2)O1,0.2699
CCC1CC(=O)C1C=O,0.2095
CC(C)C#CCC1CC1,0.2987
C1C2CC3=CCCCC123,0.2485
CC#CC1(CC1)CC#C,0.2777
OC1C=CC23CC(C2)C13,0.2431
CC1N=C(NC1=N)C=O,0.1589
CC1OCC2OC3C2C13,0.3048
OC1C(=O)OCC11CO1,0.2668
CC12CC3CC1(C)C2O3,0.3098
O=C1NC2CC3CC2C13,0.2555
C#CC(=O)CC1COC1,0.1814
CN(C)C(C)(CN)C#N,0.2622
CC12CC(CC#N)(C1)O2,0.2779
O=C1C2OC2C11CCC1,0.2096
CCC1CC2C1C2(C)C,0.3369
CCC#Cc1cnco1,0.1992
CC1C=C(C)COC=N1,0.232
CN=c1n(nco1)C=O,0.2022
c1cn(ccc1=O)C=O,0.1732
CCOC1C(O)C1CO,0.2964
CC1OC1CCOC=N,0.2844
C#CC1N=C2OC3C1C23,0.157
C1CC1C1C2CC1O2,0.3136
CC12NC1(C#C)C1NC21,0.2702
C1OC11C2C3C4C3C1C24,0.3204
CC1C(C)C(=NO)C1C,0.2491
C1C2CCOCC3C2N13,0.3028
c1c(oc(n1)N)N=CN,0.1707
CCC1(CC1O)OC=O,0.2711
O=CC1CCC2CC12,0.2247
CCOc1cnon1,0.2304
CC1C(C)(O)C11COC1,0.2975
CCC1C(O)CC1=O,0.2199
O=CCC12OC3C1OC23,0.2177
C1CC2C3COCC2C13,0.331
O=C1NC2C3C4CC13C24,0.2485
Cc1c(n(cn1)C)CO,0.2368
CC12CC(CO)C1(C)N2,0.2875
CC1CCC(C#C)=C1C,0.2057
OC1C2C3CC(C1O)N23,0.2949
C1CC1c2n[nH]nn2,0.2397
CC12NC1C1NC1C2=O,0.1883
CC(=O)c1cc([nH]c1)N,0.1836
O=C1CC2C3NC3C2=C1,0.1905
CCC(=O)C(C)N1CC1,0.2276
CC#CCC(F)(F)F,0.3034
N=C1CCN=C(N1)C=O,0.1696
C1CC1(COC=O)C#N,0.2828
CC1C2C3OC2C(C)C13,0.3172
Cc1coc(c1N)C#C,0.1855
CC1CCC1C1(C)CO1,0.3377
N=C1OCC(=O)C11CO1,0.1961
O=C1CCC(C=C1)C#C,0.1872
OC(C=O)C1=CC=CN1,0.1681
C#CCOC1CN=CO1,0.2783
N=COC1=COC=N1,0.2233
CN1C2CC1(C#C)C2O,0.2328
COC1CC(O)C(O)C1,0.3123
CCCCC(C)CCC,0.3771
CC(=O)C12NC3C1OC23,0.2079
COC=NC(C)CCO,0.2611
COC1CC(C)OC1C,0.3229
CC1=C2CCOC2CC1,0.2495
C1OC11CC2CCC2C1,0.3261
C1C=CCC1(C#N)C#N,0.2635
NC(=O)NC1CNC1=O,0.2812
CC1NC2(COC2)C1O,0.2918
CC1CNC(=O)CC1C,0.2684
CCC(CO)C(C)C=O,0.2285
C#CC1C2C(CN12)C#C,0.2595
COCC1CN=CO1,0.2719
CC1(OCC1=NO)C#C,0.2472
CCC1C2CC1C2=NO,0.2702
O1C=CC=CC=CN=C1,0.1941
CC1COC(C)(CO)C1,0.3198
c1c(c(n[nH]1)O)C(=O)N,0.2037
Cc1c[nH]c(c1N)OC,0.2269
COC1C(C)CC11CC1,0.3164
CCC12CC(C1)N2C=O,0.2481
N#CC1=CC2CC2OC1,0.1982
CC1=CCCC1CO,0.258
CC#CC(O)C(C)(C)C,0.2864
COCC1(CC1O)C#N,0.2771
CCC12CC3C(C1)N23,0.3115
OC12CC1(O)C1OC21,0.2972
OC12CN3C1C3(C2)C#C,0.2701
OCC12COC3C1OC23,0.3
OC1CCNC(=O)C1=O,0.1764
Cc1cc(=O)ccn1C,0.2015
CCC(CC)(CC=O)O,0.2229
OC12CC(C1)COC2=O,0.2757
CC1C2CC11CC(O)C21,0.2915
CC1CC2C1C2C(C)=O,0.2198
O=C1COC(C1)C#N,0.2205
O=CC12CC(N1)C21CN1,0.199
CC(C#N)C1=CON=C1,0.2485
OCC1OC23CN(C2)C13,0.2556
CCC1=CC2CC1C2=O,0.2413
O=COC12CC1C1NC21,0.2301
NC1=[NH+]C=C([O-])C(=O)O1,0.1461
c1c(nc([nH]1)C2CC2)O,0.2223
CC1CC1(O)C#CC#N,0.2158
CC#CCC1NC1(C)C,0.2955
COc1cnc(nc1)N,0.1754
CNc1nc(no1)C#N,0.2036
c1c(nc[nH]1)CO,0.2532
CCN1C2CC1(C2)C=O,0.1913
OC1=C(O)C(=N)C=CN1,0.176
CC#CC1CCOCO1,0.2867
CC12CC3C(C1=O)C23O,0.2397
c1nnnn1CC=O,0.2241
CCC(C)C1CC1O,0.3318
CCn1c(=O)onn1,0.2296
NC1=COC(OC=N)=N1,0.1972
C1OC2C1N1C=CC=C21,0.2347
C1CC(C1)(C2COC2)O,0.2958
CCOC1CC1OC=O,0.2578
O=CC1=CNC(C1)C#N,0.1834
OC1CCCOC1,0.3136
OCC12NC1CC2O,0.3031
CCCOCC1CC1,0.3396
COCc1c(onn1)N,0.2087
OCC#CC1CCC1=O,0.2114
CN1CC(C)(O)C1C=O,0.203
CC1(COC1)CCC=O,0.2267
CC1C(C=O)N1CCO,0.1873
CCCC1(C)CC(=N)O1,0.2892
CC1CC2C(C1)N2C=O,0.256
CC1(O)CC=CC1CO,0.2615
CC1CC2CC(=NO)C12,0.244
COC(CCC#C)C#N,0.2809
O=CC1OC11C2CC1C2,0.2203
CC1C(O)C11CC(=O)O1,0.2785
O=C1CC23CCN2CC13,0.1973
CN=C1OC(C)CC=C1,0.2026
C1CC1OC12CC1CC2,0.3253
CC1=CCN2CC12C=O,0.1997
C1CC12CC(C2)CCO,0.3403
COCCC1NCC1=O,0.2191
COC(=O)C(=O)CC#N,0.1834
OC1C2OC2C1(O)C=O,0.2075
C1CC1C12CN1C1CC21,0.2913
CCOC1(CC1)CO,0.3299
OCC1NCCC1=O,0.2052
CCC12CC3C(C)C1N23,0.3201
O=C1NC2C(O1)C2C#N,0.2831
CC1(CO)CC2OCC12,0.3069
CC(C)(C=O)C1(C)CO1,0.2274
CC1=NCC(C)(O)CO1,0.2633
OC1(C=O)C=CCC1=O,0.1855
CN1C(C=O)C1C1CO1,0.1956
CC(C#N)C1NC1C,0.3008
CC12CC(CO1)NC2=O,0.2509
CCOc1cncn1C,0.2458
OC1C2CN2C=C1C=O,0.1835
CCOC1COC1C#N,0.2723
CC1OC(=N)C11CN1,0.2715
CC1CC(C)(C)C=C1C,0.2586
CC(O)C(C)(C)CO,0.3275
COC(C)C(C=O)C#C,0.222
CC(C#C)C12CN(C1)C2,0.2752
Cc1cc(=O)[nH]nc1C,0.177
CNC(=O)NCC(C)O,0.2978
C1Cc2c(onn2)C=C1,0.1749
CC1(CC2COC12)C=O,0.219
c1cc2n(c1)CC(=O)C2,0.1743
c1c(ncc(n1)O)N,0.1672
COC(=O)CC1COC1,0.2521
CC12CC3N1CC3(O)C2,0.2977
CCCC#CC1CN1,0.2671
CCOC(CCO)C#C,0.2927
c1cnoc1NC2CC2,0.2245
CC12CC(O)(C=O)C1N2,0.2136
CC1=CCc2n1nnc2,0.2127
CC1(O)C2CCCC12C,0.3094
C(=O)Nc1[nH]c(=O)[nH]n1,0.1906
CNc1nc(on1)OC,0.2428
CC1(CCOCOC1)C,0.3223
CC1CCCC(C)C1=O,0.2245
CCC1C(C)CC1C,0.3473
COCC1C=CCC1O,0.2638
O=CC1CCC11CCO1,0.2125
CC1CC2OCC2(C)C1,0.3157
O=CC1(CCO1)C#C,0.2063
CCn1c(ccn1)O,0.2544
c1[nH]c2c(n[nH]c2n1)N,0.2063
CCOc1ccoc1,0.2337
C1C2CCC3OC12C=C3,0.22
CC1CCC(=O)C1(C)C,0.2198
Cc1c(=O)onc(n1)O,0.1668
CC(O)CC(C)(N)C#N,0.2861
c1c2c(c([nH]1)N)nco2,0.1958
C#CC12CC1(OC2)C#C,0.2237
COCC12COC1CN2,0.2816
CC1CC(O1)C(C)(C)O,0.3073
C#CC1=CCC2OC2C1,0.2137
CC1N=CN2C(CO)C12,0.2359
C1COCC(=CC1=O)N,0.1937
OC1C2CC2C2(O)CC12,0.3092
CC(C)(C)N=COC=O,0.2388
OC1CC(C1)C1CCC1,0.3324
CCC12CC(C)C1(C)O2,0.3201
CCC1(CN1)C1(C)CN1,0.3035
c1nc(on1)C#CC=O,0.1778
CC12CC(CO1)C2=O,0.2074
CC(CO)C1=COC=C1,0.2425
CC1(C)OC1C1(O)CC1,0.3218
CC(O)C1C2C3CN2C13,0.2996
OC1C2CC2C2NC12,0.2981
Cn1cc(nn1)COC,0.2492
CN(C)C(=O)C1CN1,0.2621
CC1(C)OC2CC3C2C13,0.321
OCC12C3C4C(CC14)N23,0.3069
CCC1C(C#N)C1(C)C,0.3085
COCC(=O)C(F)(F)F,0.2273
N=C1CNC2(CC2)CO1,0.2549
N#CCC1NCC11CO1,0.282
CC(=O)c1ccnn1C,0.2039
C1C2OC3CCC2C13,0.3241
CC12C3C4C(COC14)N23,0.3189
CC(CO)OCCC#N,0.2989
COC12CC1(C)N(C)C2,0.2885
CC1CC(O)C=CC=C1,0.1911
CCC#CC1NC1C#C,0.2596
CCC1OC(C)(C)C=C1,0.2483
C#CC(=O)c1ncno1,0.184
CC12OC(CC1O)C2=O,0.229
CC12CC(O)C1(C)O2,0.3112
OCC1CC2C1OC2=O,0.2795
O=CCC1CC(C1)C#N,0.2271
OC12C3C4C1OC2CN34,0.2837
O=CNC(C=O)C1CN1,0.2063
CC1(OCC1C#N)C#C,0.2691
OC1=NNN=C1OC=N,0.2178
CC(CC#N)C1CN1,0.2894
O=C1NC=C2C3OC3C12,0.1936
CCc1c(nnn1C)C,0.2415
CC(=O)C(=O)N(C)C=O,0.168
O=CC12CN1CC21CC1,0.1978
OC1C2CC=CCC1O2,0.259
CC(O)C1(CN1C)C=O,0.2088
OC1C2NC=NC1C2=O,0.1857
CCC1C(C)C1C1CO1,0.3341
ON=C1C2CC2C2NC12,0.2317
CC#CC1CN1C(C)=O,0.2499
CCC(C)OC1COC1,0.3127
O=C1CN2C(CC#C)C12,0.2171
c1c(ocn1)CN2CC2,0.2401
CCc1ccc(o1)N,0.2178
ON=C1CCC2CC12O,0.2294
OCC12OC1CC1OC21,0.3052
CCOc1nc(no1)C,0.2603
CC1NC(C#N)C(C)=C1,0.2396
CC1(O)C2NC3C2NC13,0.2783
Cc1ccc(o1)CCO,0.2286
C(=O)n1c(c(nn1)N)O,0.1884
OC12C3C4C1C2(C#N)N34,0.2316
CC12COC1C(N2)C=O,0.2029
COCC12OCC1C2O,0.2905
CC1(NC1C1CC1)C#C,0.2717
C1CC2C3C=CC(C1)C23,0.2429
C1OC2CN3C=NCC123,0.2376
CC1OC1CCCC#N,0.3048
CCC1(COC1)OC,0.3205
CC(C#C)C12CCC1N2,0.3065
CC12CN1CC1(CC1)C2,0.3174
CN1C2C3CC1(C)C2O3,0.2864
CCCC1CC(=O)C1,0.223
O=CCC1C2C=CC1C2,0.216
CC1CC1(C)OC=O,0.2745
CCCC(=O)C(=O)NC,0.1796
c1ncnc(n1)C=O,0.169
OC1(CC1OC=N)C=O,0.2067
COC1CC1NCC=O,0.1996
c1[nH]c2c(n1)OCCO2,0.2206
CC1(C)CCC(O1)C#C,0.2913
CC(C(O)C=O)N1CC1,0.2116
O=C1OC2C1CC21CO1,0.277
OC1CC2C1CNC2=O,0.268
COC1CCC(O)C1C,0.3146
CC1OC(=O)C2OC12,0.2508
CC1COC2C1C2(C)O,0.2993
CN=C1NCC(C)C1=O,0.1808
NC(C#N)C1CO1,0.2964
O=C1CN2C3(CC3)CC12,0.1993
C#Cc1ncnc(n1)O,0.2072
CCCC1NC(=O)C=C1,0.2151
O=C1N2CC2C11CCC1,0.2294
CC1OCC2NC12CO,0.2934
O=CCC1C2OCOC12,0.2318
CNc1c[nH]cc1C#N,0.1935
CCC(=O)C1(C)CCO1,0.2177
C1Cc2c([nH]nn2)C=C1,0.1845
COCC#CC1CC1C,0.2731
OC1CC23CCCC12N3,0.2921
N#CC12CC1CCN2,0.2755
C#CC1CCC2(CC2)C1,0.3112
c1nc(c(o1)CN)CO,0.2332
C1C=C(C(=O)O1)C#N,0.2078
CN=c1c(=O)[nH]cn[nH]1,0.1844
CC1CC2(CO2)C11CO1,0.3053
CC1=CC2(C)CC2(O)C1,0.2373
CC(O)C(C)(C#C)C#N,0.2987
CC1=C2CCC=C2CC1,0.1933
CCN(C)C(=O)COC,0.2669
Cn1c(noc1=O)C#C,0.1975
C1OCC11CC2OC2C1,0.3177
CN=C1NC(=O)CO1,0.2434
C1CC2(CCC3OC23)O1,0.313
Cc1cc(nc(n1)O)N,0.2161
CCC(O)C1=NC=NO1,0.2608
CN1C(CO)CC1C#N,0.2548
CC1(COC1)C#CC=O,0.1997
CC1C(COC1=N)C=O,0.2257
CC#CCC(CO)CO,0.2961
CN1C2C1C1C3OC1C23,0.3075
NC1=NC(N)=[NH+][N-]C1=N,0.1374
CCOCCO,0.3431
CC1C2C3OC3C12,0.2853
COC(C)=NC(C)C#C,0.2683
N=CN1C2COC2C1=O,0.2118
CCN1CC1C(N)=O,0.239
COCC(O)C(N)C#N,0.2955
OC12CC1C1CC2C1=O,0.2355
O=C1OCC11CC2CC12,0.2609
CC1(CCC1)C(O)C=O,0.2306
Cn1ccnc1N2CC2,0.2443
CC12CC3C4C(O1)C4C23,0.3106
C#Cc1cc([nH]c1)CO,0.218
CN=C1CC(O)C(=O)O1,0.25
COC(=O)c1[nH]ccn1,0.2033
CC1C2OC2(C#N)C1C,0.2746
CC1(CN1C(=O)N)C,0.2869
C#CCCCCCCO,0.3165
OCCC1C2OC(=N)C12,0.2756
CC1C(C#N)C1C#N,0.2968
OCC12CCC1C2C#N,0.2997
CCN1C2C3NC3C12C,0.2667
CN1C2C3CC2C(=O)C13,0.2089
OC1CC1CC(=O)C#N,0.1928
CC12C(C=O)C1C1CN21,0.1898
CN1N=NC2=C1ON=N2,0.1467
Cc1c(c(on1)N)OC,0.2234
CC1(O)C2NC2C1(C)O,0.2928
C1C(=NO)COC1=O,0.2441
O=CC1COC1C1CO1,0.2187
CC(CC1(O)CC1)C#C,0.2999
CC1CC(=O)C11CCO1,0.1958
N=C1NC=NC=CC1=N,0.1698
C#CC#CC1(COC1)O,0.2206
COCC1CC2CC1C2,0.3388
CCCC1C2OC2C1=O,0.2116
CC#CC(C)CNC=O,0.2728
Cc1cc(on1)N(C)C,0.222
OC1C2CCC(C2)C1O,0.3036
CCC1OC1CO,0.3411
CC1CC2C(O1)C1CN21,0.3067
OC12CN3C(CC13)C2=O,0.2043
CC1(O)COC(=O)C=C1,0.2103
CC#Cc1ccc[nH]1,0.2
COc1c[nH]nc1,0.2329
CC1C2C3C(C)C1C23C,0.323
CC(O)CC(F)(F)F,0.3389
C1CC1(CNC(=O)N)O,0.2926
CC1CC2CC1CO2,0.3154
OCC1=CC=NC(=N)O1,0.1661
N=C1OC2C=CCNC12,0.2255
C(=O)c1c([nH]c(=O)o1)N,0.178
CCCC1(O)CC1CC,0.3249
COC(C#C)C#N,0.2754
C1C2C1C13CCC21CC3,0.2859
C(CCO)CC=O,0.229
CC1C=CC2C(C#N)N12,0.2307
CC(C)CNC(=O)NC,0.299
OC1CCCC(O)C1O,0.3136
CC(C#C)C(C)N1CC1,0.2945
N=C1OC=NC=CC1=O,0.1686
OC12CC1(OC2=O)C=O,0.2109
CC1(C)CC2NC2C=C1,0.2492
O=C1OC2C3CC1C2N3,0.2597
C#CC12COC3C(N1)C23,0.2465
CC([NH3+])C1(CC1)C([O-])=O,0.2784
C#CC#CC1=CCCC1,0.1767
CCC1C2CC(CC)C12,0.3274
c1cc(n2c1C=CC2)O,0.1663
C1OC11C2C3CN2C13,0.3045
OC1C2C3NC1C(=O)C23,0.2029
CN1C2C3OC3(CO)C12,0.293
CC1C2C3OC1(C)C23,0.3107
C1CC2C1C1CCCC21,0.3251
CC1=CCC2C(C=O)C12,0.208
CCCc1cc[nH]n1,0.2666
N=C1NC=CC=NC1=N,0.1596
CC(=O)C12CC(C1)OC2,0.2243
C(CO)C(CCO)O,0.3265
COC1CC1CC#C,0.309
OC1CN=COC1=O,0.2359
CC1(CN1)C(O)CO,0.3164
CCC(NC)(C#C)C#N,0.2494
CC1CCNC(=O)C1,0.2687
COC(C)C(=O)NC=N,0.2294
OC(CCOC=O)C#C,0.2838
ON=C1C2CC1N=CO2,0.2391
C#CC1C2CC(C#N)N12,0.2518
COC(C)(C)C1(C)CO1,0.3265
CN(C=O)C1CC1,0.2672
CC1C=C2CC3OC1C23,0.2114
CC1C2OCC=C(C)C12,0.2436
CC1C2OC(=N)C12,0.2779
CC(=O)OC12CN(C1)C2,0.254
O=C1NC(=O)C2NC12,0.2273
CN=C1CNC(=O)O1,0.2671
CCC1CN1C(C)=O,0.2544
OCC1(NC1C#N)C#C,0.2568
Cc1c(c(no1)CO)N,0.2032
CC1(O)C(CO)C1C#C,0.2768
CCC1(COC1=N)C#N,0.2821
CN=C1NC(=N)C2OC12,0.2228
Cc1c[nH]c(c1O)C#C,0.1949
CC#CC12CC1C(=N)O2,0.2455
CC1CC(C=O)C(C)O1,0.2229
CNC(C=O)C=O,0.2024
C(C=O)C(=O)C(=N)N,0.1843
CCC(C)(C)C1(CC1)O,0.3259
[NH3+]CC(CO)C([O-])=O,0.2697
CCC(C)(CC)C#N,0.3534
CC1CC11OC(=N)C1N,0.267
CCOC(=O)C#CCO,0.2394
CC(C)COC1COC1,0.3184
COCCC(C)C(N)=O,0.2772
Cc1c[nH]c2n1ncn2,0.2346
CN1C(=N)NN=CC1=O,0.1835
CCc1cnno1,0.2344
CN(C)C1C2NC1C2O,0.2656
CCC(NC=O)C1CC1,0.2791
c1cc-2[nH]ccnc2c1,0.1275
OC1CC11COC(=N)O1,0.2989
CC(=O)C1(O)C2CC1O2,0.2174
CC1CCC(C#N)=C1C,0.2158
OCCC1(O)CC1C#N,0.2945
CC1OC(=N)C(C)=C1C,0.2183
COCC(C)C1CCC1,0.3368
O=C1[CH-]C(=O)C2CC1[NH2+]2,0.184
c1c(nnnn1)N,0.1728
CC1CC(CC=O)O1,0.2234
CC1C2CC(CO)OC12,0.3185
CC1N=C2OC3(C)C1C23,0.1633
N=C1C=CNN=C1C=O,0.1494
CC(NCCC#N)C=O,0.2171
COC1COC1C(C)=O,0.2223
OCC12COC3C(O1)C23,0.2803
CC1CC=C(C1)C1CO1,0.2439
CC1(C)CC2OCC2=C1,0.2423
CCNC1=NCCC1=O,0.1748
OCC12C=CC3C1OC23,0.2254
COCC12CC1NC2=O,0.2552
CC1=CC(OC1)C1CO1,0.2511
CC1OC2C3CC3C12C,0.3102
COC1(CNC1=O)C#C,0.2413
OCC12COC(=N)C1N2,0.2684
N=CNC(=O)C1CCO1,0.2297
COC1(COC1=O)C#C,0.2396
OCC1N=COCC1O,0.252
O=CC1C2C3CCC3N12,0.1978
CC1CC2(C)OC2C1=O,0.2081
CCC(=O)CC#CC#N,0.2281
OC1CC2=NON=C2C1,0.244
CC1CC1(C#N)C(C)=O,0.2334
CC#CC(=O)NC(=N)C,0.2137
NC(=O)OCCOC=N,0.2858
CN1C=C(CO)OC1=N,0.2099
CCC(CC)C(O)C=O,0.234
CC1(C)C2OCC(=O)C12,0.219
CCC1COC(=N)C1,0.2868
CC1(CCCCO1)C=O,0.2113
c1[nH]c2c(n1)C=CC2,0.1951
Cc1cnc(c(n1)C)C,0.2008
CC1CC(C#C)C1(C)O,0.2899
OC1(CC([O-])=O)C[NH2+]C1,0.2158
O=C1NCC2OCC2N1,0.2984
CC(O)C12COCC1N2,0.3091
CC1C2C(O)C2C1C#N,0.2942
CCn1c(ccn1)OC,0.2508
CN=C1OC2CCC1O2,0.2739
NC12CC1C(=O)OC2=N,0.2412
CC12CC3C4C(C1)C4C23,0.3295
CNC1(CC1(C)C)C#N,0.2641
CC1CC(C#C)C(=N)O1,0.2737
COC1CC2OC2C1=O,0.1886
C1C2C1C13COCC21O3,0.3132
C1CC(C1)OCC=O,0.2288
Cc1cc(=O)[nH]c(c1)F,0.1864
CC1CC2(CC2)N=CO1,0.2579
CC1=CC(=NO1)C1CO1,0.2426
CC1=CC(CC1=O)(C)C,0.1963
C(C(=O)N)N(C=N)C=N,0.2094
COc1cocc1OC,0.2399
CC1=CC2C3COC2C13,0.2314
c1c(nc(nc1F)N)F,0.2211
CC12C3CC1CC23C=O,0.2236
OC(C=O)C1CCC=C1,0.2086
CC1CC2C3CC2C3C1,0.3656
CCC#CCNC(=O)N,0.2815
c1c(non1)C(=O)C=O,0.1464
CC1=C(NC(=O)C1)C#N,0.1807
CC(CCOC=N)=NO,0.2538
CCC12C(O)C1OC2C,0.2954
O=C1NC2COC1OC2,0.259
CC1C2CCC3C2C13C,0.3271
CC(C)c1ccoc1,0.2429
COc1cc(on1)C#N,0.2065
CCCOCCC#C,0.3116
N#CC12C3CN1CC2O3,0.2304
CCC1(O)CC1C(C)C,0.3218
C1OC2CC3C1C3C=C2,0.2368
CC1=NC(=N)C=NN1,0.1837
CC1C(O)C2=CN=NN12,0.2582
CC1(CN1)C1=CCOC1,0.2431
CC1(C)OC1C(O)C#C,0.2808
CC1CC1(O)C1COC1,0.3083
C1C2C3C4C5C(C2N34)N15,0.2865
CCC1OCC(C)C1=O,0.2162
CC1(CO)CC1C(N)=O,0.2727
CNC1C(=O)C=CC1=O,0.1232
OC12CN3CC1C=CC23,0.2247
CC(=O)c1cocc1N,0.16
NC(=O)C(N)(CO)C#C,0.2455
C#CC(=O)n1cnnn1,0.1988
CC(C)CC(=N)NC=O,0.2267
CC12CC(C1)OC21CC1,0.3046
c1c(con1)CC#N,0.2504
CCC1(C)C(O)C1C#C,0.2804
OC1C2CNC12CC#N,0.2589
CNc1concc1=O,0.1532
COC1CCC(C1)C#N,0.3063
OC(C#C)C1NC1C=O,0.2193
CCCC1(O)CC1C,0.3253
C1CC11CCC2CC2O1,0.3106
CC12NC1(C)C1OCC21,0.3165
N=C1C2C3CC(=O)N1C23,0.2308
OC1C2CC2OC1C=O,0.1962
C1CN1CCO,0.333
COC1CC1CC#N,0.3039
C1CN=C2C1=CCO2,0.2061
CCC1NC11CN(C)C1,0.2885
CCC(C(C)C)C1CC1,0.3489
CCOCCC(C)(C)O,0.3103
CC(C)C1=CCNC1=O,0.221
CCc1cc([nH]n1)NC,0.2381
c1cc2n(c1)C=CCN2,0.1869
CC1(C)OC2CCC12,0.3184
CC1=C(CO)C2CN2C1,0.2305
Cc1c2c(no1)CCN2,0.2017
CC12COC1C2(C)C#N,0.2744
OC12CC(C1)(C2)N1CC1,0.3079
CCC(O)(CC#N)C=O,0.2269
c1c-2ncnc2nc[nH]1,0.1827
CC12CC(=O)C(=O)C1N2,0.1484
CC(=O)N1C=CNC1=N,0.1821
CN=C1OCC(C=O)=C1,0.1597
COC1CCN=COC1,0.2605
OC(C=O)C(=O)C1CC1,0.2006
CC1CC2(O)CC1C2,0.3289
c1c(oc(n1)CN)CO,0.2348
CCC#CC1OCC1=O,0.2083
NC(=[NH2+])C(=N[O-])C(N)=O,0.1459
CCCC(=O)OCCO,0.2843
CC12CCC(CO)C1O2,0.3304
c1c(cnc(c1N)O)F,0.1884
CC1(CC=O)CC1C=O,0.2129
O=CC1CC2COCC12,0.2165
OCC1(CC1)C1CCO1,0.3119
COC1CC11CC2CN12,0.3115
CCC1CC(=O)CCO1,0.2247
CCC(=O)C1(CN1)C#C,0.2241
O=CC12CC3C4C(C13)N24,0.2027
C1CC(C1)C12CC(C1)O2,0.3184
CC1(O)CC(C=O)C1O,0.1981
CC1C(=O)C=CC1(C)O,0.1914
CC1(CO)CC2(CC2)O1,0.3042
c1cnc(cc1CO)O,0.2112
c1cn2ccnc2[nH]1,0.2211
CC1CCC(O)C1CO,0.2963
COC(CC=O)C(C)C,0.2254
OC1CCCC1O,0.3167
c1cnc(=O)oc1N,0.1826
CC1(C#C)C2CCC12O,0.268
O=C1C=CC2=C1N=NO2,0.1628
OCCC12CN3CC1C23,0.2975
CC12CC34CCC(C13)N24,0.323
CC(O)C1=CON=C1O,0.254
CC1(C)C2CC2CC1=O,0.2211
COC1CCC(=O)NC1,0.2678
CCC1(C)OC2C(C)C12,0.3111
COc1cnc(o1)C#N,0.1853
COC12CN(C1)C2C=O,0.2167
O=CC1=NON=NC1=O,0.1387
CC1(CC(F)(F)F)CO1,0.3509
CCC1(O)CC2(C)NC12,0.2918
CN(C)c1c([nH]nn1)O,0.2385
OCC#CC12CC(C1)C2,0.2673
Cn1ccc(c1C=O)O,0.1702
CC1=C(F)N=CNC1=N,0.1791
C1C2C1C1C3C=CC1C23,0.229
O=COC1CC2CC12,0.2825
OC1C2CN2C1CC=O,0.2174
CCCCNC(C)C#N,0.271
OC1(CCC1=O)C1CC1,0.2134
CNCc1ncn(n1)C,0.2252
CCN1C2CC2(O)C1=O,0.2315
CCC12NC1C1NC21C,0.2645
CCCC(C)(C)CCC,0.367
O=C1CC2NC2C(=O)N1,0.2261
O=CC1C2OC1C=C2,0.1984
OCC12CC1C(C2)C#C,0.3006
CNC(C#N)C#CC,0.2613
O=C1CC2C1CC21CC1,0.2185
C(CC#CC#N)CO,0.2442
c1c(=O)c(c(on1)N)N,0.1578
OC1CCC11CCO1,0.3012
O=CC1(CC2CN12)C#N,0.205
CC1=CC(O)C2NC12C,0.24
OC1CC(COC=N)C1,0.2824
OC1C=CC(=O)C1C=O,0.1817
CN=C(CC#C)NC=O,0.2249
CC(O)C1=NNC=N1,0.2553
CC1CC1(C)C1CC1,0.339
OCC1OCC(=O)C=C1,0.1789
OC12C3CC1C3C21CN1,0.2935
OC1CC11OCC11CN1,0.285
COCC(=O)CN1CC1,0.2149
CCc1cn(nc1O)C,0.238
Cc1nc(on1)CCO,0.2614
CN=C1NC(=O)C2CC12,0.2309
OC1CC2=COC=C2C1,0.2331
OC1CCC2NC2C1=O,0.2038
Cc1[nH]nc(n1)OC=O,0.2499
O=CC12CC(O1)C1CC21,0.2217
C1=CC2C3C4C1C4C23,0.2417
CC(=Nc1cn[nH]n1)N,0.2025
CCC(OC)C#CC#C,0.2249
CC1(COC1)C,0.3154
CC(O)C1=COC(C)=N1,0.2406
CC1C2CC2CNC1=O,0.2616
O=CC1(OC1C#N)C#N,0.2149
CC(CNC)(C#N)C#N,0.2445
C1CC23OC4C2C(O1)C34,0.3092
CC(C)N(C=O)C1CC1,0.2552
C1C2C3COCOC1C23,0.3226
Cc1cc(co1)CO,0.2341
CN=C1CCC(C)CO1,0.2637
CCC1=CN=NOC1=N,0.1662
CC(O)C12OCC1C2C,0.3057
CN1C2C3C4C1C2(C)N34,0.291
CCC12C3CC1N(C)C23,0.297
CCc1cocc1C#C,0.216
CC#CC1(O)CC(O)C1,0.2756
OCC1C2CC3CC3N12,0.2971
CC1OCC2C1C1CN21,0.3084
CC1(O)CC1C#CC=O,0.2032
CCC1CC2OCC12O,0.3038
COC1(CN=CO1)C=O,0.2086
CCC1CC(O)C=C1,0.2585
CNc1c[nH]c(=O)cn1,0.133
OCC1=CC(=N)NN=N1,0.1643
C#CC12CNC1CN2,0.2523
CN=C(c1ncco1)N,0.1971
CC1C=CC2CCC1C2,0.2607
CC12C3CC3C1CC2=O,0.206
ON=C1CN2CC2C1O,0.2306
CC(=O)C12NC1C1NC21,0.1881
OC1C2CC2C1(O)C#N,0.2992
CC1C2CCC11CCC21,0.3351
CC1(C)CC1CC=O,0.2244
CC1(C(C1(C)O)(C)C)C,0.2994
CC1(O)CC2COC1O2,0.3142
C1C2OC2C2=C1NN=N2,0.238
N#CC12CCC=C1CO2,0.2414
C1OCC2N=CN3C1C23,0.2396
Cc1coc(n1)CC#N,0.2362
CC1(CCO1)C1COC1,0.3072
C1CCC(C1)(C=O)O,0.2308
O=CCC1C2NC1C2=O,0.2265
CNC(=O)C1OC1C,0.2654
OC12C3NC1C1(CO1)C23,0.291
CC1C2N1CC2(C)O,0.2905
CC12CC1C(O)C(O)C2,0.3239
COC12CC3C1C=CC23,0.2257
CC1CC(=O)COC=N1,0.2171
CC12C3OC1C1C3CN21,0.2926
CC(=O)C(=O)C(C)(C)C,0.1537
CC#CC#CCOC,0.2173
COc1ccnoc1=O,0.1824
C1CC23C4C2C2C4C32C1,0.2873
CC(C)C(C)CCC=O,0.2291
OCCCC1CCOC1,0.3154
CC1C(CO)C1(O)C#N,0.2755
Cc1c(nnn1C)C#N,0.2402
c1nc2n(n1)CCCC2,0.2643
CC12OC1C(O)C2O,0.3161
C1OC2CCC3CC12C3,0.3149
CC(C)OC(=O)C1CN1,0.2604
N=C1NC2COC1OC2,0.2616
CCC1=CC(C)OC1C,0.248
CC12CC(C1)(O2)C1CC1,0.3172
CN=C1C=NNC(F)=C1,0.1657
CC12CC=CC1C1OC21,0.2639
OCC12CCC=CC1N2,0.23
C(CNC(=O)N)NC=O,0.2744
CC1N(C)C(=O)C1(C)O,0.2663
CCC1(C)CC1(C)CC,0.3283
CCCC1CCC(=O)O1,0.2791
CC(C)C1(C)CN2CC12,0.3004
CC1(O)C2CC1C2(C)O,0.3214
CCC1C=CC(=O)C1O,0.1935
CC1C2C3C4C1C2(C)N34,0.3079
CCC1C(C)C1(C)O,0.3128
c1c(oc(n1)O)C2CC2,0.2315
C1CC23OC4C2CCC134,0.2887
CC1CN2C(CC12)C=O,0.2015
C#CC12C3CC1CN2C3,0.2351
CC1CC2(C#C)C(O)C12,0.2627
CC(O)CC(O)CCO,0.3016
OC1CC11NCC1C#N,0.2529
CCOC=NC1CC1C,0.2481
COC1CC(O)CO1,0.3233
CC1C(C)C11CC2CC12,0.3207
Cc1cncnn1,0.1657
COCC12C3CC1CC23,0.3185
CCC1OC1C#C,0.2808
c1c2c([nH]n1)nc(o2)N,0.2126
CC1C=CC2C3CC12O3,0.2345
C1NC2=NC3C4OC13C24,0.1722
COc1cnc(nc1)F,0.1944
OC(C=O)C12CCC1O2,0.2154
CC1OC2CC2C11CC1,0.3192
c1ccn(c1)CCCO,0.2458
c1cc(c(cc1N)O)O,0.195
CN(C)C(C)(C#C)C#N,0.2344
C#CC12C3CCC1CN23,0.251
CC1CCCCCC1C,0.3697
Cn1ccc(n1)N(=O)=O,0.2028
C#CC1CC1C1COC1,0.2865
CC12CN3C(COC1)C23,0.3096
NC(=O)C1C2NC(=O)C12,0.2386
CC(CO)CC#CC#N,0.2437
CC1CC2(CC2)C(=O)O1,0.2778
Cc1[nH]c2c(n1)c[nH]n2,0.2118
C#CC1CC11OC2CC12,0.2781
CCCC#CC1COC1,0.2924
CCC1(COC1C)C#C,0.2901
CC12CC3OC1C(=O)C23,0.2089
Cc1cc(c([nH]1)C)CO,0.2308
CC(C=O)C1CCC1=O,0.2134
CC(C)OC1(C)CC1O,0.2972
CC(=O)NC(=O)CC#C,0.2236
CCc1[nH]cc(n1)C#N,0.2276
CC1OC(C)C1=O,0.2213
CC1CC(O)C1(O)C=O,0.2117
OC1CCC(O)(C1)C#N,0.2946
ON=C1CC23CC(C2)C13,0.248
O=C1N=NON=C1C#N,0.1451
CC1C2C3CC3(C)C12O,0.3156
CCC1C2C1C1CCC21,0.3167
O=C1C2CC1OC2,0.2082
Cc1ccncc1F,0.2281
C1NC1C12COC1CN2,0.2811
CC1=C(CC(=NO)C1)C,0.2386
C1CC12C=CC(=O)C2=O,0.1405
CC1(CN1)C#CC=O,0.2009
CC(C)(CCCC=O)O,0.2282
Cn1cnn(c1=O)C,0.2295
CC(C)(C[NH3+])C([O-])=O,0.142
CC([NH3+])(CO)C([O-])=O,0.2652
COC1C2C=CC1C2=O,0.2406
CC1CC(=O)C(=O)C1,0.1445
CCCCC(C)(O)CO,0.3158
N=COCCOC=N,0.2793
CC1C2CC(CO)CN12,0.2854
CC1(C)CC11C2CC1C2,0.3365
Cc1c([nH]cn1)CC#C,0.2454
C(C1CN1)N1CC1,0.3065
CC(C#N)C1OCCO1,0.3047
Cc1c(c[nH]c1N)OC,0.24
COC(C)C(C)C#N,0.306
c1cnc(cc1C=O)O,0.1698
CC1(CC1)COC2CC2,0.3307
OCCC1CC=CC1,0.2649
COCCC1C(C)C1C,0.3292
CC(C)C(C)OC1CC1,0.3169
CCc1coc(n1)C=O,0.1826
Cc1cc(c([nH]1)O)OC,0.2269
CC1=CC2NC2C1,0.2438
CC1C(C#N)C2CN12,0.2729
CC12CC1(O)C(C)(C)C2,0.3083
C#CCNc1ccco1,0.2151
N#CC1C2C3CN2C13,0.2751
CC(O)C1=CC(O)=CN1,0.2222
CCC(C)(C)NC(=O)N,0.3001
CC1(C)CC(O)C1CO,0.3055
N#CC1OCC2OCC12,0.2768
C1CCCC(=NO)CC1,0.2536
C#CC12C3C1C1C3OC21,0.2709
CC1OC2C(C)(C)C12C,0.304
OC1CC2OCC12C#C,0.2761
CCC1C2CC(C)C12C,0.3223
CC(=O)C1(CC1)C#N,0.2339
COCC1(C)CCCO1,0.3181
CC1C2CC3(CCO3)C12,0.3141
CC12CC3CN1C3C2O,0.2933
CNC1(C#N)C2CCC12,0.2588
OCC1CC(O)C(=N)O1,0.2702
[NH3+]C(CO)C#CC([O-])=O,0.2156
CC1C2C3CN3C12C#N,0.2447
CC1CCOC1CO,0.3238
CNCC(N)(CN)C#N,0.2708
OC1=C2C3CC3N2C=C1,0.2062
CN=CNc1cnn[nH]1,0.2119
CC1(N)C(N)C1(N)C#N,0.2525
CC(=O)OCC#CCO,0.2709
CCC(N)(C#N)C(C)O,0.2909
CC1C2(O)CNC12C#N,0.2335
c1c(nc2n1nc[nH]2)N,0.1931
NC(=O)C12CN1CC2=O,0.219
CN1CC(=O)C2(C1)CC2,0.1934
CC(CCC#C)CC=O,0.2269
CC1CN=COC11CC1,0.2671
C(=N)Nc1n[nH]nn1,0.2104
CC12CC=C3CC1C23C,0.1773
Cc1c[nH]c(n1)C2CC2,0.2397
C1C2C3CC22COCC132,0.3265
CC1CC=C(C)C(=O)N1,0.2132
CC1=CC2CC1C2=NO,0.2353
CN=C1CC2CC(C2)O1,0.2636
C(=N)NC(=N)C(=O)C#N,0.1329
COC12CC1C=CC2=O,0.173
c1(c(=O)[nH]nc(n1)O)N,0.1729
OC12C3CC1OC23,0.2962
CC1(C)NC1C1CO1,0.3144
CC1CC2C3C=CC2C13,0.2315
OCC(O)C(CO)C#C,0.2966
CCc1cc([nH]c1O)N,0.2264
CC1NC(=N)NC1=O,0.2351
CC1OC1C1NCC1=O,0.22
c1c(nnn1CC=O)N,0.1721
CC1=NC(=N)C(C)=NN1,0.1909
C1C(=O)OC1(C#N)C#N,0.2581
CCCCCCCC=O,0.2289
CC1=CC2(CCC1)CC2,0.2464
CC1CC2C1N2C(C)=O,0.2439
C#Cc1c(n[nH]n1)C#N,0.2158
CC12C3C4C1C4(CO)C23,0.2877
CC1CC(C=O)=C(C)N1,0.1779
COC1CC1CC(C)=O,0.2333
CC1C2CC(C)(C#C)C12,0.3012
OC12CC1NCC(=O)C2,0.2115
NC1C2CCC1(N2)C#N,0.2562
OC12CC(CC=O)(C1)C2,0.2256
COC(=O)C(C)(O)C#C,0.2527
CC(C)n1cncc1O,0.2432
C#CCC(C#N)C#N,0.2758
CCC1OC2(C)CC12C,0.3082
CC(=O)C1NC1(C)CO,0.2208
CC1C2C(O)C2OC1=N,0.2757
C#CC#CCCC(=O)N,0.2304
Cc1c(c[nH]c(=O)n1)O,0.1639
OCC1COC=NC1,0.2739
COC12CC1CC1CC21,0.3115
CC1(CC#C)OCC1O,0.2914
C(COc1n[nH]nn1)O,0.2323
N=C1OC2C(OC12)C#N,0.2591
CC12C3CC1OC(=O)C23,0.2652
CN1C2C(O)C2NC1=O,0.28
ON=C1CC2NC2C1,0.2494
OC12CC1N1CCN=C21,0.2289
CN1C(=O)CC=C1C=O,0.1555
CC(C)(CC#N)C#C,0.2964
OC(CC#N)C1CCO1,0.2911
OCC12CC3OC1CC23,0.3055
OC12CC1(NCC2)C#N,0.2379
CC12OC1C(O)C1NC21,0.3007
CN1CC2C1CN2C=O,0.2504
CCOC1=NC(C)CN1,0.2753
C1OC2C11NC22COC12,0.1704
C#CCC1OC2CCC12,0.2965
C1OC11C2C3OC1OC23,0.3213
CC(=NO)C(C#C)C#C,0.2536
CC1=CC2OC1C21CO1,0.2372
Cc1c(cno1)C(=O)C,0.2074
CN=COC1(CC1)C#N,0.2681
CCCC1OC11CCC1,0.3328
CC1(CN1CCO)C=O,0.2172
CC1(NC1CC=O)C#C,0.2141
ON=C1C2CCC1O2,0.2586
CC1=C(NC(=O)CC1)C,0.2105
CC12CC(C1O)C21CN1,0.2981
COC12CC1C(C)C2C,0.3185
C1CC2=CCC(=O)N2C1,0.2067
COCC(OC)C1CC1,0.3227
Cc1c(nc(cn1)N)N,0.1793
CC(CO)C(C)(C)C,0.3373
C#CC12NC1C1NC21,0.2277
CC1(O)C(C#N)C1C#N,0.2787
CCC1(CN1)C1CCO1,0.3122
c1c2c(c([nH]1)O)COC2,0.2357
CN1C2COC(C=O)C12,0.2029
C(C(=O)C(=O)N)NC=O,0.172
O=CCC(CC#C)C#C,0.2221
CCC1C2CC2C1(C)C,0.3341
CC1CC2OC11COC21,0.2742
NC1CCC1(C#N)C#N,0.256
COC1(C)CC(=O)C1O,0.2084
CN=COCC#N,0.2665
CN=c1[nH]c(=O)nco1,0.2038
CC(C=O)C(O)C(C)=O,0.2062
OC1CC=CCC=C1,0.2512
ON=C1CNC1C1CO1,0.2368
CC1COC(=N)C1O,0.2878
C#CC12CC1NC2C#N,0.2425
Cn1c(cc(c1O)O)O,0.2191
CCC(C)(C)C(=O)C#N,0.2058
O=COC1CC2CC2C1,0.2849
OC12CC3OC(C=C1)C23,0.2357
CC1OC(C)C(O)C=C1,0.25
CC#Cc1cc(n[nH]1)O,0.2036
CC(C#N)C1CN1C=O,0.2513
CC1CC2=CN=C(O)N12,0.2515
CCn1ncc(n1)C,0.2499
CC1CN(C=O)C1C#C,0.2616
CCN(C)c1nc[nH]n1,0.212
COCCCC(C)CO,0.3274
NC(=O)NC(CO)C=O,0.2242
O=CC1CC2C1C1CN21,0.2036
CCC1OCC11OC1C,0.3255
CCCC1(CC1O)C=O,0.2261
CN=c1cnoc(=O)o1,0.2079
CC1=CCC(O)C=CC1,0.245
C1C2C3C=C4COC13C24,0.1923
CC1CN1C1C2COC12,0.2828
CC1N(CC1=NO)C=O,0.2327
CCC12CC3(CO3)C1N2,0.3313
CCC([NH3+])CCC([O-])=O,0.2738
CC1(CC1CC#C)C#N,0.2974
CC12NC1(C)C1NC21,0.3223
CC(O)CC(C)(C)C#N,0.312
OC12C3NC1C1C3OC21,0.2877
N#CC12CN1C1COC21,0.2461
CC#CCC12CCC1N2,0.297
c1c2ncncn2nn1,0.1737
CC1C(C)C1(C=O)C#C,0.2186
CC12OC=NC3CC1C23,0.2619
N=C1OC2(CC2)C2NC12,0.2566
N=C1OC(=O)C(=C1)C#N,0.1815
CC1COC(=O)C1(C)C,0.276
C1CC11OCOC2CC12,0.3229
O=C1C2NC(C=C2)C1=O,0.1373
CCC12CC1C(O)C2O,0.3176
CCC(C)OC(=N)C#N,0.2384
CC(C)C(O)CCO,0.3287
O=C1COC(C=C1)C#C,0.1775
O=C1NC=CC2CC2N1,0.2287
OCCCC(CO)C#C,0.3044
O=C1NC2C=CC1C=C2,0.2124
C1CC11C2C3C1CN23,0.3189
CC(CO)OC1COC1,0.3131
CC1CCCOC1C=O,0.2078
C(CO)C(F)(F)F,0.347
CC12C3CC11CCC2N31,0.3124
CC12CCC1C1C(O)C21,0.297
O=C1CN2CC2C2OC12,0.1993
COc1c(cno1)C#N,0.2283
c1c(nnnn1)NC=O,0.1632
c1c([nH]c(c1O)N)C#N,0.1801
CC1(C)C2C(O)C(=O)N12,0.2231
CCCCC(=O)N1CC1,0.2535
CC1=CC(=O)OC12CC2,0.2155
OC1CN2C1C=CC2=O,0.2093
N#CC1C2C3CC2C13,0.3316
C1C2CN1C1=C2C=CN1,0.2275
CCC1=CC(=O)NC1C,0.2161
C#CCC1CN(C1)C=O,0.2652
OC1COC2C1NC2=N,0.2628
CNC1=NCC(N1)C#N,0.2404
O=C1CCC2C3CC12O3,0.2081
Cc1c(=O)cnoc1N,0.1779
CN=C1N=NON=C1F,0.1698
OC1C2OC(=O)C12C#C,0.2376
CC12CCC3OC1CC23,0.321
C1CC1C2=CCOC2=O,0.2163
CC1C2CCC1C2C#N,0.331
CCC1C2C3OC3(C)C12,0.323
CCC(C)C(C)COC,0.335
c1c(c(cnc1O)F)N,0.2114
C1C2OC=NC1C=C2,0.2365
CC1CC2CC(O)C2O1,0.2983
[NH3+]C12CC(C1)C2C([O-])=O,0.2712
N#CC12CN3CC(O1)C23,0.2285
CC12C3CC1NC(=O)N23,0.2663
Cc1c(cnnc1F)O,0.1958
COCC#CCCC=O,0.2192
OC1C(CC1=O)C1CN1,0.2128
C#CCOC(=O)C1CC1,0.2811
COCC12CC1CO2,0.3039
OC1CCCOC2CC12,0.3182
N=COC1=CC=NO1,0.2233
C#CC12COC1CN2,0.2493
OC1CC11CC(=O)O1,0.2826
CN1C=CCC1=O,0.2094
C1CN1CC(CO)CO,0.3053
CCc1[nH]nc(n1)O,0.2458
COCC(C)(O)CCO,0.3266
CC1OC2C1CC2(C)C,0.3201
COC(C#C)C1(C)CO1,0.2919
CC12CCC(C)(O)C1N2,0.3057
CCC1CC(O)C1,0.3311
CCc1c(n[nH]n1)C,0.2518
OCCC1CCC(O)C1,0.3322
c1concc(=O)c1=O,0.1512
CC12CC1(O)C1OC21C,0.307
OC(C#C)C1=COC=N1,0.2479
CCC1(C)COCC1O,0.3135
C#CC1OCC(=O)CO1,0.2071
C1CC(=O)C=CC1=NO,0.1672
C#CCC1C2CC1C2,0.316
C1Cn2c1c(nn2)N,0.2198
C1C(=CC(=O)O1)N,0.2229
CCCC(CO)NC=O,0.282
ON=C1C=CC2OC12,0.188
CC#CCc1nnon1,0.1935
C#CC1C2N1CC21CN1,0.2598
COC1CN(C=O)C1=O,0.202
C[NH+]=C(N)CCC([O-])=O,0.244
OC1C(O)C11CCC1=O,0.212
CC1OCCC(C)=C1,0.26
CC1(O)C(O)C1OC=N,0.2502
CC1C(C#C)C2CC12O,0.2995
C1CC1C(=O)NC2CC2,0.2707
C1C2CC3CC(CO3)C12,0.3187
Cc1cc(n(c1)C)CO,0.2299
Cc1ccc(=O)ncc1,0.1694
CC1NC11CCCC1O,0.3043
CC12OC(C=O)C1C2O,0.2184
CCc1cnccc1O,0.2386
CC1(C)C2OC1C=C2,0.2316
c1c2c(c(n[nH]2)N)[nH]n1,0.1951
CC12CN1CC2CO,0.299
CN1C2C3C2C(C)(C)C13,0.2798
CC1(C)C2CC2N1C=O,0.2613
CN=C1NN=CC=C1F,0.1611
N=C1OC2=C(O1)C=CO2,0.2114
Cc1c(=O)onc(n1)C,0.1641
CC(=O)C(O)C(O)C#N,0.2333
CCC1=CC(=N)ON=N1,0.1636
CC1CN=CO1,0.2721
COC1COCOC1C,0.3183
COCC(OC=N)C#N,0.269
OCC12C3CC1OC23,0.3064
Cc1c(cn(n1)C)C=O,0.2045
CN=CN(CC#C)C=O,0.2266
c1(nc(no1)N(=O)=O)N,0.1804
c1c(nno1)C#CC#N,0.1949
CCC1CCOC11CC1,0.3061
C1NC1C1=CCOC1,0.2369
CCC12CC1C(C2)OC,0.3256
C1C2OC22C=CC3C1C23,0.2124
CC1(CC(C1)(C)C)C,0.3443
NC(=O)C1C2CN1C2,0.2706
COc1c(cno1)C=O,0.2109
NC1C(N)C(=O)NC1=O,0.2186
CC1OCC(O1)C#C,0.2879
CCC12C=CC3C1OC23,0.2246
CC1C2C(C#N)N2C1C,0.2598
CC1=CC(CC1O)C#C,0.2551
OC1CCC(=O)N2CC12,0.2443
CN1CC(=NO)C1CO,0.2355
CCC(C)C#CCC=O,0.2183
OC12CC1C(CC#C)C2,0.3046
Cc1cc(cc(=O)o1)N,0.1842
CC12C3CC1N3C2C=O,0.2079
N=C1OCCC(C=O)=C1,0.1779
CCC1NC(C#N)C1O,0.2697
C1CC2(C1)CNC(=O)O2,0.3126
CCc1cccn1C,0.2386
CC12CCCC1O2,0.3443
CC1=CC2C=CC3C2C13,0.2329
CC1=Cn2c(ncn2)C1,0.2041
OC12C3C1C1=CC3OC21,0.1389
C1C2CC3C4C(OC13)C24,0.3072
OCC12CC(C1)N1CC21,0.2993
CC1CCC2C3CC1C23,0.3257
CC1CC(C)(CO)C1,0.3221
OC1C=CCC11CC1,0.2624
c1c(c[nH]c1OC=O)O,0.1904
CCC1(CO1)C(N)=O,0.2627
CC1NC2(CO)COC12,0.2691
c1c(ncn1C=O)C=O,0.1798
CC1(CC1)CC(=O)C#N,0.1954
COC1(C)CN2CC12,0.3078
CC1CC(=O)C2(C)CN12,0.2175
CC1COC(C)C1C=O,0.2181
c1coc(=O)ncc1=O,0.1641
C1CC2CCN=C2O1,0.2735
CC1(C)NC1C1CN1,0.301
Cn1cccc1,0.2469
CC1C2CC2N1C(N)=O,0.278
CCC1CN(C1)C(=O)C,0.2677
OC(C#N)C1=NC=CO1,0.2417
CC12OC1(CC=C2)C=O,0.2107
CC1CC1(O)CN1CC1,0.3152
O=C1CC2CC1CC=C2,0.22
CN(C=N)C(=O)OC,0.2498
CCOCCCC(C)O,0.3173
CCn1cnc(c1N)O,0.2274
CCOC1CC(O)C1=O,0.2011
C1OC2=NCCN3C1C23,0.2215
CC(NC(C)=O)C1CN1,0.2588
COCC12CC(O)C1O2,0.3203
OC12CC1COC2C#C,0.2842
CC12CC(=CC1N2)C#C,0.1906
C(CNC(=N)C#N)C=O,0.2126
c1nncn1CCO,0.2661
CC1CC1C(=O)C1CN1,0.2271
C#CCc1nc(co1)O,0.2189
C1CC2(CC2)C=CC1=O,0.1873
OCC1CC1OCC#C,0.2772
OC12CCC1C1OC21,0.3121
OC1CCOC(=O)OC1,0.2964
CC1=CC2(CC2C1)C#C,0.2364
O=C1C=CC2NC2C=C1,0.1777
C1C(CO1)C(=O)N,0.263
c1ccnc[nH]cnc1,0.1801
c1c(=O)nc(on1)CO,0.1863
N#CC1C2CCOCC12,0.2886
OC12C3C1C1N=C2NC31,0.1138
CC1(COCCCO1)C,0.3213
O=C1C2CC2C1C#N,0.2298
CCC#CC=O,0.2053
CCC1(CC#C)CCO1,0.2897
CCOC(=O)C(=O)CO,0.1865
CCOCC1(CN1)C=O,0.2206
CC1(O)CC2(NC12)C#N,0.2643
CC12OCC3NC1C23O,0.2783
CC1CCN1C(=N)C=O,0.1611
CC1CN1C1=CN=NN1,0.2307
OC1C(O)C2(CN2)C1O,0.3073
O=CC1C2C3NC3CN12,0.2207
CCC12CN1CCOC2,0.3031
COc1ccc(o1)N,0.2243
CC1(CC1)C1NC1C#C,0.2731
C#CC12C3CN1CC23,0.2516
CC1(C(=CCO1)CO)C,0.2517
CC(=O)c1c(non1)N,0.1709
OCC12NC1CCC2O,0.3121
CC(C)C1OC(=O)C1O,0.2634
N=C1NCC2CN2C1=O,0.2056
Cc1cnoc(=O)c1F,0.1869
c1c2n(nn1)CC(=O)C2,0.2091
C1CC12CC=CC(=O)O2,0.2131
CCC1CC2CCC12C,0.3348
OC(C=O)C(=O)C#C,0.1898
CCOc1[nH]cc(n1)C,0.2509
O=C1CNC1C#N,0.2197
COCCC1OC1C#C,0.274
CC1C=CC(=O)C2OC12,0.187
OCC(O)C1CCC1=O,0.222
N#CC1CC=CCCO1,0.2533
[O-]C(=O)C1C[NH2+]C2CC12,0.2708
N#CC1C2C3CN1CC23,0.2829
O=C1C2OCC2C1C#C,0.1942
N#CC12C3C1C1C3NC21,0.2595
COCC(C)C#C,0.3144
CC1OCC2C(O)CC12,0.3173
CC1OC1C1CC(=O)N1,0.2852
C1OC1C1CCOC1,0.3303
OC1COC2(CC2)C1,0.2947
CC(O)(C1CO1)C1CO1,0.3353
C1OCC2OC3C1NC23,0.2955
c1c(c([nH]n1)CO)O,0.2308
CC(CCCO)C(C)=O,0.2301
CC(O)C12CC1OC2C,0.2977
C1CC23CC1OCC2N3,0.3131
CC1CC1CCCC#C,0.3134
C1CCC(=O)OCC1,0.2628
CNC1C(N)C1(O)C#N,0.2431
N#CC1CC1N1CC1,0.2873
C1=C2C3C4C3N3C1C3C24,0.1865
OC1C=CC2CCOC12,0.2594
CC1(O)CCC2OCC12,0.308
COC12C3C4N3C1C24O,0.2668
C#CC12OCC1C2C#N,0.2495
CCn1cnc(c1O)N,0.2366
CC12CC(=N)OCC1O2,0.2829
N=C1OC2CCCOC12,0.2683
OCC1CC(=N)OC1=O,0.2513
CNC1(COC1=O)C#C,0.2395
COC1CCOC1=N,0.2691
CC12CC1(C#C)C(O)C2,0.2662
C1CC12CN(C=N2)C=O,0.2092
Cn1cc2c(n1)COC2,0.2381
CC1CC2(CO2)C1,0.3352
CC1CC2C3OC3CC12,0.3338
[O-]C1=CC2=C(C[NH2+]C2)O1,0.1114
OCC1CC=CC(=N)O1,0.2137
CC12CC(C1)C(=O)C2O,0.2202
NC1=CNC(=N)N1C=O,0.1764
CC1CC(C)([NH2+]1)C([O-])=O,0.2647
CNCC(=O)OC1CC1,0.2385
CC1CC2CC(=O)C12O,0.2173
COC(=O)CC1CN1C,0.234
CC12NC3C(OC13)C2O,0.283
CCC1(NC1C=O)C#C,0.2084
C1C2C1C1=CCOCC21,0.2423
C1C2CC3CC(O3)C12,0.3178
C1CC(O1)C1CCO1,0.319
O=C1CC2(CO2)CO1,0.2757
N=C1OC(C=O)=CC=C1,0.1387
NCC1NC=NC1C#N,0.2475
COC(C)C1=CON=C1,0.2456
CC1(O)C2COC12C,0.2979
CC1(CCC=C1)C1CC1,0.2632
CC1(NC1C[NH3+])C([O-])=O,0.2654
CC1(CN=CO1)C(N)=O,0.2595
CC1(C)OC=NC1C=O,0.2125
CC(=O)N1CC(C1)C#C,0.267
c1cc2ccnnn2c1,0.1501
CC(C=O)N1C=CN=C1,0.1862
Cc1nc2c(o1)nco2,0.2001
CC1(O)CCC11COC1,0.3
C1CC(=CCC1=O)CO,0.2232
CC1C2CCCCC12,0.3308
CC(C)CC(C#N)C#N,0.3239
CCc1c(cn[nH]1)C=O,0.2071
C1CC1(C#N)C(=O)N,0.2752
C1CC12C=CCOCO2,0.2435
CNC(C)(C#C)C#N,0.2506
NC1=CNC2=C1N=NO2,0.1197
CCOC1C2NCC12O,0.2837
Cn1c(c(nn1)O)O,0.2197
CNC(=O)C#CCO,0.2372
CC1OC(C)C(O1)C=O,0.2197
COC(=O)c1ccco1,0.2023
CC(O)COC(C)C=O,0.2262
C1CC2C1N1C=CN=C21,0.2474
CCCC1C2CC1(O)C2,0.3375
OC1CC1OCC1CN1,0.2941
O=CC1CC1C(=O)C=O,0.1427
CC1NC(=O)NC1(C)C,0.306
O=C1OC2C1OC21CC1,0.2402
CC12NC1CC(C=O)=C2,0.1873
Cc1nc(no1)N2CC2,0.229
CCCCOCCCO,0.3275
C#CCCc1cnoc1,0.2434
O=C1NC2C=CCOC12,0.2381
CC12OCC1NCC2=O,0.1866
CC1(O)C2C3COC1C23,0.3057
CC1C2CN1CC(=O)O2,0.2323
COC1COC=NC1C,0.2703
CC#CC(O)C(C)C,0.2883
CC1(O)C2OC11CCC21,0.2809
OCC1CC11CCC1O,0.3164
CC1C2CC1C(C)CO2,0.3157
CCCN1CC1C=O,0.2101
CCC(C=O)C1(O)CC1,0.2177
CC12CC(C1)C1CCC21,0.358
C(C=O)C(C#N)(C#N)O,0.2249
C1C2CC=CC=CC1O2,0.1888
NC1=CNC(=N)C(=O)O1,0.168
OCC1C2CCOCC12,0.3082
CCNC(=O)CNC=O,0.2608
CC1OCC2C1C2(C)C,0.324
CC12C=CCC1C2O,0.2327
C#CC1CCC1,0.3045
CC1OC(=O)OCC1O,0.317
O=CC12C3C4CC1C4N23,0.2149
CCCn1c(=O)ocn1,0.2383
CCCC1CC1C#CC,0.2822
CC12OC(C1O)C21CN1,0.3087
OC12CC1OC(=N)OC2,0.2833
CCC1CNC(=O)NC1,0.2937
CCC#CC1(CO1)C=O,0.2138
CCN1C2CC1(C)C2=O,0.2488
CC1CC(C1)N(C)C=O,0.2633
OCCC1C2C3CN2C13,0.3055
CCC12CC1OC(N)=N2,0.2709
C1CNC=C(C1=O)CO,0.182
OCC1(CN1)C1CC1O,0.2791
CC1(CC=O)C2CN1C2,0.2098
c1coc2c1nc(o2)N,0.2172
N#CC1=CCC2(CO2)C1,0.2224
CCC1CCC(CC)O1,0.3301
N#CC(C1CO1)N1CC1,0.2786
c1c(nc[nH]1)C#CCO,0.2151
CC1OCCC2(C)NC12,0.3082
O=C1COCC1C1CO1,0.2146
C(CO)NC(=O)CC#N,0.2783
COC(C)C1=CC=CO1,0.2353
c1nc2c(o1)CCN2,0.1981
CC12OC1(CC=C2)C#N,0.2481
OC1=CC=CN=CC1=N,0.1467
CC1C(C)C11CC(=O)O1,0.2774
O=C1C2CC=CCC1O2,0.2249
C1C=C(NC1=O)CC#N,0.2131
CC12CCC1C(O2)C#C,0.2763
CC1(COC(=N1)C#N)C,0.2196
CCC1CC2(CC2C)O1,0.3027
OC12CC1C1CN1C2=O,0.2272
NC(=O)NC12CC1OC2,0.2746
NC(C#N)C1CN1C=O,0.2488
CC12OC3C1C2CC3=O,0.2137
O=CC12NC1CCC=C2,0.2181
CC1COC2CC2C1O,0.2844
COC1=CC=NNC1=N,0.1665
CC1CC1C1(C)CC1,0.3267
OCC#CC1C(O)C1O,0.2546
CC#CCC1CNC1=O,0.2713
CC1(C)CC(O)C2CC12,0.3284
C1CC2(O1)C1CCCC21,0.2906
N=COC1CC1,0.2799
COCC1CC2CC2O1,0.3161
C[NH+](C)C(CO)C([O-])=O,0.255
O=C1CN2C=NC3C2C13,0.2
CC12CC3C1C(C#C)N23,0.2606
CC1CCC11CCCC1,0.3477
Cc1c(cn[nH]1)C#C,0.2253
CC1(O)C(CO)C1C=O,0.2175
CC1CCC23CC12OC3,0.2894
C1C2CCN=C3OC1C23,0.2487
NCC1(NCC=C1)C#N,0.2316
O=CC1COCOC=N1,0.219
OCC1(O)CC2OC2C1,0.3179
C1CC1C1CO1,0.3534
CCC1C2CCOC12,0.3182
COC1CC11COC1C,0.3104
C1CC=C2C3NC3C2O1,0.2322
CC1C2CC2C2(C)CC12,0.3191
CC12C3N1C1C2CC=C31,0.1587
CC(O)C1(CNC1)C#N,0.2661
O=CC1OC1C1CN1,0.2129
CCN1C(=N)CNC1=O,0.2462
NC1C2OC(=N)C12N,0.2442
CCc1cc(ccn1)C,0.2294
C1C2CCCC3(CO3)C12,0.3277
O=C1CC2C(C#N)C12,0.2282
CC1C(O)C1(CO)C#N,0.2983
CC1=CC(F)=COC1=N,0.1615
OC1C2CC3C2C1C3=O,0.2201
CC1=CC(C#C)C(=O)C1,0.2151
CCN(C=O)C(=N)C=O,0.1914
C1C=CC=CC(=O)CN1,0.147
N#CC1OCCC2OC12,0.2928
CC(C)C1CC(C1)=NO,0.2498
Cn1cc(ccc1=O)F,0.1663
CC1(CC=O)NCC1=O,0.1946
COCC1(CC#C)CO1,0.3081
CC#CC1(O)COC1C,0.2731
OC1(CC#C)CNC1=O,0.2591
CCCOC(C=O)C=O,0.1967
OCC1C(CC1=O)C#C,0.2182
N=C1OC2=C(O1)N=CN2,0.216
CC1CC2NC1C2C#N,0.2894
CCC1C(O)C1C#C,0.2849
OC1C2CCC=CCC12,0.2596
OC1C2NC2C=C1C=O,0.1788
CC1C2OC1C2C=O,0.2041
N#CC1C2CC1C1CC21,0.3057
N=CN1CC(=O)CC1=N,0.1977
CC(C)(COC(=O)N)O,0.298
c1nc(c(c(n1)O)F)N,0.224
c1ccnc(c1)CC#N,0.2305
CC1OCC(C=C1)C#N,0.2628
CNC(=O)C(C)(O)C#N,0.2609
CC1OC2CC2C1CO,0.2942
O=CC1CC2C(C#C)C12,0.2128
C1C(CO1)(C#CC#N)N,0.2184
c1cc(c(nc1)N)C=O,0.1639
CC1C2C3NC3(C#N)C12,0.2905
CN1N=CC=C(F)C1=N,0.1602
CCC12CCC1C2(C)O,0.3081
CC1NC2C(O)C12C#N,0.2624
O=CC12CC3OC1C3N2,0.2127
CC1CC(O)C2OC12,0.3292
CCC1C2C3CC1CN23,0.3185
N=COC1CCNC1=O,0.2487
CC(C#C)C(=O)CO,0.2289
NC(=O)C12CC1CCO2,0.269
CC1CC(C)(CCO)C1,0.3409
CC(=NC)OCCC#N,0.2775
CC12CC(C1)OCC=C2,0.2489
C#CC1C2C(CN12)C#N,0.2634
OC1C2CC1(C#C)C2=O,0.2334
CC(O)C1=CN=NN=N1,0.1713
CCC1CC(=O)CN1C,0.1935
CCC(=NO)C1OC1C,0.2487
CN1CC11CC2(C)NC12,0.2983
N=C1NC(=O)NCC=C1,0.2057
COC12CC3CC(C1)C23,0.3229
OC1C2NC1C1CC2O1,0.2766
CCC1C2C3CC1CC23,0.345
CC1(O)C2COCOC12,0.3123
CC1CN=C(O1)C1CO1,0.2465
C1OC2C3OC4C3NC124,0.2774
O=CC(=O)OCC1CN1,0.1634
C1CC(C1)COC=O,0.2863
CC1COC=NCC1C,0.2553
C1CC(C1)OC2CCC2,0.3171
CCc1c(c(c[nH]1)N)N,0.2194
CCC1C(C=O)N1CC,0.1945
CCC1CC2C(C)CC12,0.3371
O=C1C=C2CCC3C2N13,0.1841
CC1(CC#CC#N)CN1,0.2239
CC12OC1(CC2O)C=O,0.214
CN=c1[nH]ccc(=O)[nH]1,0.1916
CC1(C)C2OC1C2(C)O,0.319
CN=C1COC(=N)CN1,0.2477
CC1OC2C1CC21CN1,0.3
O=C1CC2N=COCC12,0.2155
C1C2C3OCOC3CN12,0.3109
C1CC2C3OC3C2C=C1,0.262
CC(C#CC=O)C1CN1,0.1829
CCC1OCC2(O)CC12,0.3226
CC1(C)CCCN2CC12,0.2905
CN1C2C3C(O)C1C23O,0.2703
COC1C2C3OC3C12O,0.2778
OC1CC2(CC2C=O)C1,0.2275
C1OC2COCC(C2)O1,0.3033
OC12CC(C1)C2OC=O,0.2737
CCNc1c(nco1)O,0.2033
CC1C2C3N1CC23CO,0.2898
OCC1(O)C2CC(O)C12,0.2992
COC1CC2C1N2C=O,0.246
CC1C(=O)CC=C1C,0.2226
Cc1c[nH]nc1C(=O)N,0.2294
CC1=C(N)ON=CC1=N,0.1646
CCC1NC1(C=O)C#C,0.2169
CCOC1COC1CC,0.3192
O=CC1CC11CCOC1,0.2264
CC1CC23CC(C2O)C13,0.3053
OC1CC1CCCC#N,0.3038
CCC(C)CC(=O)NC,0.2785
CC(=O)NCCCC#C,0.2765
C1C2OC3C4CC2N1C34,0.292
CC1N(C)C1(CO)C#C,0.2636
CC12NC(C3OC13)C2O,0.2956
CC#CC1C(C#N)N1C,0.2437
NC(=O)C([NH3+])C([O-])=O,0.2605
CC1(CN(C1)CC#N)C,0.2597
O=C1CN2CC3OCC123,0.1943
CC1CCOC2(C)CC12,0.316
CCC1C2CC(C)(O)C12,0.3204
COC1C2NC(=O)C12,0.2527
CC1CCOC1C(N)=O,0.263
CCC1C2(C)CCC12C,0.3151
N#CCC1=CC2CC1C2,0.233
CCc1cnc(o1)O,0.2417
CC#CCC(C#C)C#N,0.2688
CCOC1C(C)OC1C,0.3188
OC1CC23CC(CC2)C13,0.2909
CC1CC(CO)C1(C)C,0.335
CC(C)Cc1ncco1,0.2434
C#CC12CC3=CCC1C23,0.1779
CCN=C1C(O)C2CN12,0.2402
CC12NC1(C)C(O)C2O,0.2903
C(C#N)N(CC#N)C=N,0.2554
CC12CC(C1)C1(CC1)O2,0.3076
CC1(CC1)C#CC(=O)N,0.2328
CC12C3CC1C(=O)C23C,0.2435
CCCOCC(C)OC,0.3383
OC(C#N)C12CC(C1)N2,0.2776
C#CC1CC1(C#N)C#N,0.2537
C1CC1(CCCO)O,0.3275
CC(=O)N(C)CCO,0.2571
CCC1(CC#N)OC1C,0.3053
CC1=CC2NC2C(=O)C1,0.2072
CC(=O)CC(O)CCO,0.2296
CC1CN1C1CC2CC12,0.2988
CC1CC1(C)C(=O)CO,0.2401
CC1(CN1)C1=CNN=N1,0.2404
CCC1(O)COC1(C)C,0.2991
C1CC(=O)NC1,0.2747
CC1OC1(CO)C(N)=O,0.2519
CN1CC2(O)C(O)C12C,0.2571
COC1(C#N)C2CCC12,0.285
CC12CCC1N2C(N)=O,0.2714
OC(C#C)C(=O)C#N,0.1845
CC(C#C)C(C)C1CC1,0.3099
CC12CN1CCOC2=O,0.2444
CC1(C)C2OC2C1C#N,0.2951
COC1(C)CC1O,0.3161
CC(C#N)C(N)C#C,0.275
CC1C(C[NH+]1C)C([O-])=O,0.1817
CC12CC(CC1)C2CO,0.3227
CC12CC1(CO)N=CO2,0.2549
CC1NC2C(OC12)C#N,0.2479
C1CC11CN2CC2C=C1,0.2296
CC(=O)C1CCOC1=N,0.2267
c1c([nH]c(n1)C2CC2)O,0.2325
NC(=O)C1COC(=O)N1,0.2656
CC1CCCC(C)CC1,0.3757
OCC1COC(O1)C=O,0.2095
CC(O)COCC#C,0.289
OC1(CC11COC1)C=O,0.2088
CCn1c(cnc1O)O,0.241
Cc1coc(=O)c(n1)F,0.1711
CC1=CC(CCC1)C#C,0.2563
NC(=[NH2+])C1=C([O-])OC=N1,0.1743
COC1C2OC1C21CN1,0.3108
CN1N=NN(C=O)C1=N,0.1809
OC1C2CC1(OC2)C=O,0.201
Cn1nc2c(n1)CCC2,0.2334
NC(CCO)(C#C)C#N,0.2708
FC(F)(F)C1CC1C#N,0.3243
CC(=O)C(=NC)NC=O,0.2047
C#CCc1cc[nH]c1O,0.2201
CC1C2OCCCC12O,0.3107
CC1(CC(=O)NC1)C,0.2742
CC1C2C3(C)CC2(C)N13,0.3172
CNc1[nH]c(cn1)O,0.2338
CC1=C(F)N=NOC1=N,0.1612
c1cocc(c1=O)CO,0.203
OC1CC(O)C=CC=C1,0.1885
CC1CC2COC(=N)C12,0.2774
CC12CC3C4C(C13)C24O,0.3046
CC#CCNC(=N)C=O,0.1707
CC1=C(COC1)C=O,0.1834
COC1C2OCC2C1=O,0.1958
COC12CC1C(C2)C#C,0.2953
CNc1coccc1=O,0.171
CN=COCC(O)CO,0.2733
CC(C#N)C(=N)NC=O,0.2295
CC1C2C3CC1(C#C)N23,0.2629
CC1CC(CC1O)C#C,0.3046
CC1C(CO)C1(C)CO,0.3244
CCCC(=O)C(C)(C)O,0.2301
OCC1C2C3OC2C13,0.3001
OC12C3C4C3C1(O)C24O,0.2469
OC1C2CC(C2)C1C#N,0.3068
NC1=NC2C(O1)C2C#N,0.2584
CCC1C2OC2C11CO1,0.3241
C1CC2C3C=CC(O1)C23,0.2386
CC(C)(COC)N1CC1,0.3082
CC1CC2OC1C2CO,0.318
c1cc(nc(c1O)O)F,0.1963
CC(CO)CCN1CC1,0.3074
C1CC1(C(=O)CC=O)O,0.2148
CC12CC(CC1O)C2=O,0.2307
c1c[nH]c(=NCC#N)[nH]1,0.2203
CC1N=C2NCC2C1O,0.2509
OCCC(=O)C1CCO1,0.2189
O=C1C2C3CC4C3C1C24,0.2279
C1COC(=O)CC=C1,0.2421
CC(O)CNC(N)=O,0.3014
CC(C)c1[nH]c(=O)[nH]n1,0.2415
CC1(C)C=CC2NC12,0.2461
CC(C)C12CC(C)(C1)C2,0.3642
CC(C)C1CC1(C)C#C,0.2931
CC(C)(COC=O)C#C,0.2777
c1c(oc(n1)N)N,0.232
O=C1OCC2C3OC2C13,0.25
c1c(c(n[nH]1)CO)C=O,0.2019
C1=C2C3C4C3C2N2C1C42,0.1729
CC1=NC2C3N=CN1C23,0.2045
CC1C2CC1(C)C21CN1,0.3192
N=C1OCC23CC(N2)C13,0.2747
CCC(=O)C1OCCO1,0.2183
CCC1(CC1)C#CC#C,0.2179
CC(=O)N1CC(C1)C=O,0.2036
CC(O)(CO)CCC#C,0.3102
CC12CC1(O)C1(C)OC21,0.3078
OCCC12CCC1CO2,0.3091
OCC12CC1(O)CC2,0.3156
CC#CC1CCC1C=O,0.2209
C1CC(C1)(C#CC=O)O,0.2044
Cc1cc(c(nc1)N)F,0.1939
CC(O)C1C2OC1C2O,0.2995
O=C1NC2CC(=O)NC12,0.2557
COC12CC1OC1CC21,0.3022
c1c(nco1)C(=O)N,0.2274
COCCN1CC1C,0.317
OC1CC(O)C1(O)C#N,0.2831
CCC([NH3+])CC([O-])=O,0.2771
CC1OC(=O)C1CC=O,0.2261
CCC(=O)C1(CC1)C#C,0.2292
CC(C)NC=O,0.2832
CC12CC(CC1C=O)O2,0.2197
Cn1cc([nH]c1=O)O,0.2288
OC1CC2(CCO2)C=C1,0.2448
CCc1cc(c[nH]1)N,0.2225
CC1C2C(O)C3N1C23C,0.3056
CC(C)C1(CCC1)OC,0.3164
CCC1CCC(C)C1=O,0.2168
CCOCc1ccoc1,0.2435
CC1OCC=C1C1CC1,0.242
CC12CC1(C)C(O)C=C2,0.242
CC1(C)OC11CCC1O,0.3077
OCC1(O)CC1C#N,0.2979
CN=COc1n[nH]nn1,0.2222
CC(C#N)C1CC1C,0.3231
C1CC23OCC4C2NC134,0.2852
c1cnn(n1)CCC=O,0.2209
CC1CN(C)C1CC#N,0.2602
O=CC12CC(C1)(C2)C#N,0.2186
CCOC1CC1OCC,0.3175
N#CC12CC3OC(C1)C23,0.276
CCC(O)CC(=O)CC,0.2307
C1CN2C(=C1)CNC2=O,0.2203
CC12NC1C=CCC=C2,0.2299
CCC12CC3N1C2C3=O,0.2343
OC1C=CC=CC2NC12,0.1847
CCC1CC=CC(O)C1,0.2579
OCCCC1CC(=N)O1,0.2897
OC1CCC11OCC1=O,0.2113
OC1COC1(C#C)C#N,0.2574
CN1CC1(C)CNC=O,0.2771
CC1C2OCOCC12O,0.3116
CC(=NO)C1(O)CC1O,0.2226
O=C1NC=C2CN3C2C13,0.1891
CC12CN(C1)C2(C)C#N,0.2589
O=C1NCC(CC#C)O1,0.3043
O=CCC12CC1C=CC2,0.2102
CC(C)CC1OC1C,0.34
OCC1=CC(=O)C2OC12,0.1763
C#CC12CC1C1CN21,0.2428
CCC1CC(=N)OC1C,0.2863
CCCC1C=CC2NC12,0.2437
N=C1CN=C(N1)C1CN1,0.2207
N#CC1OC1CC1CO1,0.2728
CC1C2CC3(CO3)CC12,0.3275
Cc1c(c(oc1N)O)O,0.219
CNC(=O)C(N)C#N,0.2632
CC1OCCC1(O)C=O,0.2125
C#CC1CC2=NC=CN12,0.2321
OC1=CC=NNC1=N,0.1653
CC1OC(=N)C2(O)CC12,0.2628
CC1=C(C)C2(C)OC2C1,0.2395
N#CC12C=CC3C1CN23,0.2076
CC(O)C1CCC1,0.3371
CC1CC(O)C(C=O)=C1,0.1886
C1CC(=O)C=CCOC1,0.2042
CC(O)C1CCOCC1,0.3151
CC(O)C1CNC(=O)N1,0.3057
CC1C(O)CC=CC1=O,0.1873
N=C1OC2CC3C(O2)C13,0.2707
C1CNC(=O)CCOC1,0.2644
CC1N2C(=O)CC12C#C,0.227
OC12CC1(C#C)C(=O)C2,0.2175
Cc1c[nH]c(=O)nc1,0.1753
CCN1CC2C3C1CN23,0.2868
C1C2N1CC21COC=N1,0.2517
C1CN1C1C2C3OC2C13,0.3043
CCC(=NC)OC1CC1,0.2713
CCC1CN(C)C1C#N,0.2516
CN1C2CC2(O)CC1=O,0.2528
CCC1(O)CC1(O)C#C,0.2731
Cc1nccn1C(=O)C,0.1935
COC1CC(OC)C=C1,0.2591
COC1C(C)NCC1=O,0.189
CC1C2(C)C3NC3C12O,0.2762
CC1(CO)CN1C(N)=O,0.2879
CC1(O)CC2NC12C#C,0.2512
OCC1C2C(O)C(=N)N12,0.2432
CCCC(C)(C)CC#N,0.3422
OC1C2CCC2(O)C1=O,0.2184
CC1COCC(=O)O1,0.2618
c1c(c([nH]c1O)O)O,0.2238
C1COC2(C1)CCC=C2,0.2572
[O-]C(=O)CC1CNC1=[NH2+],0.2521
CC1C2COCC=CC12,0.2463
CC12C3C4C5C4C1C5N23,0.2864
CCn1c(c(nn1)N)O,0.2382
CC1C=CCC2COC12,0.2591
N#CCC1NC1C#N,0.2923
COCC12CCC1CO2,0.3121
CC1(COCCO1)C#N,0.28
c1c(cn[nH]1)NCCO,0.2171
CC1(O)CCC(C1)C#C,0.3086
OCC1CCC(=O)NC1,0.2675
C1C2CC34CC(C3)C1C24,0.312
C(C(=O)C=O)OC(=O)N,0.1544
N#CC1CN=CO1,0.2693
OC1(C#C)C2OC(=O)C12,0.2343
CC1OC2C1COC2C,0.3241
OC12CC3C1OC2C3=O,0.2105
O1C2C3C1C1N=CN3C21,0.2244
OC1C=CC2OCC1O2,0.2478
CC1C(C#C)C2CC12C,0.2983
CC(O)C(C)(O)CC#N,0.2971
Cn1ccc(n1)C2CC2,0.2471
CC1CC2COCC2C1,0.3165
CC1(NC1C#N)C#C,0.2596
OC1(CC2OC12)C=O,0.2108
C1OC11C2CC=CC1O2,0.2369
CC12CN1C(=O)OC2,0.2878
CC12CC3C1C3(C2)C#N,0.2903
O=C1CC2NC2CN1,0.2694
CCC12OC1C1(C)CC21,0.2921
CC(CC#C)C(C)C=O,0.2254
OC1(CCC2OC12)C=O,0.2127
OC(CC(=O)C#N)C=O,0.196
CC(=O)N1CC(C1)CO,0.2677
CC12CCC1=CCC2=O,0.2189
CCC1=CCCOCC1,0.2458
C1C2N=COCC3C2N13,0.238
OCC(CC#C)N1CC1,0.2978
O=COC1COC(=O)C1,0.2706
OC12CN(C1)C2C1CO1,0.3126
CCC12NC1C(=O)C=C2,0.1754
CN1C2C(=O)CC12CO,0.21
CC1OC2C3OC1C23O,0.2786
NC(CCO)C(N)C#N,0.27
CC(=O)N1C=NNC1=N,0.1841
CC12NC3(C)C1OC23,0.2976
N=C1NN=NC=C1C=O,0.1421
COC1(CC=O)CC1C,0.2245
COC1CNC1=NC,0.2506
C1C2CC1CN=COC2,0.2236
OC1=C(O)C(=N)OC=C1,0.1627
CC1C(=O)NCC1=NO,0.238
c1noc(=NCCO)o1,0.228
CCC(NC(N)=O)C#C,0.2847
O=C1C2COC1CO2,0.1985
O=CCNC(=O)C1CN1,0.2202
OC12C3OC1C1(CO1)C23,0.2935
COC(=O)C(N)C1CO1,0.2554
c1c(c(nc(n1)N)N)O,0.1878
CCCC1=NOC(=N)O1,0.2462
COCc1cc([nH]n1)N,0.2418
CCOc1[nH]c(cn1)C,0.2445
CCOc1conc1C,0.2285
C1NC1C1=NC=CC=C1,0.2227
CCCC1(O)CCC1C,0.3261
c1c([nH]cn1)C2(CC2)O,0.2418
CC1(CCNC1=O)C,0.2732
c1c(=O)nc(on1)O,0.1873
Cn1ccc(n1)CO,0.2556
O=CNC1COC1C#C,0.2668
COC(C=O)C#N,0.2236
CC1C2COC1COC2,0.3201
CNC(C#N)C(C)(C)C,0.2776
CCCc1c(nn[nH]1)N,0.2154
COc1[nH]cc(n1)C#C,0.2095
CC1OCC(=O)C(C)O1,0.2036
CC1=CC2CC(=O)C1O2,0.2012
OC(CC=O)C#CC=O,0.19
Cc1cc(no1)NC,0.2222
CC1OC(=O)C1N(C)C,0.2365
CC(=O)C1CCC1C=O,0.209
CNC(=N)c1cocn1,0.1937
CC1CN1C(=O)CC#C,0.2454
OC(C#C)C#CC#N,0.2309
CC(=O)C1CC(=O)C1O,0.2039
O=CC1COCCC=C1,0.2032
O=C(C#C)C#CC1CO1,0.1884
OCC1CCC1=O,0.2191
C1N2CC11OCCCC21,0.3119
CC1C=CC2OCOC12,0.2588
OC1CCC(=O)OC1=N,0.2538
O=C1OC(C#C)C11CC1,0.2739
N=C1NC(=N)OC(=O)N1,0.2494
c1nc(on1)CN,0.228
CC1NC11CN2C(C)C12,0.2883
CC(O)C1NC1CO,0.3157
CC[NH+]=C(N)CC([O-])=O,0.232
CN1C=CC(O)C1=O,0.1973
OC12COC11CC2C=C1,0.2218
C(CO)C(=O)CC(=O)N,0.2137
CC(CN)[NH2+]CC([O-])=O,0.2659
CCC12OC1CCC2O,0.3205
c1nnc2n1nno2,0.1939
c1c(c(co1)C=O)CO,0.189
CC1OC(C)(C)C1C#C,0.2865
COCC(C)NC=O,0.2819
CN1CC1COC1CC1,0.3063
CCCc1conc1N,0.2382
O=C1OC23CCC12NC3,0.2349
O=C1CCC11OC1C#N,0.2017
COc1ccn(n1)C=O,0.2021
COC12CC1C1OCC21,0.307
CC1CC23CCC2CC13,0.3308
NC=[NH+]C1=COC([O-])=N1,0.0825
CCCC(=O)NC(=O)C,0.2233
OC12C3OC(C13)C2=O,0.215
N#CC1C2OC2C2OC12,0.3128
COC12CC3C1N3C2C,0.2981
C1C2CC3CCOC3C12,0.3084
OC1CNC=CC1=O,0.186
O=C1CCNC1CC#N,0.1986
CCN1CCCC(=O)C1,0.2048
C#CCCC(=O)CCO,0.2309
OC1C(NC1=O)C1CO1,0.2621
CC1=C(C[NH3+])OC([O-])=C1,0.1771
OC12CCC1=CCCC2,0.2563
CC12OC3C(CC1O)C23,0.305
CC(=O)C1(CCN1)C#N,0.2018
C1C2C=C3CC4C3C1N24,0.175
CNc1nccn1C=O,0.1797
CC(=O)Oc1cnon1,0.2406
COCC12CNC1CO2,0.2921
NC1=C(F)C(=O)N=NO1,0.166
C#CC1(CNC1)OC=O,0.2425
C#CCOCC1COC1,0.2744
COC=Nc1nnon1,0.2037
COC1C(O)C1(O)C=O,0.2143
C1CC11C2CC2C11CO1,0.3293
OCC1NC11CCC1O,0.3106
CC(=O)c1c(c[nH]n1)N,0.1689
C1C2CN1C1=C2N=CO1,0.2163
C1CN1C(=O)NC=N,0.2457
CC(CO)N1CCC1=O,0.2723
CC1C2C3OC3C(=N)N12,0.2224
O=C1C=CC2C3CC12O3,0.1779
N=C1OCC23CCC12O3,0.26
CC(O)C1=NN(C)C=N1,0.256
Cc1c2n(nn1)CCN2,0.2249
CC1C2OC1C(=O)C2O,0.2075
CC(O)(CN1CC1)C#C,0.2921
CC(C)(CCC#C)O,0.3105
CC1(O)C2CC1C(=O)N2,0.2554
CC1=CCOC2(C)CC12,0.2364
NC(=O)C1(CC1)OC=N,0.2565
CC1OC11CCCC1=O,0.2036
O=CC12CCC=C1CO2,0.1962
c1cnc-2nnonc12,0.1461
OC1C(=O)OCC11CN1,0.2568
Cn1c(cc(n1)O)CO,0.2372
c1c(ocnc1=O)N,0.206
CCC1OC2COC1C2,0.3294
O=C1OCC2CC1C2,0.2756
Cc1c([nH]cc1OC)C,0.2351
OC1C2COC12CC#N,0.2727
OC1CC2(OC12)C=O,0.2196
CC(O)C12OC3C1CC23,0.2912
C1C2CCCCOC12,0.3202
CC1(CC1C=O)N1CC1,0.2156
CC1OC1COC(N)=O,0.3201
OC1CC2CC(O)(C2)C1,0.3253
NC1=CC(=N)C(F)=NO1,0.1758
CC12CN1C(C=C2)C#C,0.2314
NC(=O)C1(O)CC2NC12,0.2477
OC1COC2=C1C=NO2,0.2326
CC12CC(C1)CC(=O)C2,0.2197
CC1(O)CN2CC(=O)C12,0.1979
OC1(C#N)C2C3C1CN23,0.2636
CC(C)C1(COC1)C#N,0.2897
CC1OCCC=C1C,0.2607
CCc1cc(c(o1)C)C,0.2273
C(CNC=O)C(=O)C#N,0.1807
CN(C=[NH2+])C(=N)C([O-])=O,0.1243
CNC1=CC(=O)OC1=N,0.1756
OC1C2CN(CC#C)C12,0.2381
CCC(CC)OCC=O,0.2279
NC1=NC2C3OC1C23O,0.2233
OC1=CN=CNC1=N,0.1784
CC12CC(=O)C1C1CN21,0.2007
CC1CC(O)(CO)C1C,0.3163
C#CC12C3C1C1OC3C21,0.2674
CC(C#C)(C#C)C1CN1,0.2683
CC1C2CC1CC(O)C2,0.3309
N=C1CC(C=O)C(=O)N1,0.2205
OC1=NN(C=O)C(=N)O1,0.212
O=CC1NC1(C=O)C#C,0.1884
CC1C(CCO)OC1=N,0.2879
c1c([nH]cn1)C(=O)C=O,0.1539
OC1C2CC1(CC#N)C2,0.3032
CN=CN(C)C(=O)C#C,0.1961
CC1=C(F)C(=N)C=CO1,0.1925
CCOC(C)C1CO1,0.3404
CNc1c(cno1)C#C,0.21
O=C1C2CC2C2CC12,0.2142
CC1(CN1)C#CC1CN1,0.2595
C1C2OC3C2C2OC1C32,0.3049
CC(O)C1=C(N)C=CN1,0.2179
CC12CC(O)(C1)C=CC2,0.2517
N=C1OCC1C(=O)C=O,0.1572
Cc1c(cncn1)N,0.1969
OCC1OC11CNC1=O,0.2603
COC12CC1CCC2=O,0.2142
CC1=CC=C(O1)C1CO1,0.217
CC12C3C4N3C1C24C#C,0.2313
OC1(C=O)C2CCCC12,0.2172
C1CC2C3C4C3C2C14,0.3282
CCCC(O)C#CCO,0.287
OC12CC3C(CC13)C=C2,0.247
CC1COC1(C=O)C#N,0.2081
COCC(CC#C)C#C,0.3033
CC12C(O)C3N1CC23O,0.3142
CCC1=CC(OC1)(C)C,0.2486
Cc1c(ccn1C=O)O,0.1706
C(=N)N(C=O)C(=N)C#N,0.1982
COC12CC1C(O)C2O,0.2909
COC1COCC1O,0.3107
CN1CC1(C)CCC=O,0.214
CC1C=CC2=C1OC=N2,0.1939
CCC1CC11CCO1,0.3029
C#CC1C=CCC11CC1,0.2621
CC1CCN(C=O)C1=O,0.2152
c1c(coc1NC=N)N,0.1872
CC1OC(C#C)C2NC12,0.2825
COC(=O)C1COC1C,0.2514
COc1cc(on1)N,0.2425
CC1C2CC(O)C(=O)C12,0.216
CCC1(C)OC1C1CN1,0.3248
c1c(non1)C(=O)CO,0.1938
CCOCC1CC2CN12,0.3169
OC1(COC1C=O)C#C,0.2104
OC1CCC2C3NC3C12,0.2972
CCC1OCCC=C1C,0.2601
CC1COC(C)C1C#N,0.2975
CCC1CC(C)C1C=O,0.2206
OC1CC2=CCCOC12,0.2496
C#CC(C#C)(C#C)O,0.2593
CCN=C1OCC2CC12,0.2665
CCN(C)c1conn1,0.1762
OCC1C(C#C)C2CN12,0.2782
CC1C=C(C#N)C2NC12,0.2085
CCOC(C=O)C1CN1,0.2082
CC1C2CC2C=C1C#C,0.1986
c1nnnn1C(=O)CO,0.2216
NC(CC#N)C1CN1,0.2837
CNC(=O)C(=O)CC#C,0.1777
CC1CCC1C#C,0.3024
CN=c1nccncn1,0.1443
CC12C3CN3C1CC2=O,0.2005
CC1C2C3OC2C2C3N12,0.2988
c1nc(no1)NC=N,0.22
Cn1c(ncn1)N,0.2521
CCNc1coc(n1)C,0.2109
C1COCCNCC1=O,0.1939
CC1OC(=O)C1CC#C,0.2707
CCC1C2C(C)C2C1=O,0.2243
C(CO)COCCC#N,0.3032
CC(CC#N)C#CC#C,0.2294
CN1CC23CN4C2C1C34,0.2908
FC1=CC(=N)ON=C1,0.1663
CC(OCCC#N)C#C,0.2921
CC1CC11CC(CO)C1,0.3278
N=COCC12CC(C1)O2,0.2745
CC1OC2=NON=C2O1,0.224
N#CC12CC(CC=C1)N2,0.2268
CC1(CN1C=O)C1CN1,0.25
CC1NC1C1OCC1=O,0.215
CC12OC3C(O)C1C23C,0.3117
CCC1=CCC2OC12,0.2435
CC(C)C1COC2CC12,0.3064
CC(C)C1COCC=C1,0.264
C#CC1CCCN=CO1,0.2546
CN=C1ON=NOC1=N,0.2113
C1CN1C(=O)NC=O,0.2313
OC12C3C4C5C4C1C5C23,0.3114
C(#N)c1[nH]c(c(n1)N)N,0.1805
CCCC1OC1COC,0.3389
OC12C3C1C1=CC2=CC31,0.1543
c1cocc1CC(=O)N,0.2358
OCC(=O)C(=O)C1CO1,0.1534
CC12CC=C3CN1C23,0.1726
COC1C2OC(=N)C12N,0.2555
O=CC12CC(=O)CC1N2,0.2176
O1C=C2N=CN=C2C=N1,0.1812
CC1=C(C)C(OC1)C#C,0.2512
CC1CC(C)C(C)O1,0.3183
CC1(CC1NC=O)C=O,0.2276
Cc1cc2ccoc2[nH]1,0.2178
C#CC1=CCN=COC1,0.1941
ON=C1C2C3C2C1C3O,0.2528
CCOCC1CCC1C,0.3313
CC1C(O)C11CC(=O)N1,0.2738
C#CC(CN)(C#C)C#N,0.2627
O=C1COC2CC1C2,0.2276
CC(=O)CC12CC1CO2,0.2228
OC1CC11C2CCC1O2,0.3075
CC(=NO)C1C2CN1C2,0.2347
CCCC12OC3C1CC23,0.315
O=C1CC23COC12CN3,0.1911
CC1C2CC(C)(O)C12,0.3208
CC(C)CC1NC1C#N,0.2908
O=C1C=CNCC1C#N,0.1889
CCC1C(CO)OC1=N,0.2843
OC1CCC2=COC=C12,0.2308
C1CC2C3OC22C1NC32,0.2209
CC1(C)C2NC2C2OC12,0.3078
CC(CC=O)OC=N,0.2237
CC1=CCCC1CC#N,0.2571
COC1C(C#N)C1(C)N,0.2792
CC(O)C(C#C)C(N)=O,0.2718
O=C1C=CC(=O)C2NC12,0.1616
CC1CC(C)C2(CO2)C1,0.3293
c1c(c(cnc1F)N)N,0.2046
N#CC1C2COC12C#N,0.2558
C#CC1NCC11CO1,0.2689
CCOC(=N)CC#C,0.295
OCC12CC3CC3C1N2,0.3048
C(C#N)Nc1n[nH]nn1,0.214
CC1OC2C3CC12CO3,0.2801
CCC1(C)CC=C(C)C1,0.2603
CCCNC(=O)OC=N,0.2702
OC1CC2CC3OC2C13,0.3039
Cc1c(noc1N)CO,0.2201
O=CC12C3C1N1CC3C21,0.2056
OCC(C#C)C1CCO1,0.2898
CCc1cc(no1)CO,0.2437
CNC1=CC(=N)OC=C1,0.1614
CN1C=CC(=O)C1C#C,0.1821
C#CCCc1ccno1,0.2415
COCc1[nH]nc(n1)N,0.2339
CC1(O)C(O)C1O,0.2745
NC(=O)N1CC1C=O,0.2087
C1C2CC34CC3(CC4)C12,0.2914
O=CC1C=CCC2CN12,0.2125
CC1OC11CC2(O)CC12,0.3265
CC1OC1C(O)C=O,0.2291
CCc1c[nH]c(c1C)C,0.2391
CC1OC23CC12COC3,0.2902
CCCCCC1CCC1,0.3694
OC12CC1C=CCC2,0.2436
CC1C2COC(=O)CN12,0.2375
Cc1cc2c(o1)CC=C2,0.1882
CNC(C=O)C#CC=O,0.1683
OC1C2(O)CC1(O)C=C2,0.2425
NC(=O)C(C#N)N1CC1,0.2577
CCOCC(=O)COC,0.2337
CC1(C)OC1C(=O)C#N,0.1952
C1C(=O)NC=CC(=O)N1,0.1973
Cn1ccc2c1cc[nH]2,0.206
CC1(C)OCC1(C)C=O,0.22
COC(C#N)C#CC#N,0.2336
C1OC2CC=CCC1O2,0.2631
OCC1OC2CC2C1O,0.3021
C1OC2C3C4NC3C24O1,0.2999
C1CC2C3CC(O3)C12,0.3319
CN(C=O)C1=NCCN1,0.2196
CCC1(O)CCC1(C)O,0.2982
O=CC1CCN1CC#C,0.1813
N=C1OC2C3NC=C1C23,0.1712
CC#CC12COC1C2C,0.26
CC1C2CN3C2C13C#C,0.2687
COC1(C)C2OC(=N)C12,0.2697
CC1CC2CC(C)C12C,0.3274
OC1CC(=O)C=CC1=O,0.155
CC(CCO)C#N,0.3163
CC12CC1CC2(O)CO,0.3055
C1C2C3C4OC1CN2C34,0.2876
C1CC23CC(C4OC24)C13,0.318
CN=C1NC(=N)N=NO1,0.155
CCC1(C)CCC(C)=C1,0.2572
[NH3+]C(CC#N)CC([O-])=O,0.2636
CCC1C(C)OC1CO,0.312
CC1CC2(CC3CC23)C1,0.3326
CC1CC(=NO)C2NC12,0.2408
COCC1OC2C(C)C12,0.3064
O=CCC12OC1CC2=O,0.2148
N=C1OC2COC=NC12,0.2652
OC1CC2C=CC(O)C12,0.2373
CC1OCC11OCC1O,0.2985
CC(=O)C(C)(C)CCO,0.2287
CC#CC([NH3+])CC([O-])=O,0.265
OCC1(O)CCC2NC12,0.2997
O=C1OCC2NC2C=C1,0.2117
O=CC1CC2(CN12)C#N,0.2161
O=CC12CC=CCC1N2,0.219
C1N2C3C4CCOC13C24,0.3145
C#CC12CC3C(C1)N3C2,0.2873
CC1(CC1O)C(=O)C=O,0.1565
C(C1CO1)C1=CCOC1,0.246
NC(C#N)C1=NOC=N1,0.2329
O=C1COC11CCOC1,0.2147
OCC1OC11CC(O)C1,0.3164
CC1OCC1(C)C(C)=O,0.2263
OC1C=CC2=C1N=CO2,0.1729
Cc1cc(n[nH]c1=O)O,0.1681
c1cc-2c[nH]cnc2c1,0.1465
CC1OCC2CC12C,0.3338
CC12COCC(CO1)O2,0.3288
OC1C2OC(=O)C(=O)C12,0.1757
CCC1(CO1)C(C)(C)C,0.3376
CC1CC2(O)C(C)CC12,0.3177
N=C1NC(=N)C2OC12,0.2289
C1CN2C1C1C3OC1C23,0.2826
NC(=O)C1OC(=O)C1O,0.2454
CC(=NO)C1CCC=C1,0.2526
CC1NC(=O)C1(N)C#C,0.258
CC1(CCCC1)C=O,0.2265
COCCc1nc[nH]n1,0.2581
O=C1CN2C3CC2C1C3,0.2086
O=CC1(CC2NC12)C#N,0.2088
CC1CC23CC(C2)N13,0.2871
OCC1CC11CN2CC12,0.2898
CC(C)C1(C)CN1C,0.2973
Cc1c(c([nH]c1N)O)O,0.2265
CC1C2C3CN4C(C23)C14,0.3009
OC(C#C)C(=O)C1CN1,0.2194
[NH3+]C1CC1(O)C([O-])=O,0.2689
CC1(CO1)C(O)CC#C,0.307
CC12CC1OC21COC1,0.3111
CC1C2C=CC(C#C)N12,0.2249
CCC(C)C(=O)C(C)O,0.2328
OC(C=O)C1COC1=O,0.2292
CC#CC1(CO1)C#N,0.2522
CC(C)C(=O)C1(CC1)O,0.2209
CN=COCC1CN1C,0.2556
C1C2CCOCOCC12,0.3439
OCCC(CC#C)C#C,0.3022
CC1CC2OCC2=C1C,0.2379
CC1(C)OCC(O)C1=O,0.2158
c1c2c(on1)C=CCN2,0.1657
CC1(O)C2CC1OCC2,0.3141
Cc1c(n[nH]n1)N2CC2,0.2262
COC1CC1(C)C(C)=O,0.2273
CC(CC=O)CC1CO1,0.2276
OC1CC2OC1CC2=O,0.2159
CC1=CC(=N)NC(=O)O1,0.2149
CC1C2(C)OC(C)C12C,0.304
CC1CC1C#CCO,0.2706
OC1(CCOC1)C#N,0.2771
COCC(C)C(O)C#N,0.2742
CC12CC=CC1N1CC21,0.2345
CC1CC2(CCOC2)O1,0.3236
OC1COC2CCC=C12,0.2513
CC1(COCC(=O)O1)C,0.2633
OC12CN(C1)C2C1CC1,0.3083
Cc1nc2n(n1)CC=C2,0.192
CC1=CN(CC1=NO)C,0.1672
CC1C2OC3C2C13CO,0.2858
CN1CC11CCC2NC12,0.2981
CC1CC2CC2(C1)C#C,0.2838
O=C1CC2C3CC2(C1)O3,0.2148
CC(C)C(C)OC=O,0.2854
c1c([nH]cn1)O,0.247
CCCCC(C=O)C#N,0.225
N=C1OC2C3NC3C2=C1,0.1989
CCOC(C#C)C(C)=O,0.2255
CC(CC#N)C#N,0.3346
CC12C3CC1(C)CC23,0.3207
CC1(C)C2C3CC1(C)C23,0.3242
CC1(CC(C1)C=O)C,0.2241
OC1C2CC(O)C1C2O,0.3052
OC1CC1(O)CCC#N,0.2945
CCN(CCO)CC=O,0.1959
OC1CC1C1(CN1)C#C,0.2799
O=C1COC(=O)N2CC12,0.2082
C#CC1(C#N)C2CN1C2,0.2356
OC1COC(=N)CC=C1,0.243
CC12CC1N=C(O2)C=O,0.1811
OC1C2CNC(=O)C1O2,0.2437
CN1N=NC(=N)C=C1N,0.1577
CC(=O)CN=C(C)OC,0.2155
CCN=C1OCC1(C)O,0.2732
CC#CC1OCCC1=O,0.2096
CC1OC2C3C4C3C1C24,0.3246
CCC(C#N)C1CN1C,0.2688
O=CC1OC1C1CCO1,0.2196
OC12CC(C1)C(=O)C2=O,0.1545
COCC1C(C#C)N1C,0.2587
c1cnc-2ncocc12,0.1582
OC(CCNC=O)C#C,0.2781
CCn1c(coc1=O)N,0.2396
c1cc(n2c1CC2)C=O,0.184
OC1CC11CC2(CN2)C1,0.3098
COCC#CCC(C)O,0.2796
CC1(CO)CCOC1=O,0.2682
CC1OC23CN(CC2)C13,0.2537
Cc1cc(oc1C#N)C,0.1994
COC1OCCC=C1C,0.2601
COC=NC(C)C(C)C,0.2694
C(CCOC=O)CC#N,0.2866
CC12C3C1N1C3C21C,0.2786
Cc1c(ncc(=O)[nH]1)O,0.1427
CC1OCC2NC12,0.3133
OC1CC(O)C11COC1,0.2965
c1([nH]nc(n1)N)C(=O)N,0.1873
CN=COCC(F)(F)F,0.2781
CCC1OC=NC1CO,0.2608
CC(C)(CCO)NC=O,0.2774
CC12CC(C)(C=C1)C2O,0.2367
OC1CC1N1CC(O)C1,0.2754
CN(C=O)c1cocn1,0.2168
CCCC1(C)OC1C#N,0.2917
C1CC11C2CC1OCC2,0.3173
C1OC2CC3OCC2C13,0.3264
CC(C)CC(C)C1CO1,0.3396
COC1(CC1O)C1CN1,0.3002
c1c[nH]c(c(c1=O)O)N,0.1822
O=C1C=CNC2CC12,0.1852
CC1=CC2=CCN3C1C23,0.1719
CN(CC=O)CC(=O)N,0.2015
CC1OC=NC2CC12,0.2534
CC12C3CC4OC1C4N23,0.295
CC1=C(N)C(=O)OC1=N,0.1658
Cc1cccc(c1F)N,0.2095
C(CO)C(=O)C(F)(F)F,0.2278
CC12NC3C1NC2C3=O,0.2096
CC(O)C1OC(=N)C1C,0.286
CN1CC(CO)C1C#N,0.2495
C1NC23COC4C2NC134,0.2642
C1OC11C2NC1C1NC21,0.3067
COc1c(non1)OC,0.2265
CC(O)C1N2CC2C1=O,0.2182
NC1(COC1=N)C1CO1,0.2648
CC(=O)NCC(=O)NC,0.2466
CC(CC=O)C1CO1,0.2283
CC1C(C)N1C(=O)C#C,0.2157
CC1CC1(O)CCC#C,0.3043
N=C1OC2C=CC3C2N13,0.2121
CCc1conc1CC,0.2448
CC(N1CC1C)C(C)=O,0.2235
CC(=O)CC1CN1,0.2263
ON=C1CNC(C1)C#N,0.2413
CC1NC(=O)C(O)C1O,0.2574
CCC1CC(O)C11CN1,0.3008
CC(CO)CCCC#N,0.3101
CC1CNC(=O)C2CC12,0.2656
O=C1OCC2CC(C2)O1,0.3054
CC1(C)CC1C(=O)C=O,0.1559
COC12CC3C4C3C1C24,0.3015
CCC1(O)C2OC=NC12,0.2473
C#CCC12OC1C1CC21,0.2774
N=C1ON=C(C=O)N=C1,0.1578
O1C2C=CC=CC=CC12,0.1707
CC12COCC1C1CC21,0.3194
OC1CCC2CC(=O)C12,0.2148
Cc1cc([nH]c1)C(C)C,0.2436
c1cc2ncnnn2c1,0.1406
N=C1C2NC2CN1C=O,0.2232
CN=C1N=NOC=C1C,0.1571
CC1CC2(CC12O)C#C,0.2558
OCC1(CCCO1)C#C,0.2901
C1CN1C(=O)C(=O)CO,0.1759
CC1=CCOCCC1=O,0.1924
OCC1=CC=COC1=N,0.1697
O=CC1CC2C3CC1C23,0.2238
CC1(CO1)C1=NNC=C1,0.2581
CCC(O)CCC1CO1,0.3343
OC1CC1C(=O)C=O,0.1544
C(c1c(onn1)C#N)O,0.2049
CN1CC1(C)C=O,0.2166
OC12CCCC11CC2C1,0.3065
OC1CCC2(CC2)C1,0.3334
COC(=O)C1(CC1)O,0.2576
c1c(nc[nH]1)N2CC2,0.2459
COCC1C2C(O)CN12,0.2912
NC12C3OC1=NCC23O,0.1604
CCC12CC(N1C)C2=O,0.2474
CC12C3C(=O)C1CC23O,0.2425
CCc1cnc(cn1)F,0.206
Cn1cc(nn1)CO,0.2491
NC1=[NH+]C(=N)C(F)=C[N-]1,0.1815
CC#CC(=O)C(C)CO,0.2054
CC12COC(C#C)C1O2,0.2871
c1cc(oc1N)O,0.227
CC(N)(C#N)C(N)CO,0.2815
Cc1ncc(o1)CC#C,0.2376
Cc1c(nc([nH]1)C)C#N,0.2224
CCNC(=O)C(C)CO,0.2746
C1C2NCC3=C2N1N=C3,0.1845
CC1CCC1C(=O)C#C,0.2012
COC1OC=NCC1O,0.2746
CC1OCC23CCC12N3,0.299
COC1(C)C=CCC1C,0.2586
COC1C(=O)COC1=O,0.1991
CC1OCC2(O)COC12,0.3015
CC(=NC)OC(=O)N,0.2605
CC12CC3N1C2(C)C3=O,0.2341
OCC12OC(C1O)C2=O,0.2253
O1C2C3C4C5C2C(C13)N45,0.3074
CC1COC11COC1=O,0.2449
CC#CCC1(CCC1)C,0.2982
Cc1cc(ccc1F)F,0.2199
C#CCOc1ccoc1,0.2354
OC12C3C1C1=CC3CC21,0.2125
COC(C)(C=O)C(C)O,0.2146
CC1C2OCC(C=O)C12,0.2161
CC12OC1COC1CC21,0.335
CCC1(C)CC2(C)CC12,0.3248
O=C1CC2(O1)C1CC2C1,0.285
CC1CC11C2NC2C1C,0.3046
C1CC23OCC=C2CC13,0.2247
CCC12CN1C1(C)CC21,0.2912
CN=C1ON=C(C)C=C1,0.1602
CC1C2CN1CC(C)O2,0.2914
CCC1C(C)C11CCO1,0.2891
CC1CCCC(=O)N1,0.2673
C#Cc1cc(co1)C#N,0.1952
C#CC#Cc1ncno1,0.1793
NC1=CC(=N)NC(=O)O1,0.2122
OC1=CN=NOC1=N,0.1694
CC(C)C(=O)C#CC=O,0.1921
OC1CC2CC3OCC123,0.3012
O=C1C2OC3C2C13C#N,0.221
CC(CO)CC#C,0.3128
COC(C#C)(C#N)C#N,0.2648
C1C(CO1)(CC#N)CO,0.2746
O=CCC12CN1C1CC21,0.2029
O=C1CC2NC2C1,0.2263
Cc1c(nc([nH]1)C)C=O,0.201
CCc1c(nco1)CO,0.2339
COC(CC#C)CC#C,0.2792
c1nc2n(n1)CCN2,0.2464
O=C(C1CO1)N1CCC1,0.2445
CC(O)C(C)(C)C#C,0.3027
CC(C)C#CC1(C)CO1,0.2781
CN=C1OC2C(C)C12O,0.2574
C1CC1C(=O)CNC=O,0.2198
C1NC1C1=CCOCC1,0.2464
OC12CC1(OC2)C#C,0.2392
Cn1cc(nc1N)O,0.2247
OC1CCC=CC2CC12,0.2506
CC1CC2CCC1C2O,0.311
OCC(O)(CC#N)C=O,0.2097
CC1C(=O)C2OC2C1=O,0.2062
CC1CC2=CNN=C2C1,0.2509
CCCC1CCC1C,0.3637
C1CN(C1)C2(CC2)C=O,0.1976
CCc1c(nc(o1)O)C,0.2404
COC=NCC(C)C=O,0.225
CC12CC(C1)N1CC21,0.3181
OC1C2CC2(O)C1C=O,0.2029
CC1C(CCO)OC1=O,0.2807
CC1C2CCOCC12O,0.3121
CC1CN1C1=CC=CN1,0.2305
OC1CC1C1CC(O)C1,0.3259
CC1N2CC1(C)C2CO,0.304
Cc1ccnc(n1)CO,0.2062
CCC1(CCC1)C=O,0.2256
NCC1(COC1=O)C#N,0.2394
CCOC(=O)C(=O)C#C,0.1701
CCc1c(nn(n1)C)N,0.2174
c1ccn(c1)CCO,0.2465
c1c2c([nH]cn2)[nH]c1N,0.2122
c1c(c(co1)OC=O)N,0.2067
c1c2c(ncn1)nno2,0.1816
CC(=O)C1C2CC1C=C2,0.2054
CC1CC=CCC1C#N,0.2669
CC1(C)C2CC1C=C2,0.2372
CC(OCCO)C1CC1,0.3365
C1C(CO1)OC(=O)CN,0.2563
C#CCc1ccc([nH]1)O,0.2276
OC1CN2N=C(O)C=C12,0.2304
OC1COC(=N)OC1,0.2863
OC1CCCC2(O)CC12,0.3205
CCC(=NO)CCO,0.2504
OC1CC2(O)C3CC3C12,0.284
OC1C(COC1=N)C#C,0.2766
COC12CCC1OC2=O,0.252
C1C=CC2C3C=CC1C23,0.2327
CCOCCC(=O)OC,0.2688
NC12C3OC3C1C2C#N,0.2725
C#CCC1(CC1)CCO,0.3117
CC1NC2=NCCC12O,0.236
CC1CN1C1=NNN=N1,0.2117
C1C2OCC(C12)N1CC1,0.3138
NC(=O)C12CC=CC1O2,0.2377
CC12CCC1(C)C1NC21,0.3165
c1c2c(on1)CC=CC2,0.2348
c1c2c([nH]nn2)ncn1,0.1921
CC1=CC(=N)OC(O)=C1,0.1708
c1c([nH]nn1)CCC=O,0.2176
CC1OC2(C#C)C(O)C12,0.2447
[O-]C1=CC(=[NH2+])NC=C1,0.203
CC(=O)OCC(O)CO,0.2489
O=C1NCC1N1CCC1,0.2524
N=C(OCCC=O)C#C,0.2232
CC1N2CC2C11COC1,0.2989
Cc1c(ocn1)COC,0.2363
OCC1NC(=O)C1C=O,0.2206
C#CC#CC1(CO1)C#C,0.2113
C1OC11CC2C3OC1C23,0.2993
CC1(C)OC11CC2OC12,0.3236
OC12CC(C1)OCOC2,0.3206
CC(=O)C(O)C=O,0.2051
CC(O)CC1=CC=CO1,0.2359
CC1(CO1)C12CC(C1)C2,0.3471
CC1COC(CO1)C=O,0.2117
O=CN1C=CC2OCC12,0.2077
OC1C2CN3CC1(O)C23,0.2697
CC1OC(=O)C(O)C=C1,0.2499
CNC12CC1OC2=NC,0.2514
CN1CC=CCNC1=O,0.2201
O=C1C2CC1C1OC21,0.2371
CCC1CCOC1OC,0.3384
CC12COCC1(N2)C=O,0.2161
CC1NC2CC12C#N,0.2524
CC1CCC2CC2(C)O1,0.3157
CC(CO)C1(C)COC1,0.3116
CC1C=C2C3C4C1C2N34,0.1609
CC(O)C1(O)C2CC1O2,0.321
Cc1cc(on1)N(=O)=O,0.1935
OCC1COC1C#N,0.2754
CNC=Nc1cn[nH]n1,0.1988
CCNC(=O)NC=NC,0.2483
NC1=C(F)NC=CC1=N,0.1744
CN1CCC(O)C1=O,0.2734
Cc1c(nn[nH]1)NC=N,0.2181
Cc1coc(=O)nc1O,0.1965
CC1(C=CC2OC12)C#C,0.2392
CC1(O)COC11CC1O,0.2864
C#CC#Cc1n[nH]nn1,0.1913
N=C1NC(=N)C=NC=C1,0.1467
CCN1CC(C)C1C#N,0.2523
CC1(COC(=N)O1)C=O,0.2078
COC1(C)COC1C#N,0.2746
NC(=N)C1OCC(=O)O1,0.2514
C#CC1CCOC=NC1,0.2581
C#CCC1CC2CC1O2,0.3031
Cn1cnc(c1O)C#N,0.2258
CC1(O)COCOC1=N,0.2767
O=C1C2C3NC1C23C#N,0.2207
CC#CC1CC1(C)O,0.2812
N=C1OC(=O)N2CCC12,0.2609
CC1(O)CC(O)C1C#N,0.294
COC(=O)C(O)C#N,0.2807
CN1CC2OC2C1=O,0.2493
CC12N=CN3C1C2C3=N,0.214
CCC1C(C)CC1C=O,0.2205
COC=NCC1(CC1)O,0.2664
O=C1NCCC11CO1,0.2514
C1C2C3C4CCCC24N13,0.3003
C#Cc1concc1=O,0.1771
CC(CO)C1COC1=O,0.2762
C1C2COCC3CC2C13,0.317
c1c(c2c([nH]1)nco2)N,0.1878
CC1CC2CC2(O)C1C,0.3074
NC(=O)C12C3CC1OC23,0.2531
Cc1c(c([nH]c1N)C)N,0.2379
CC1C2N1CCC2(C)O,0.2854
CC1N(C)C11COC1,0.2967
CCC1OC(=N)C1N,0.2686
CC1=CC2CC2C1=NO,0.187
OC1CNCC(=O)OC1,0.2348
OC1C=CC(=O)OC1=N,0.2147
OC1C2C3CC1CN23,0.3027
CC12CN1C(CO)C=C2,0.2313
COC1CCCC1,0.3277
O=CC12CCC(CO1)O2,0.2169
CCC(=O)C(OC)C#C,0.209
CC1(COC(=O)C=C1)C,0.2168
N#CC12C3CC1NC23,0.261
CC1(CC=CC1(C)C)C,0.2625
CC1OC2CC11COC21,0.2773
CN1C(=N)ON=CC1=N,0.1801
O=C1NC2CCC3C2N13,0.2708
CCCC(=O)C(=N)NC,0.187
CC1(O)C(O)CCC1=O,0.2185
c1cc(=O)[nH]c(c1N)N,0.17
C1OC2CC1CC1OC21,0.321
CC#CC1C2CCCN12,0.2561
CC12OCC1CC1OC21,0.31
COCC1OCC1C#C,0.2921
COC1(C)CNC1C=O,0.2089
CC12CC3C(CC1)C3O2,0.2986
CCC1CC(O)C1(C)C,0.3265
CC(O)C1(CN1)C1CO1,0.3195
O=C1CC2NC1C1NC21,0.202
C(CO)COCCO,0.3343
CC1(CO1)C1CO1,0.3414
OCCCC(C#C)C#N,0.2872
C1CC12COC(=O)O2,0.3201
COC1CN=C2OCC12,0.2638
OC1C2C3CC3C12C#N,0.2372
CN(C)C(=O)C#C,0.221
OCC1CCC(CO)=C1,0.2496
Cc1ccc(cc1)F,0.2258
O=C1C2CC2NC1C#N,0.1999
O=C1C=CCCC2OC12,0.19
OC1C2C3C4CC4N2C13,0.2987
N#CC1C2CC1OCC2,0.2896
COC(=N)N(C=N)C=N,0.2262
CC(C)(C=O)OC,0.2262
CC1(CC1O)C1(O)CC1,0.3133
O=C1CNCC2CCC12,0.1912
CC(C=O)C12CCC1O2,0.2173
OC1C2CC3OC1C23,0.307
C1C=Cc2n1c(=O)on2,0.1865
C(C=O)N=c1[nH]nn[nH]1,0.1995
CC12NC1(CC2=O)C=O,0.1891
CC1(CC2OC12)N1CC1,0.3166
OC1CC2C=CC(=O)C12,0.1913
NC1COC(=O)NC1=N,0.2429
CC12CC1(CCO)CC2,0.3192
C1CC2CC1CCC2,0.3614
CC12CC3OCOC1C23,0.3178
CN1CC1CC#CCO,0.2599
CC(O)C1C2OC1C2=O,0.2458
OC1CC(CC#N)C1=O,0.2222
CCC1CCOCC1,0.3309
N=C1CN=C(N1)C=O,0.1586
CCCC1COCOC1,0.3367
N#CC1C2NC(C#N)C12,0.2618
CCC1COC1=O,0.2805
N=C1OC=CC(=O)C=C1,0.1733
c1c(nn[nH]1)CC#N,0.2556
CC1CC2COC(C)C12,0.3167
CC1(C)CN1C(=N)C=O,0.1733
CC#CC(C)(O)CC=O,0.2195
C1CC11CC2OCC=C12,0.2295
CC1OC2CC3OC1C23,0.3137
CC1C(=O)CC=C1CO,0.2232
CC1(O)CC2OC1C2O,0.3193
CCC1N=CNC1=NC,0.2207
CC1CC(C)C(C)C1,0.3716
CCC(C)C1C(C)N1C,0.2839
CC1C2C3N1C2C3(C)O,0.3167
CCC1CC=CC1,0.2649
N=C1N=CN(C=O)C=N1,0.1861
O=C1C2C3C4C3C1CC24,0.2196
CC1OC23CC2(CC3)O1,0.2981
CC1CCCOC(=O)N1,0.2859
CC12NC3CC1(C#N)C23,0.2537
OCC1CC11CC(=N)O1,0.2746
CC(C)(CCC#N)C=O,0.227
NC(=O)NCC1CCO1,0.2993
CC1=CCC=CC=C1,0.1861
C1CC2CN=COC2C1,0.2712
[NH3+]C(C#C)C#CC([O-])=O,0.2236
CCC12CN1C(=O)CC2,0.2413
CC(C)(C)NCC#N,0.2684
C#Cc1conc1C=O,0.1833
CC1C2NC2C2(C)NC12,0.2892
O=COC1C2CC1C2=O,0.2432
OC1CN2CCN=C12,0.2421
CC12CC1C(C)(N2)C#N,0.2755
CC1C=C(CC1=O)C=O,0.1837
c1coc(n1)OCC=O,0.1935
COC1C2CC3C2C13C,0.328
CC1C2CCC=CC12O,0.2463
C1OC11C2CCC1C=C2,0.2586
CCN(CCO)C=O,0.2583
CC1(C)C2NC(C#N)C12,0.2504
C(c1c(nno1)O)O,0.2039
OCC1OCC1CC#N,0.2833
CC1(O)CCC(C1)C#N,0.3162
CC(COCC#C)C=O,0.2305
C1COCCC(=C1)C#N,0.2099
CCCC1(C)CC(C)O1,0.3204
N#CC1OCC2CNC12,0.2662
CC(=O)N1CC2CC2C1,0.2657
O=CC1CC2CC(=O)N12,0.2091
NC(=O)C(O)C=O,0.2077
O=C1C2NC2C1C1CO1,0.2171
FC1=CNC=C(F)C1=N,0.1831
CC1C(C2CO2)C1(C)O,0.3197
CC1(C)C2CC1(C2)C=O,0.2145
O=C1NC2C3OC2C3N1,0.2954
CC1(COC1C#N)C=O,0.229
Cc1nc(nn1C=O)N,0.1817
CC1=CC(O)CC(=O)C1,0.2252
CC(O)C1COC(N)=N1,0.2783
O=CC12CC(CO1)C2=O,0.1914
Cn1cc2c(n1)CCC2,0.2417
CC1=C(OC=N)N=CN1,0.2237
CC1=CC(=N)C(N)=NO1,0.1826
CC1(C)NC1C(O)C=O,0.2141
CC1(O)C2C3N4C3C1C24,0.2873
CCc1c(oc(n1)C)C,0.2326
N#CC12NC3C1COC23,0.2624
CCN1C(=N)ON=C1N,0.2426
CC#CCN=COC=O,0.2367
O=C1C2C3OC1(C#N)C23,0.2175
C1CC2NC2C2NC2C1,0.3058
CC1C2OC3C4C3N1C24,0.2766
C1C2CCC3(CO3)CC12,0.3363
CCn1cc(cc1N)N,0.2211
O=CC1C2CC1C2C#C,0.221
CC(C)(O)C1CN2CC12,0.2916
NC(=O)C1C2C3OC3C12,0.2683
CN1C2C3C1CCC23C,0.2933
Cn1c(=O)oc(n1)CO,0.2404
N=COC12CC1C=CC2,0.2488
C1OC2CN3C1C3CO2,0.3001
c1c(c(nc(n1)F)F)N,0.1886
CCC1(O)C2CC=CC12,0.2368
CC1OC2CC1C2(C)C,0.3215
OC12CC1C1(CC1)OC2,0.3007
CC1C2CC(C)(O)CN12,0.2789
OC1(CC1)C1CC2OC12,0.3215
CC1(CC1)CN2CC2,0.3141
CC(C)(OC=N)C=O,0.2256
O=CC1OC2C1CC2=O,0.1938
CC12CC(CC#C)(C1)O2,0.2823
COc1ncc(nn1)F,0.1686
CC(C)(C#C)C1CC1O,0.3037
CC1(CO)NC1(C)C#N,0.2738
Cc1cc[nH]c1CC#N,0.2365
CCc1ccc([nH]1)CO,0.228
OCC(OCC#C)C#C,0.2667
CC1CNC(=O)C(=O)O1,0.2092
CC1C(C)=CC(O)C1=O,0.2212
CC([NH3+])CC(C)C([O-])=O,0.2756
C#CCc1c(cc[nH]1)N,0.2309
C#CC1C2N1CC21CO1,0.2678
O=C1C=CC2CCN12,0.2066
CCNc1c([nH]cn1)O,0.2383
OC1C2CC(O2)C1C#N,0.2927
OCCC(CC#N)C=O,0.2244
c1c2c(c([nH]1)N)[nH]cn2,0.1946
CNc1cn[nH]c(=O)n1,0.1893
COCC1(CN1)C#CC,0.2787
Cn1c(cc(c1N)O)N,0.2244
OC12COC1CNC2=O,0.2638
CCCOc1c[nH]cn1,0.2275
CC(CC(=O)C#C)C=O,0.1956
C(C=O)C#CC#CCO,0.2025
CC1C=CCCCC=C1,0.2569
CCC1CC2NC2C=C1,0.2481
CC1(C)C(O)C=CC1=O,0.1887
CC1(CO1)C1=NNN=C1,0.2484
N#CC12CCC3C(O1)C23,0.2542
O=CC12CCN1CC2,0.1921
O=C1OC2C3CC(C3)C12,0.2771
C1OC2COCC=C12,0.2496
C[NH2+]CCC#CC([O-])=O,0.2288
CC1COC1CCO,0.3239
COC(=O)C(C)C#N,0.2792
CCC(=O)OCC#CC,0.2721
OC1C2CNC12C#N,0.2457
CC1CC2C=CCC12C,0.2596
COC1C2CN2C1CO,0.3004
CC12CC1C(C#N)C2=O,0.229
CC1=CCc2c1noc2,0.2141
CN=COC12CN(C1)C2,0.271
COCCC(C#C)C#N,0.2775
C1C2OC1C1N=COC21,0.2683
COCC1C2C3CC2C13,0.3385
COC1C2C3C1CC23C,0.327
C1OC1C1CC2CC2C1,0.3404
OCCOC(=O)C1CO1,0.2537
O=C1OC2C(C3CO3)C12,0.2688
CN(C)C(=O)CCC=O,0.2273
CCC(C)C,0.3934
CCN1CC1C1(C)CN1,0.3021
O=COC12CC1CCC2,0.2741
CCC1C(=O)CNC1=O,0.2097
CC1(NCC1=O)C1CN1,0.2165
CC1NC(CC=C1)C#N,0.2559
C1C2CC3CC=CCC123,0.2674
Cn1c(=O)ccc(n1)N,0.1539
O=CNC1CC1CC#N,0.2724
CC1(CO)CCN=CO1,0.2748
C1C=CNC(=O)C=CN1,0.1896
CC1C2C3OC2(CO)C13,0.3044
CC1=NC2(CC2O1)C#C,0.2524
C1C2OC3CCC3OC12,0.2796
CC1=CCC(O)CC=C1,0.1953
N#CC12CCC1=CCO2,0.2373
CC1C2OCC12CC=O,0.2088
CC12CC3C4CC1C2C34,0.3277
CC1NC(=O)C2OCC12,0.2424
COC(C)C12CCC1N2,0.3277
C1CC1(CC2COC2)O,0.3003
OC1C2CC1(O)C2=O,0.2387
C1C=CC(=NO)C(=O)O1,0.1799
CNC1(CNC1=O)C=O,0.192
OC12C3C1C1=CC2C3C1,0.1164
O=C1C2C[NH2+]C2[C-]1C#N,0.1793
COC1C(N)C1(C)C#N,0.2708
CC1C2CC(C)(C)C12C,0.321
CC(C)(C)C(C)(N)C#N,0.3004
c1c(nnc(n1)N)C=O,0.1587
CC12CC(C1)C=C2C#N,0.1991
C#CC1OCC11CCC1,0.2703
CN1CC=C(C1=O)C#C,0.1966
C#CCOc1conn1,0.2029
CC(C1CO1)C(C)(C)C,0.3325
CC12CC1C=CCOC2,0.2438
CCn1ccc(c1O)O,0.2285
Cc1c(noc1OC)C,0.2341
CC12CC(=O)C1(O2)C#C,0.2109
Cc1c(c(on1)C#C)N,0.1809
CC1OC2CC3CC12O3,0.3044
CC1C(C)C(O)C1C,0.3062
CC(=N)OCC(=O)CO,0.2351
C1CCC(C1)(CCO)O,0.3253
CC(=N)OC(C)=O,0.2681
OCC12OC3C1CC23,0.3073
CCOCc1c[nH]nc1,0.2602
OC1C2C3CN2C3C1=O,0.1968
CC#Cc1cc([nH]c1)C,0.2145
CCOC12CC1CC2C,0.3251
CCCOC(=O)C1CO1,0.2629
CCC(C)(C)NC=O,0.2775
CC12CC34C=CC(C13)N24,0.2113
C#CCC1COC=NC1,0.2709
O=CC(=O)C1CC2CN12,0.1453
CN1CC1C1COC1,0.3059
CC1C2C=C3COC3C12,0.2289
CCC(=NO)C,0.2562
CC(C)C1NC1C#N,0.2909
c1c(cn[nH]1)C(=O)CO,0.2101
CCn1cn[nH]c1=O,0.2385
NC(=O)N1CC(O)C=C1,0.2146
CC1NC(=O)CC11CN1,0.2713
CC1=CCC2OC12C=O,0.2079
C(C(=O)N)n1nnnn1,0.2399
c1[nH]c(c(c(=O)n1)N)N,0.1863
c1c(c([nH]n1)N)O,0.2312
COC1CCC1(C)C=O,0.2222
CC1(O)CC2OC(=O)C12,0.2755
OC1(CC1)C1CC2NC12,0.2914
CC1C(C)C2(CO)CN12,0.3109
C#CC12COC(C1)C=C2,0.2454
C1COCCC1=O,0.2243
CC1OCC2C3CC3C12,0.3114
CCn1c(c(cn1)N)N,0.2359
CCC1OCC(=O)CO1,0.2061
c1cnc-2c[nH]cnc12,0.1638
O=CCCC1C2CCC12,0.2261
CC1=CC=CCOC1,0.1879
CNC(=O)CC1CN1C,0.2701
Cc1nc([nH]n1)N2CC2,0.2616
OC1C=C(CC1=O)C#N,0.2079
FC1=NC(=N)ON=C1,0.1677
COC12CC1CC2=O,0.2203
O=CC1CN2CC12C#N,0.2126
CC1(O)C2C3C=CC1C23,0.2276
CCCN1CC1(C)CO,0.2984
CCC(=O)C(C)O,0.2374
Cc1cc(cnc1)NC,0.1897
CC1C(OC1=N)C(C)=O,0.2233
Cc1nc2cocc2o1,0.1974
COC1COCC11CN1,0.303
NC1=C2C3CC3N2C=C1,0.1983
CC1(C)OC2C(C=O)C12,0.2108
OCC1OC1CC#N,0.304
CCC1C(CC)C1(C)C,0.3272
CC1(O)CC(O)C1CO,0.307
CCN=C1NCC11CO1,0.2408
CC1(CO1)C1C2CC1C2,0.3525
C1CC2=CCOC2=NC1,0.204
O=C1C2(CC2)CC11CO1,0.2021
CCC(C)CNCC#N,0.2695
COC1CC1(O)C(C)O,0.2992
CC12CC3OC1C23C#N,0.2595
C1OC2CC3=CCCC123,0.2397
CC1(CC1CO)C(N)=O,0.2699
C1C(CC1=O)OCC=O,0.2147
c1(nc(nc(n1)F)N)N,0.2477
CC(O)C#CC#CC#C,0.1821
CC1=CCC2C3CC1C23,0.2536
O=C1C2C3C2C1C3C#C,0.237
CC12C(CO)C3C1OC23,0.2963
CCCc1cc(on1)N,0.2327
COC=NC(C)C1CO1,0.2669
c1c2c(co1)NCC2,0.2178
CC12OCOC1C2O,0.3103
CC12CN3CC1(O)CC23,0.28
N=C1CN=C2OCCN12,0.2372
CC1CCC2(CN12)C#N,0.2772
c1c(c(c[nH]1)C=O)CO,0.1913
CC1CCC1OC(N)=O,0.3229
O=CC12C=CC3CC1N23,0.1978
CCc1c[nH]c(n1)OC,0.2497
CCC1(CN1)C(O)C#N,0.2936
CC1N(CC#N)C1(C)C,0.2678
NCC(O)(CO)C#N,0.3042
CC(C)(C)C(C#N)C#N,0.3225
C1CC(=O)C1,0.2222
O=C1CN2C1CCC2=O,0.2148
CCC12NC1CCC2O,0.3008
CCC1CC1CCO,0.3421
O=C1C=CNC2CCC12,0.1822
CC1(C(=CCO1)C=O)C,0.1805
CC1CCC(C)(O)CO1,0.3199
CC(C)(C)C1CC1C#N,0.3108
c1cn[nH]c1C2CCC2,0.251
C#CC1C2CC1OCC2,0.2846
O=C1CCC2OC12C#C,0.2085
CC1CC2(CC12)N1CC1,0.2955
CC1CC2CC1(C)C=C2,0.2546
OC1(CC1)C1CC(=O)N1,0.28
O=CC12CN1CC21CN1,0.1922
NC1(COC1CO)C#N,0.2746
COC(=O)CC1CCC1,0.2855
OCC12CC3C1C2C3O,0.319
N#CCCC12CCC1O2,0.2982
CC1COC11CC1C#N,0.2757
COC1CC1C#CC=O,0.1943
N=C1NC=CNC1=O,0.1768
CCC1C(O)CC1C#N,0.3028
CC(C)(CCC=O)C#C,0.2276
OC1C2C3CN2C13C#N,0.2537
OCC1OCCN2CC12,0.306
c1c(non1)C#CC=O,0.1811
C1CC2(CC2)CNC1=O,0.2689
c1cc(n(c1N)C=O)O,0.16
CC#CC(=O)OC=N,0.2213
NC1=NC2(CC2O1)C#N,0.2621
N#CC1C2C3CC2N1C3,0.2569
CC1OC(=N)C(O)C1C,0.2776
CN1C2C3C1C(O)C23C,0.2684
CC1C(CO)C2CC12O,0.3189
CC1C(N)C2(CN12)C#N,0.248
C1CC1C1C2C3CC1N23,0.3245
N=C1NC(=O)C=NC=C1,0.1553
CC1(CN1C=O)C(N)=O,0.2333
COC1CCN2CC12C,0.3076
NC1C([NH3+])C1(O)C([O-])=O,0.2
CC12CCCC1CC=C2,0.2663
CN=C(C)OC(C)C#N,0.2734
CC1=NC(CO1)C=O,0.2136
OCC1CC1C(=O)C#N,0.1887
FC1=NOC(=N)C(F)=N1,0.1697
COC1COC11CCC1,0.3103
NC12C(C#N)C1N1CC21,0.2483
c1c[nH]c(c(c1=O)N)F,0.1804
OC1CC2(O)C3CN3C12,0.2695
COCC1(CCC1)C#N,0.3036
CC1(CC2(CO2)C1)C=O,0.2297
CC1(CO)CCC1CO,0.3307
OC1CC(C1)C1(O)CC1,0.2991
CC1C(O)C2(CO2)C1=O,0.2021
N=C1OC(=O)CNC=C1,0.1894
CC1C=CC2C3OC1C23,0.2376
CC(O)C(O)(CO)C#C,0.2747
c1c([nH]nc1O)CC=O,0.1905
CC1CNC=C1C=O,0.1794
COC1C2OC1C2C#C,0.2716
Cc1cc(n(n1)C)NC,0.2394
O=C1CCCC(O1)C#C,0.2669
CCC#CC1=NCCO1,0.2173
Cc1ncnn1C(=O)N,0.241
NC(CC#C)C(F)(F)F,0.3071
CCOC12CN(C1)C2,0.3219
COCCC(=O)COC,0.2349
CC1C(CC11CC1)C=O,0.2214
CC1(CC=CC1=O)C#N,0.1926
CC1NC11COCOC1,0.3161
CC12CC3CC1C2CC3,0.3246
OC1CC(=O)C2CCC12,0.2164
CC(=O)C(O)C#C,0.2257
OC1C2COCCC12O,0.3023
c1cc(=O)oc(c1N)N,0.1629
CCC(=O)NCC(C)O,0.2773
CCCC12NC3C1OC23,0.2919
N=C1CC2(CCC2)CO1,0.2842
CC(C#C)C(O)C#N,0.2826
CC12CC3N=CN1C23C,0.2372
N#CC1CC2CCC2N1,0.2672
CN1CC1(C#C)C1CN1,0.2602
OCC1CC2CC1C2=O,0.2302
CCOC=NC1CC1O,0.2363
OCC1(O)C2CC1C2=O,0.2552
CC1C(C)C1C(C)=NO,0.2348
C1CC(=O)COC(=O)C1,0.2164
OCC1CC2C(C#C)C12,0.2892
CC(C)(CO)C(=O)C#C,0.2029
c1c([nH]cn1)C#N,0.2175
COC(C)CC1CN1C,0.2953
N#CC1CC2=NCCN12,0.2432
C1CC1OCC#N,0.2822
CC1=NCC2CCC2O1,0.275
c1c(nnn1C=O)O,0.1791
N=C1OCC1(C#C)C#N,0.2788
CC1(O)C2C(=N)OC12C,0.2714
CCC12NC1C1(O)CC21,0.2795
N=C1NC(=O)C=CC=N1,0.1553
c1c(noc1N=CN)O,0.1864
CC1(O)CC2CC3C1N23,0.3057
O=CCC(C#C)C1CC1,0.226
CC1OC2(C)C3CN3C12,0.2885
CC1=CC=CCOCC1,0.1996
CCC1NC(=O)C2NC12,0.253
CC12C3CC11C=CC2N31,0.2102
C#CC1NC1C#N,0.2702
CCCNC(=O)NC,0.3027
CCCC1=NCC(C)O1,0.2731
CN=C1CC2CC2CO1,0.2707
CC1NC(CCO)C1=O,0.2154
Cc1cc(n[nH]1)N(C)C,0.2164
C#CCOCC1CCO1,0.2745
O=C1CC2C3CC2C3O1,0.2703
N#CC12CC1CN2,0.2557
c1c2c(on1)OCO2,0.2038
CC(O)C(CO)CO,0.3084
CCCC1(C)CN=CO1,0.2724
CC1OCOC1C1CN1,0.3259
N=COC12CN(C1)C2,0.2721
ON=C1CC2CCC2=C1,0.1894
C#CCCn1ccnn1,0.2543
CC(C1NC1C)C(C)=O,0.2276
OC1C2CC2CC11CO1,0.3155
CC(C)C(=O)C1CC1,0.2292
C#CC1CC11C2CC1C2,0.2876
CC(C)CC(C)(C)C#C,0.3141
CC12NC(=O)C1CC=C2,0.2449
CC1C=CCC=CC1=O,0.1859
CCC1CCCC2OC12,0.34
CC1OC(=O)C1C#C,0.2673
CN1CC1C#CC(C)=O,0.1895
C#CC#CC(=O)NC=N,0.1823
CCCC(C#N)C(N)=O,0.277
N#CC12CC(C1)COC2,0.292
CNC(=O)C1CC2NC12,0.2626
O=C1OC23CC12C=CC3,0.2411
O=CC1CC1CC1CC1,0.2286
CCC1CCCCC=C1,0.2554
CC1C(O)C1([NH3+])C([O-])=O,0.2672
Cc1c([nH]c(c1N)C)C,0.2315
CC1OC1C(O)CCO,0.3226
OC1CCC1COC=N,0.2823
CCCC(C)COCC,0.3356
C1CC(C1)OC2COC2,0.3143
CCCC(CC#C)C#C,0.3048
CC12CC(=NO)C1O2,0.2469
CC1CCCC(C)OC1,0.3234
CC12CC1CC=CC2=O,0.1917
N=C1N=COC=NC1=N,0.209
C1COC(=O)C(=O)C1=O,0.1335
CC(CC#N)(C#N)C#N,0.3151
C1C(CO1)CNC=O,0.2725
CC#CC1N2CC1(O)C2,0.2702
CC1(CC1)C#CCCO,0.2842
CC1(O)CC2OC12CO,0.3059
CC1=CC2OC1C1OC21,0.2366
O=CCC1C=CNC1=O,0.1982
CC(=O)CCC(=O)C,0.2343
CCC(C#N)(C#N)C#N,0.3235
CC1(CNC1=O)C1CO1,0.2782
CC12CC3C(C1)C3C2=O,0.226
CC1OCC11COC1,0.3092
Cc1c(c(no1)O)C=O,0.1925
OC1C2CC2C1CC#C,0.2976
O=C1C2CC3OCC13N2,0.2326
CC(=O)CC12CC1OC2,0.2128
c1cnc(nc1O)F,0.2301
c1ccn(c1)C(=O)C=O,0.1306
CC#CC(CO)C1CO1,0.2935
CC12CC(=O)OC1C2O,0.2747
CC1=CC(=N)ON=C1F,0.1662
C(C=O)c1c(non1)N,0.1907
C1C2COC12C1CCC1,0.3072
CC1(C)OC1(C)CCO,0.3345
NC(=O)C([NH3+])CC([O-])=O,0.2541
OC12CC1OC2CC#N,0.2804
CNC(=O)C#CC(C)O,0.2324
C#CC1CCCCC1,0.3166
CN=C(N1CC1)C1OC1,0.2364
CCC(OC)C(=O)C#N,0.1845
C[NH2+]C(C)(C)C([O-])=O,0.2674
CCC(C=O)(C#C)C#N,0.2169
C#Cc1ccc[nH]1,0.202
OC1(CC1)C1CNC1=O,0.2762
O=CC1OC1CC1CO1,0.2188
c1cc2c(nc1)non2,0.1733
CC1=NC2CC2CO1,0.2522
OCCC1CNC(=O)C1,0.2735
O=CCC12CN1CC2=O,0.2185
O1C2C=CC3C=CC1C23,0.2245
CC1C2C3OC3C12C#N,0.2536
OC1=CNC(=C1)C1CN1,0.2157
CC1(C)CC=CC2CC12,0.2453
CC#CC(=O)C1CN1,0.1978
CC1(C)C2CN2C1C=O,0.2092
C1C2COC3=C2N1C=N3,0.1718
CCN(C)CC#CC#N,0.1927
C1N=C2NCCN3C1C23,0.2198
CC(C)C1(C)CC1C#N,0.3111
Cc1cc(ccn1)C#C,0.2053
CCC1OC2CC(C)C12,0.3094
CC1CC(C1)OCC#C,0.2847
CNC(=NC)C=O,0.1615
CC1OC1C(C)(O)C=O,0.2109
N#CC1(CC1)C1OC1,0.3068
Cn1ccncc1=O,0.1698
COC1C2CC1(N2)C#C,0.2625
CC12CC(O1)C(O)C2=O,0.195
C1C2CC3C4CC3(O4)C12,0.2939
Cn1c(=O)[nH]cnc1=O,0.2247
COCC(C#N)C#CC,0.29
OC12CC1(O)COC2,0.2975
C1OC23C4C5C4C12CC35,0.2753
OCC1(CC=O)CCO1,0.2248
CC1=C(C=NO1)C1CN1,0.2393
OC(C#C)C1CCC1,0.2929
COC1CN2CCN=C12,0.2427
Cn1c(c(c(n1)O)N)O,0.2558
CC1(C(C1(C)C)CO)C,0.3129
C#CCc1c(nc[nH]1)N,0.2243
O=C1C2NC1C1OCC21,0.2278
CC1C2N=CN3C2C13C,0.2347
OCC12CC3C(CC13)C2,0.3321
C(CO)NC(=O)NC=O,0.2428
CC1(CC(C=C1)(C)C)C,0.2656
CC1(O)CC(CC=O)C1,0.2262
CCOC1CN(C1)C,0.2956
Cc1cc(ncc1C)O,0.2093
CC1(C)C2C(O)CN12,0.2869
OC12COC1C=CC2,0.2508
OCC1CC(O1)C1CO1,0.3117
C1CC23OC4C2CN1C34,0.2763
CN=C1N=NOC=C1F,0.1566
C(C1CO1)C12CC(C1)C2,0.3559
NC(C#N)C1COCO1,0.2808
C1CN1CC(=O)NC=N,0.2375
CC12CN1CCCOC2,0.3082
OCC1OC2CC=CC12,0.2547
CCN1C(C)C(O)C1=O,0.2666
CC(C)N1CC1CC#C,0.2764
CCC12CC3CC1C23,0.3318
C(=O)(C(=O)N)N,0.21
OCC1=CC(=O)OC1=N,0.1976
CC1C(CO)C1OC=O,0.2585
CC1C2CN2CC11CO1,0.3093
CC(=O)C1OC(=N)C1O,0.207
c1cc([nH]c1C=O)N,0.1678
CC12C3C4C1C2(O)C34O,0.2762
CC1(CC1)C2=CCOC2,0.2453
OCC(C=O)C#C,0.2204
NC1=CNC(=O)NC1=N,0.1763
COC=NCCCC=O,0.227
CC1OC(C#C)C1O,0.2737
c1conc1NC=O,0.2314
CC(O)C1(CC1)C#C,0.2921
O=C1NCC2C1C1CN21,0.2512
CC1CC2C1C2N1CC1,0.324
C1CN1C1CC2COC12,0.2952
N=C1CC(=O)NC(=O)N1,0.2319
c1c(n[nH]n1)CNC=O,0.2512
O=C1OC23CC4C2OC134,0.2236
CCC1=CC2CC2C1=O,0.19
CC12C3C4C(C)(N13)C24O,0.2658
OCC1C2CC2N1C=O,0.2574
CC1(COC1=O)C1CO1,0.2745
COC1(OCC=C1)C=O,0.1995
CC(=O)C1OC2CC12O,0.216
C1N2CC=C3CC=CC123,0.217
OC1CC(O)(CC=O)C1,0.2166
C1CN1C12CC1N1CC21,0.276
C1CC1C1C2CC1CC2,0.3498
CCC12N(C)C3C1NC23,0.285
CCC(=O)NCC,0.278
OC1C2C3C(CN23)C1O,0.2805
C1OC11C2CC1OCO2,0.3184
c1n[nH]c2n1c(nn2)N,0.1947
CC#CCOCC#N,0.2578
OC1C2CC(O)C1O2,0.2845
C1C2CCC3OC1C23,0.3139
CC1C2CC(C)(C)C12,0.3303
C1C2CC3CC(O2)C1O3,0.3279
CNC(=O)CC1(C)CN1,0.2726
C1CC23OC4C2OCC134,0.2817
COCC#CC(=O)C#C,0.1914
OC1CNC=C1C=O,0.1781
OC1CC23CC(C2)C13,0.2919
CC1(C)N2C3CC1(O)C23,0.2957
CN(C)C(=N)C(=O)OC,0.2048
N#CC1OCC1C1CN1,0.2526
CC1C(O)C2NC12C,0.3031
CC#CC#CCOC=O,0.2168
CC12CC1OCC21CC1,0.3045
O=CNC1CC11CCO1,0.2468
COCC1OCC11CN1,0.3012
O=C1CCC2C1C1CN21,0.1988
C1NC2CN=COC12,0.2616
OC1COC1C1COC1,0.2909
OCC1C2C3CCC3N12,0.2811
CC(C)C1(C)CC(C)C1,0.3489
N#CC1CCC11CCO1,0.2819
O=C1C2C3C1C(C#N)N23,0.2228
O=C1OC2CCOC12,0.2524
CCN1CC1C#CC=O,0.1827
CC(C#CC#N)C1CN1,0.2116
NC12COC1COC2=O,0.2546
CC1OCC2CC12C#C,0.2879
CNc1conc1NC,0.2248
CC(CO)CC(C)C#C,0.3135
CC1(CC1)C1CC=CC1,0.2655
CCC1=NC(=N)N=NO1,0.2263
COCC1CC1NC=O,0.2677
CC(CO)N1N=NN=N1,0.2552
CC1NC1C(O)CC#N,0.2959
CCC(C)N1C=CC=N1,0.2634
c1c[nH]cc1CO,0.2476
CCN1C(C)C1CC#C,0.2694
CC1CC2N(C)C12C=O,0.2161
CCC1=NC(=N)OC=C1,0.1742
Cc1[nH]c2nnnn2n1,0.2407
C1C2CC3=CNC=C3C12,0.2415
CC1(O)C2(O)CCC12O,0.2707
Cc1ncn(n1)C=O,0.2205
CC(C=O)C1C2CC1C2,0.2252
CC1OC1C1CC2NC12,0.3074
CC1C2CC1C(=O)OC2,0.2755
CC1=NOC(=N)C(=N)N1,0.1983
COC12C3CN=C1NC23,0.1587
CCC1CCCNC1=O,0.2668
CC(=NO)COC1CC1,0.2516
N#CC12C3CNC1CN23,0.2374
CC(C)CC(=O)C,0.2337
c1c(c(on1)C=O)C=O,0.1694
CC1(NCC1C#C)C#N,0.2589
CC1(CC#C)CCC1=O,0.2148
CC1OC2C3NC12C=C3,0.213
COCC(O)(CO)C#C,0.2778
CC12OC3C4CC1C4C23,0.301
CC12C3CC1(O)COC23,0.2876
C1CC23COC2CN13,0.2833
CN=C1OCC2OC12C,0.26
CCC1=CCC(O)C1,0.2598
OCCC1CC2(O)CC12,0.3275
CC1(CO1)C12CC1OC2,0.301
NC(=O)C12CC(N1)C=C2,0.2406
CCC1CC=CC(C)C1,0.2651
CCCC12CC1OC2C,0.3021
N=C1OC2CC2(O1)C#C,0.2573
CC(O)C1C(C#C)N1C,0.2545
NC1=NC(=O)OC(F)=N1,0.2266
CC1CC(C1)C1CN1C,0.301
CC1NC1(C)C#C,0.2753
CC1OCC2C=CCC12,0.2638
OC1C(CC11CC1)C#C,0.2909
O=C1COC2CN3C2C13,0.2058
COC1C2OC(=O)C12O,0.2568
c1nc(c(o1)N)C(=N)N,0.2059
N=C1ON=NC(C=O)=N1,0.1328
CCCC(C)(CC)CC,0.3641
CC(O)C1NC(=N)C1O,0.2589
CC1COC2CC=CC12,0.2587
N=C1CCCC(O1)C=O,0.2111
COC(C#CC)C(N)=O,0.2475
CC12CC(CC1)N2C=O,0.254
OC1CC2CC1C=CC2,0.2546
CCC12OC3CC1C2C3,0.3185
Cc1cc(c[nH]1)CCO,0.2408
c1c2c(no1)OCCC2,0.241
CN=CNC(=O)OC,0.2459
OC1CC(C2CN2)C1O,0.3056
ON=C1CN=CNC1=N,0.1986
CCC1C(C)CC1CO,0.3326
OCC(O)C1=CON=N1,0.2119
O=CNC1C2CCCC12,0.2712
COC(C#C)C1CCC1,0.2866
CCC12CC1(C)CCC2,0.3298
O=CC12CCC1C1CN21,0.2025
CC1=NNC(=N)C(=O)N1,0.1838
COCC#CC(C)O,0.2831
OCC1(O)C(O)C1O,0.2803
OC1CC1C1(CO1)C#N,0.2472
CC1NC(=O)CC1CO,0.273
O=CNCC1(CN1)C=O,0.2159
C(#N)c1nc(no1)N,0.1833
CC1C(C)C11CCC1=O,0.2173
NC(=O)C12CC1CC2=O,0.2235
OC1CC2(CC2)OC1=N,0.2754
OC1CN2N=NC=C2C1,0.255
O=CCC1CC2CC12,0.2265
CC#CC1CCNC1=O,0.2562
CC1OC(=O)CNC1=O,0.2583
CC1=C[C-](OC1=[NH2+])C#N,0.1804
CC1C2OC2C2OC12,0.3168
CC12N=C(N)OC1C2O,0.2654
O=C1CNCC2(CO2)C1,0.2169
OC12COCC11CC2C1,0.3099
CCCC#CC1NC1C,0.2771
OC1CC1C(=O)C1CC1,0.2145
CC12CN1C1C2OC1=O,0.2424
CC1C(=NO)C2CC12O,0.2428
C1CNCC1(C#N)C#N,0.2536
COCC1(C)C2CC1O2,0.3154
C1C2COC12C1COC1,0.3069
C1C=CC2CC3OC3C12,0.2591
CN(CCOC)C(=O)N,0.2912
ON=C1C2C3C1N=CN23,0.2154
CCc1ncc(o1)N,0.2208
COc1c(cc([nH]1)N)N,0.2232
C1C2CC3=NC=CN3C12,0.2459
CCN=COCC=O,0.218
OCC1C2C3C1CC23O,0.316
C1OCC2=C1CC1OC21,0.2305
CN1CC(C#C)C(=O)C1,0.184
CC1(CCO)OCC=C1,0.25
c1nncn1C2COC2,0.2623
NC1=NC=CC=NC1=N,0.1514
CC1OC1C1CC2CC12,0.3306
C1C2C3C4=CCOC13C24,0.1836
C(COc1nnon1)O,0.217
CCN(C)C1CC1C#N,0.2439
CCCN(C=NC)C=O,0.2263
CNC(C=O)(C=O)C#N,0.1785
C1CC=CC(=NO)C1,0.1946
N=CN1C2COC2C1=N,0.2172
CC(C#N)C12CCC1O2,0.2959
OCC1CC2C(C=O)C12,0.2118
CCC#Cc1cc[nH]n1,0.2217
CC1CN2C=C(O)C=C12,0.2267
CC1=CC(C#C)C2CC12,0.2456
C#CC1NC11CC2OC12,0.2764
CC1OC(C#N)C(=N)O1,0.2774
CC(CO)C1(CO)CC1,0.3177
CC1C(=O)N(C)C1(C)C,0.2768
CC1=C(N)N=COC1=N,0.1681
CC1COC1(CO)C#C,0.2704
CC1CC(CCC#C)O1,0.3064
CC1OC2CC12C(C)=O,0.2238
CC12OC3CC4C1C2C34,0.3054
CC1C(C)N1C(N)=O,0.2832
CNC(=O)CCNC=O,0.2724
CC(=O)C1C2C=CCN12,0.199
CN1C(=O)OCC12CC2,0.2883
CC1CC1(O)CC=O,0.2189
CCC1=NCC=CCO1,0.2487
Cn1ccc(nc1=O)N,0.1966
COc1c(nc(o1)O)N,0.2228
ON=C1C2OC3C2OC13,0.2289
CC(=O)CC1OCCO1,0.2307
CC12CC(C1)N2C=O,0.248
CC1COC(=N)C2OC12,0.2644
CC12NC1C1CC(O)C21,0.2903
CC1C2OCOC12C=O,0.2242
OCC1(CC(=N)O1)C=O,0.2056
CC1CC2C3CC(O1)C23,0.3187
C1CCCC(CCC1)O,0.3349
OC1(CC1)C1(CN1)C#N,0.2787
C1C2C3C=CCCC1C23,0.2509
Cc1c([nH]ncc1=O)C,0.1886
CC1CC(C)(O)C1C=O,0.2227
CC1CC2C3N2CC3=C1,0.2139
CCNc1cn(nn1)C,0.2078
COC1CCC1(N)C#N,0.2883
O=C1C2NC2C1C#C,0.2092
O=CC1OC2C3CC3C12,0.2174
CN1CC(=O)C12COC2,0.1991
CC(=O)CC1NC1C#C,0.232
C1CC1(C=O)C(=O)C=O,0.1634
CC1OC1(C)CCC#N,0.3108
CC(C#C)C1CCO1,0.2971
CC12CC(O)(C1)CC2=O,0.2291
CC(CC#C)CC1CC1,0.312
c1c(n[nH]c1O)CC#N,0.2507
N=COC1C2C=CC1O2,0.2386
OCC12CC(C1)CO2,0.3272
OC12CC1C(C2)C#C,0.3013
OC1COC(=N)NC1=N,0.2411
N=C1OC2C3C2C(=O)N13,0.2398
CCn1c(cnn1)NC,0.2279
CC1C(O)CC(=O)C1C,0.2202
CC1CCC2CC(O)C12,0.3047
CC1=CC2NC2COC1,0.2446
O=C1C2CC3COC1C23,0.1961
CC1NC1C1OC1C=O,0.2118
C1C2OC1C1CC2CO1,0.3051
CCC1(C)C2CC1(O)C2,0.3332
OC12CN3C1CC23C#N,0.2681
[NH3+]C1(CC2OC12)C([O-])=O,0.2671
c1c(cn2c1NCC2)N,0.2198
CC1OC2CNC12CO,0.2857
c1c(nno1)CCC#N,0.2339
FC1=CC(=N)N=NN1,0.1673
c1c(c(c(nn1)N)F)O,0.2018
CC1CC1(CO)NC=O,0.261
O=C1NCCC11CCO1,0.2442
C#CC1CC2=NC=NN12,0.2624
CC1C2OC(=O)CC12C,0.2763
CCC1(O)CCC1OC,0.3131
C1CC2COC1CC=C2,0.2609
CC1C2CC1(C)C21CC1,0.3509
CC12C3CC(=CC1=O)C23,0.1607
C#CCOCCC=O,0.228
CC#Cc1c(nco1)O,0.186
CC(=O)C#CCCOC,0.2086
CC(O)COC1COC1,0.316
OCC(=O)C1CCCO1,0.2206
C1CC1NCC(F)(F)F,0.2998
O=C1C2CNC11COC21,0.2139
CCC(O)C(C)(C)C#N,0.3252
CC12CC3CN1C23C=O,0.2078
CC1CC(C)(C#C)C1=O,0.2091
Cn1cc(nc1N)C#N,0.2105
CN=C1OCCNC=C1,0.1903
N#CC1OC2CC12,0.2617
CC1=CC(=O)OC1=N,0.1972
CC(C)C#CC(C)C#N,0.2849
COCC1CC(C)(C)O1,0.3216
Cc1nc([nH]n1)CC#C,0.2665
C1CC12CC=CC(=O)C2,0.1858
CC12NC3C1OCOC23,0.3218
CC1C2NC1C2C#N,0.2762
O=CC1NC2C1OC2=O,0.2094
CC1C2CCN=COC12,0.2594
CCOC(C#N)C1CO1,0.2953
OC1(CC#N)CC1C#N,0.295
O=CNC12CC1C1NC21,0.2363
NC1=[NH+][CH-]C(=O)C(=N)N1,0.1438
C1OC2C3OC4C3OC124,0.2747
CN=C1NC(=O)OC=N1,0.2046
CC1CC2CC2OC=N1,0.2587
c1c(n(nn1)C=O)C=O,0.1809
CC1=CC2OCOC2C1,0.2624
OCC(O)C(=O)C1CO1,0.209
OCCCOCC1CN1,0.3193
COC1C2CC(C2)C1O,0.327
CC(=O)C#CCC#N,0.2067
OC12COC1CCC2,0.3012
CC(C)(C)C1NC1C#N,0.2896
c1cn2c(n1)CCCC2,0.2451
O=C[C-]1[NH2+]CC=CC1=O,0.1514
C#CCCCNCC#N,0.2709
COC1(C=O)C2CCC12,0.2179
CCC12CC1OC(=O)N2,0.2978
CCC1C2CC2CC1C,0.3337
CC12CC3CC3CC1O2,0.3236
OC12CC1CCC1OC21,0.327
N#CC1OCCC11CC1,0.2972
ON=C1CC=C2COC12,0.237
CC(C)(C(C=O)C=O)O,0.2069
CCCOC1CC1C=O,0.2243
CC1=CCCNC(=O)N1,0.2295
CCN=COCCCO,0.2741
CC1OC1(C#C)C(C)=O,0.2212
CN1C2C3OC(=N)C2C13,0.2406
CCOC1OC=NC1C,0.2766
C(COC(CO)CO)O,0.3242
CC1C(O)C1(O)C1CO1,0.2757
CC1(C)C2C3C=CC2N13,0.207
CNC(C)(CC=O)C#N,0.213
COCc1noc(=O)o1,0.2683
O=CN1CC1CC#C,0.2515
c1ncn(n1)CC#N,0.265
CC(C)(CC=O)CO,0.2256
OC12C3C1N1C3C21C#N,0.2307
CC(O)CC(=O)OC=N,0.249
C#CC12C3CN=C1OC23,0.1571
NC(CO)(CC#N)C#C,0.2802
O=C(C1CO1)C1CCC1,0.2136
CC#CC(=O)CC(C)C,0.2081
CC12NC1CCC21CO1,0.3079
C1OCC1C1COC=N1,0.2607
CCC1OC(CC)C=C1,0.2471
CC1=COC(=N)C(C)=C1,0.167
CC1CC2(CN2)C(C)O1,0.3162
COc1cc(ncn1)O,0.2313
COCC1C2OC(=N)C12,0.2752
COCC(O)C1(C)CN1,0.2989
OCCC1CC(=O)C=C1,0.1913
CC1(CC1(O)C=O)C#N,0.2146
CC(=O)CNC(=N)C=O,0.1723
CC1C2C3C1C(O)C23O,0.3159
C1OC1C1C2C3CN1C23,0.3058
NC(=O)C1=CN2CC2C1,0.202
C1CN1C1C=CC2OC12,0.2192
CC1CNC(=O)C=C1C,0.2088
CC1(CC1)COC(=O)N,0.3213
O=CCN1CCC1C#N,0.2154
OC1C2C3OC(=O)C2C13,0.2704
OC1C=CC2COC1C2,0.2449
CC(O)C1=CC(O)=NO1,0.2456
OCC1CCN1CC#N,0.2643
C1CC(O1)C1=CC=CO1,0.226
CC(O)C(C)C(=O)C#N,0.2
C1C2OCC3CC(C3)C12,0.3238
c1(nc(nc(n1)F)F)O,0.2624
CC1CC2(CN2)CO1,0.3164
c1nc(n(n1)CC=O)N,0.173
CC1C=C(C)C2(C)CC12,0.2454
O=CNC(CC#C)C#C,0.2719
CCC1C2C3CC=C1C23,0.1798
CCC1COCC(C)O1,0.3215
CC(=O)C#CC(O)CO,0.2074
CCC1(CC1)C(C)OC,0.3279
CCC(=O)C1CC2OC12,0.2204
CC1OC1CC#CCO,0.2836
NC(=N)C1OC2CC2O1,0.2646
CC1C(C)C2C=CCC12,0.2568
Cn1ccc(=O)c(c1)F,0.1948
CCC12CCC(C)C1O2,0.3387
O=CC12CC3CC(C1)C23,0.2172
N=COC1CCC11CN1,0.2667
OC1(CC2CCO2)CC1,0.294
CC1C2OC2(C=O)C1=O,0.1923
CN1C2C1C(C=O)C2O,0.1929
C#CC1(CC1C#N)C#N,0.2548
COC1OC(=O)CC1C,0.2772
C1C=CC23OC12C1NC31,0.2371
COC1C2C(C)OC12C,0.3061
N=C1CC2=C(N1)OC=C2,0.2028
ON=C1C(O)CC1O,0.2368
CC1C(C#N)N2CC12C,0.2632
OC1C=CC2CC1(O)C2,0.2457
N=C1OC2CC(C#N)C12,0.2783
O=C1CCCC2CN12,0.2479
CC1OC1C(=O)CCO,0.2218
CC(CO)(C#N)C1CN1,0.2878
CCN=C1C(O)CN1C,0.2474
C1CC1C1(CC1)C1CO1,0.3449
OC1C2C3C4CN2C1C34,0.3102
CC1CN1C12CC1OC2,0.2934
N#CC1NCC2COC12,0.2713
CCC12OCC1C1NC21,0.2957
CC1CC1C1(CN1)C#C,0.2832
OC1C2OC3(CC3)C12O,0.2858
c1cc(oc1)COC=O,0.2279
OC12CC1C=CC1CC21,0.2375
CC1COC2CC12C,0.3042
CC1CCC2(NC12)C=O,0.2268
O=C1OC2OC1C1CC21,0.266
CCCC(C)(C)C,0.3758
COC1C2N=COC12C,0.2527
CCC(NC=O)C#C,0.2733
CC1(C(=NO)CN1)C,0.2344
O=CC1CC2=NC=NN12,0.2053
c1c[nH]c(c1C2CC2)O,0.233
CC#CC1(C)CN=CO1,0.2698
OC1CCOC1OC=N,0.2549
CC12CC3(O)CC1C23O,0.2928
N=COC(C#C)C1CO1,0.283
CC1C2C1N1C2C1(C)C,0.2736
OC12CC1C1C3OC1C23,0.3004
CC1OC(=N)C(O)C1O,0.2719
C#CC1C2OC1C1NC21,0.2839
O=CCC1CCOC=N1,0.2208
CC1CCC=C1CC#C,0.255
c1c-2nc[nH]nc2cn1,0.1242
OCC1C2C3C(O)C2N13,0.3088
COCC1=NCCCO1,0.2711
CCCCCCC(C)O,0.3349
Cc1cc[nH]c1C#C,0.2012
N#CCC12CC(C1)C2,0.3397
CC1OCOC1(C)C=O,0.2142
CC1(C)COC1C#C,0.2705
c1nc(c(o1)C=O)O,0.1886
CC1C2CCCC(=O)N12,0.2476
OCC1(NC1C#C)C#N,0.2585
CCCC1CC(C1)C#C,0.3042
CNC(=NC)C(=O)C#C,0.1575
Cc1ccn(n1)CC#N,0.2519
CC(=O)CN=C(N)OC,0.2016
CC1CCC2(C)CC12O,0.3188
O=C(C#N)C1CC2NC12,0.1685
CC1(CC2NC12)C(N)=O,0.2604
CC12C3CC1(CO)OC23,0.294
CNc1cnc(=O)on1,0.1492
CC(C#C)(C#C)OC,0.2785
CCCC1C(C)OC1C,0.3161
c1c([nH]nc1N)C2CC2,0.2275
O=C1C2OCC1N1CC21,0.1934
C1CC2C3C4C2C(=N1)N34,0.209
Cn1cncc1CC=O,0.1885
COC(=O)CC#CC=O,0.2046
CC1(O)CNCC(=O)C1,0.201
OCC12CC1C(O)C2,0.3199
COCCCCC(=O)N,0.279
CC1OC(=N)OCC=C1,0.2527
CC1=C(NCCC1=O)C,0.1801
CC(CO)C#CC1CO1,0.2733
CC1=CCCC1(C)C#C,0.2575
OCC1C2OC1C2C=O,0.2047
CC1CCC(=O)C2OC12,0.2133
O=C1C2CCC(=O)C1O2,0.1884
CC1(N)C2CC1(N2)C#N,0.2656
CCC(=O)OC(=N)C=O,0.1823
CCC12C(C)C1C1OC21,0.2822
CCCOc1[nH]ccn1,0.252
N=C1CCC2(CO2)CO1,0.2835
CC12CC(O)C1(O2)C#N,0.2643
CCC#CCC1(C)CN1,0.2903
CC1C2CC3C2OC13C,0.3162
CC1COC(=O)C1CO,0.2657
OC12CC1CC(=O)NC2,0.2644
CC12CC(O)C1(O2)C=O,0.2164
C1CC1C1OCC2CC12,0.335
CCC1(C#N)C2CCC12,0.3116
Cc1cn2c(n1)C=CC2,0.1757
C1C=CC2NC2C=C1,0.2303
CC12CC3(O)CC1N2C3,0.2918
CC(=N)OC(=O)NC=O,0.2262
CCC(C#C)C(N)=O,0.2725
C1C2OC=NCC=CC12,0.2341
CCN1CC1C(O)CO,0.2898
CC12C3CC4C1N4C23,0.3002
CCC(C)(CO)OC=N,0.2834
CC1CC2C3NC3C2=C1,0.2355
CC1CC1CC1CO1,0.3513
Cc1ccn2c1CC2,0.2502
c1nc([nH]n1)NCCO,0.2503
CCC1OC(=O)C1NC,0.2352
CC1C2CN(C=O)C12,0.2581
COCC(OC)C(C)O,0.3159
CC1CCOC(=O)N1C,0.2923
C#CC#CC12CC1CC2,0.2062
OC12CC1NC(=O)C=C2,0.2022
C1CC1(CO)OC=O,0.2747
CC1C2OC2(C#C)C1=O,0.2081
OC1C[NH2+]C1C([O-])=O,0.2606
C1CC11CCC11CCO1,0.3088
CC1NC2COC12C#N,0.243
CC1OCCC11CCO1,0.3199
CN1CC1CC#CC=O,0.1769
O=C1OC2C3OC1OC23,0.2426
CC1COC(=O)C1C#N,0.2664
CNc1cnoc1C#C,0.17
CC1CCCC1(C)C,0.3616
CC1=C2NCC2OC1=N,0.1963
COC(=O)C(CN)C#N,0.2449
NC12C3NC3C1C2C#N,0.2559
CC1CC2CC12N1CC1,0.3074
Cc1c(cc(o1)C=O)N,0.1576
O=C1CCC11CC=CC1,0.218
NC1CC2CC1(N2)C#N,0.2522
CCC1CC1(C)O,0.3244
C#CC1(COC1)CO,0.2848
N#CC12OCC3OC1C23,0.2444
CCC(CO)C(O)C=O,0.2343
OC1C2C[NH2+]C12C([O-])=O,0.2505
CCC1OCC1=NO,0.245
Cc1cn(c(c1C)C)C,0.2402
O=C1CC2(O1)C1CC2O1,0.2605
NC(=N)C(=O)C(O)C#N,0.1669
CCC1(C)C2OC(=N)C12,0.2727
CN1CC(C)(C=O)C1=O,0.212
CC1=CCC23CC12OC3,0.2339
CC(O)CC(=O)NC=N,0.237
CC(=O)C1(C)OCC=C1,0.2036
COC1C2CCC12C,0.3251
c1c2c([nH]nn2)n[nH]1,0.2003
CCCC(=O)CC(C)C,0.2334
C1CC(=C(C1)N)C=O,0.1824
CC(C)C(=O)C#N,0.208
CC12CC1C1CC(=O)N21,0.2323
CC12C(C=O)N1CC2=O,0.1884
CN=CNC(C#C)C#N,0.2462
CC12C=CC3NC1C23O,0.2228
CCC1=NCC(O1)C=O,0.2158
CC12NC1C(=O)C2(C)C,0.215
C1CC1C(C=O)C2CC2,0.2229
c1cnc-2nc[nH]nc12,0.1496
CC12C3CN1C1(CC1)C23,0.3103
C#Cc1cc(c(o1)O)N,0.1707
COCC(N)C(F)(F)F,0.3264
COC(CCO)C#CC,0.2887
CCN(C)CCC#N,0.2652
N#CC12CN3C4C(C14)C23,0.2541
CC1N2CC(C)C12C#N,0.2502
CCCN(CC)CC#N,0.2523
O=CNC1CCC1=O,0.2188
OC1C(O)C1COC=N,0.2736
CCC12CC1CN=CO2,0.2712
OC1CCOC2CC1C2,0.3159
CC1(O)CCOCOC1,0.3251
CCOCC1COCO1,0.336
NC12C3C4N3C1C24C#N,0.2365
CCC(C)CCN1CC1,0.3133
Cn1ncc(n1)N2CC2,0.2211
c1c(c(n[nH]1)O)C#N,0.2279
CC12C3CC4C(N13)C24O,0.2876
O=CCCC1OC2CC12,0.2253
OC1CC2(CN2)C1C#C,0.2838
CC1C(O)C(O)C11CC1,0.2996
CC1OCC(C)=C1C=O,0.1824
c1cncnc(c1=O)O,0.173
O=COCC1OCC1=O,0.2224
CC1(C)C2CC11CCN21,0.2822
CC1=CCOC1CC=O,0.2173
CC1C2C3C4C2C1N34,0.3017
C(C#N)N(C=O)C=O,0.2265
O=CN1C2CC3(CC3)C12,0.2441
CC12CC3OC1C23O,0.29
O=C1CC(CC2CO2)N1,0.2826
Cc1cccnc1C,0.2292
O=C1CC2C3CN=C1N23,0.1998
CCCC(O)(CO)C=O,0.2242
CC1(C)CC2(OC12)C#C,0.2628
CC1C2C3N(C2=O)C13C,0.2503
CC1C2(O)C3OC3C12O,0.2736
O=COCC1CC2CC12,0.2763
CCC1OC2CC(=O)C12,0.217
C1CN2C(=N1)COC2=O,0.2407
CCC1=NNC=NC1=N,0.1916
CCN1C2C3OC2(C)C13,0.2915
OC1CC2(CCC2O)C1,0.2964
CC1CCCOC(C)=N1,0.2544
CC12CC(C1)C2OC=O,0.2857
CC12OCC1CN1CC21,0.2945
OCC1CCCC(=O)C1,0.2238
OC1(COC(=O)C1)C#N,0.2763
O=C[C-]1C2C[NH2+]C2C1=O,0.1612
C1NC11CC2CCC2=C1,0.2247
CC12OC=NC1CC=C2,0.252
CCC1=CC(C)C2OC12,0.2414
CC1CCC1(O)C1CO1,0.3297
COCc1c(nc[nH]1)O,0.224
CC12OC3C(O1)C3C2O,0.3152
CC1=CC2CC3C2OC13,0.2406
C1C(CC1=O)OC(=O)N,0.2211
CN(C)C(CCO)C#N,0.2669
CC1CCOC1C1CN1,0.3085
C(COC(=O)NC=O)O,0.2454
CC1(CCCO1)C1CC1,0.3245
CC(O)C1=C(N)NC=N1,0.2289
OC1C2CC=CC12,0.2346
CC(C)OCC(=O)NC,0.2802
CC(=O)C1(C)C2CCC12,0.2198
CCn1cnnc1,0.2664
CC1C2NC2C(=O)N1C,0.2521
O=C1C2CC3OC2C13,0.2183
c1c(c(no1)N)CO,0.2414
CCCc1ncc(o1)C,0.2363
C#CC#CC1(CC1)C#C,0.2116
NC(=O)C1NC2CC12O,0.2466
N=C1NC23CCC12OC3,0.259
CC1C2CC3C2C1C3=O,0.2188
[O-]C(=O)C12CC3C1[NH2+]C23,0.2601
CC1(O)C(C#N)C1(C)O,0.2829
CC12CCC1C2C=O,0.217
O=CCCC1CC2CC12,0.2275
CCC1(CC1)C2CCC2,0.34
OCC12CC3(CO3)C1N2,0.3262
C12OC34CC(C3)C4(C1)C2,0.332
OC1CNCC(=O)NC1,0.2386
CC1(C)OC2CCC1C2,0.3131
C#CC1CC2C3OC2C13,0.2776
N=C1OCC=CCC1=O,0.1904
CC1(O)CC1CN1CC1,0.3062
CC1CC(=O)C(CO)=C1,0.1986
CC1(O)CC(O)C1(C)O,0.2942
O=C1COC(CC#N)O1,0.2771
CCC(=O)OC(C)C=O,0.2291
CC1(CN2CC1C2)C#N,0.2779
CC12CC(N1)(C#N)C2=O,0.2452
CC12C3OC(OC13)C2O,0.3208
COC12CCC1CCC2,0.3216
CC(O)CC1COC1,0.2961
N=C1NN=CC(=N1)C#N,0.1313
OCC1OC(=N)C11CC1,0.278
OCC1CC2(CC2O)C1,0.3036
COCCOC1COC1,0.3127
CCOC1C2CN2C1=O,0.2162
N#CC1CC2(CO2)CO1,0.2938
COCC1(CO1)C1CN1,0.3156
CCn1cc(nn1)C#N,0.2429
CC1C(O)C1C(F)(F)F,0.3412
C1CC(C1)C1COC=N1,0.2684
Cc1c(con1)COC,0.2492
COCCC1(C)CO1,0.3409
C1CC2(CC2)C(=O)NC1,0.2718
COC1CC(O)C1O,0.3029
N=C1CC2(O1)C1COC21,0.2605
OC12CC3C(OC1)C23,0.2952
CCC1CC=CC1CO,0.2628
C1CC1C1C2COC12,0.3097
N=C1OCC1NCC=O,0.224
N=C1C=CNC(=N1)C#C,0.16
CC1CCC(O)C1,0.3204
CC1C2C3CCC1C23,0.3358
COC1=NC(CN1)C#N,0.2642
CC#CC12NC1CC2O,0.2559
CCn1c(=O)[nH]c(n1)N,0.2408
Cc1ccc(c(n1)N)F,0.1966
CNC1=COC(=N)C=C1,0.1488
COCC1(O)CC(C)C1,0.3262
O=CCC1CC2COC12,0.2247
CC1CC1C1(CC1)C=O,0.2238
C1OC23CC4CC12CC34,0.3096
CCC12CC(C1)(O2)C#N,0.2575
CC1C2C3C1C(C#N)N23,0.2666
CC1CC=CCC1(C)C,0.2683
CC1CC(C)(C)C1C=O,0.2201
CCC(C#C)C(=O)OC,0.2637
CCC12OCC1(O)C2O,0.2648
C#CCC1CC2COC12,0.3008
OC1C2(O)C3NC3C12O,0.2762
COCC1COCOC1,0.3363
CC1(CO)C2C3C1CN23,0.2988
N=C1CCC2CC2O1,0.281
CC1=CC(C)(C)C2CC12,0.2475
N#CC1CCC2(CC2)O1,0.2702
CNC1(C)CC1(O)C#N,0.2403
COC1CC1(C)C=O,0.2219
CC1C2NC(C=O)C12O,0.2002
CN1C2C(CC12C)C=O,0.2196
CC(COC(N)=O)C#N,0.3112
C1CC2C3C4CC2C1C34,0.3476
CC(=O)n1nc(nn1)N,0.1794
OC12C=CCC1CC2=O,0.2079
O=CCCC1COCO1,0.2293
N#CCC12CCCC1O2,0.3044
COC(C#C)C#CC#N,0.2315
COC(=O)COC=N,0.2583
CC1=CC2OCC2C1,0.2513
CC(O)C1(O)COC1C,0.2933
CC1CN=C(O1)C(N)=O,0.2208
CC12COC3C1NC23,0.3145
CC12NC1CC21CC1O,0.2923
CC12C3C1N1C3C21C#N,0.2314
CC1OC2CN(C2)C1C,0.2857
CC1CC2=NOC=C2N1,0.2049
OC1CC23CC12N=CO3,0.2331
OC1C2CC2CC11CC1,0.3346
CC1(CO)C2C3CC1N23,0.3089
Cc1ccccc1C#N,0.21
c1c(n[nH]n1)C2CCC2,0.2535
CC12NC1C1(CC21)C#N,0.2447
CC12CC(N=CN1)C2=O,0.1961
CN1C2CCC2(C)C1=O,0.2695
O=CC1=CC2CC1C2=O,0.1879
Cc1cc(n(c1C)C)O,0.235
CC(CC=O)CC=O,0.2137
CC1(C)C2C=CCC12O,0.238
O=C1C2CC(O2)C11CN1,0.2024
O=CC1CCO1,0.2129
CC1CCC1(O)C1CC1,0.3174
CC12CCC(N1)C2=NO,0.2613
O=CC1C2CNC(=O)N12,0.1978
CCC#CC1(CN1)C=O,0.215
CC12CN3CC(O)(C1)C23,0.2751
CCC(CC)C#CC,0.3014
OC1COC2CCCC12,0.3058
COC(C#N)C1(C)CO1,0.2924
CC1CC2CC(O1)C2=O,0.2125
NC1=COC(=N)OC1=O,0.1704
CC1(C)C2CC(=O)C1O2,0.213
NC1=NOC=C1C1CN1,0.2339
C1C2OC3=CC=CN3C12,0.235
NC1=CNC(=N1)C1CO1,0.206
CNC1COC1=O,0.2443
CC1OC23CC(C12)C3=O,0.2437
CC1(O)CCC2CC12O,0.2911
CC(CO)N1CC1C#C,0.2668
CC1N=CN2CCN=C12,0.211
CN1CCC2(CN2)C1=O,0.2559
C#CCC1C2C3CC3N12,0.2666
CCC1OC1(C#C)C#C,0.2555
CCCC(=O)C1COC1,0.2303
CC12NC1CC2(O)CO,0.2806
CN1C2CC1C(C2)C#N,0.2619
CC12CC3(O)C1CC23C,0.3269
N=C1NCCCCC1=O,0.1903
CCC12CC(C1)N=CO2,0.2655
CC1C2C=CC(C)C12C,0.2421
C1C2OC1C1=CCOC21,0.2367
CC1CC(C#N)C(C)O1,0.296
C#Cc1cc(c([nH]1)O)N,0.1882
CC#CC1OC2CC12C,0.256
N#CC12CN3C(CC1)C23,0.269
CC(C=O)C(C=O)C#N,0.2047
CC1CC(N)(C#N)C1C,0.2916
OC1(C#C)C2CC1CC2,0.2863
OC1CC2CC11COC21,0.3015
COC12C=CC3OC1C23,0.2129
OCC(OC=N)C#C,0.2816
CN1C(=N)CCC1=O,0.2506
C1C2CCCC3CC2C13,0.3352
Cc1cc(nc(c1)O)O,0.208
CCc1cnc([nH]1)O,0.2461
OC(C#N)C1(CC1)C=O,0.2307
CNCC1(CN1)C#N,0.2636
CCC1NC(=O)C=C1,0.215
CC1CC(O)C1(O)C#N,0.2811
O=CC1OC1C1CO1,0.2171
CC1(CC#C)CN=CO1,0.271
CN=C1OCCC1C#C,0.2631
COC12CC3C(CC1)C23,0.3274
C1C2CC3CC2C13,0.3728
C1C(CO1)CCNC=O,0.2765
CC(CC(C)(C)C)C=O,0.2274
CNCc1ncc(o1)N,0.2172
CC1(CC1)C1(CN1)C#C,0.2863
CC1(C)C=CCN2CC12,0.2423
NC(=O)C(O)C(F)(F)F,0.2851
CC12OC(C1CO)C2=O,0.2438
Cc1c(n(nn1)C)C,0.2424
OCC1COCCO1,0.3212
CCN1CCNC1=O,0.2945
C#CC1C2COCC1O2,0.2729
C1NC1C12NC1C1CC21,0.2671
OC12CC1C1C2OC1=N,0.2746
Cc1c(c[nH]n1)CC=O,0.2117
NC(C#N)C#CC1CN1,0.2471
CC12CC1CC2(O)C#C,0.2825
CC1C2CCCN2C1=O,0.2516
CC1C(C)C2C1CC2=O,0.2166
O=CC1C2C3OC1OC23,0.2226
CC1CC1C#CC1CC1,0.2756
CC1CC23COCC12N3,0.3081
CC#CCC1(CC1)CO,0.3004
OC1C=C2CC3CC1C23,0.2197
C1C2CC34CC3(CO4)N12,0.2656
O=C1C=C2CN3C2C13,0.1555
Cc1c(c(ccn1)F)N,0.2071
CNC(=O)C(C)C1CN1,0.2665
OC1C2CC(C#N)C12,0.2974
O=CNCC1CCCO1,0.2808
CC(C#N)C(C)(C)C,0.346
CN1CC2(N)CC12C#N,0.234
C(=O)NC(=O)C#CC#N,0.1742
NC(=O)CC1(CN1)C#C,0.2613
Cn1c2c(cn1)OCC2,0.2187
CC1C2OC1C2C1CC1,0.3143
c1cc2c(nc1)OCO2,0.1975
CCC(C)N1CC1,0.3188
CC12OCC=C1C1OC21,0.2254
CCC12C3C(CN13)C2=O,0.2268
CN1CCN=C1C(N)=O,0.1839
C1COCC=CCC#C1,0.2293
CCC(O)C(O)C1CN1,0.3047
C1C2C3OC4CC3N2C14,0.2954
c1c(c(c(nn1)N)N)F,0.2015
OC1CCC(=O)C1=O,0.1435
CC(C)C(=O)OC(C)C,0.2812
CCC#CC(C)N1CC1,0.2792
CC1C2COCC1C2=O,0.2249
O=C1CCCCC11CN1,0.226
c1nc2c(o1)NC=NC2,0.1973
OC12CC(C=C1)C1CC21,0.2529
OCC1CC(=O)NC1=N,0.2382
COC12C3C4C3C1(O)C24,0.2836
CC1(C)COCC(O)C1,0.3121
CC1CCN2CC12C=O,0.217
O=C1C=CNCC1C#C,0.1899
CC(O)C(C)C(C)CO,0.3256
N=C1CC(CCO1)C#N,0.2719
OC1CC(C=O)C2OC12,0.2201
NC(=O)C1=CCOC1=N,0.1946
CC1C2COC12C#C,0.2455
N=C1C2CC2CN1C=O,0.2281
c1cn2c(nc1=O)CC2,0.2
C1CC11C2C3CC2N13,0.3256
OC1C2OC(C3CN3)C12,0.3059
OC1C2CCC3C2C13O,0.3154
CCC(=O)C1CC(C)C1,0.2296
CC1OCC1(C)NC=O,0.2732
CCCC1CCC2CC12,0.3446
CC1=CCCC11CCO1,0.2534
CCC1CCC(CC)C1,0.375
O=C1NCCCC1C#C,0.2638
Cc1c(c(oc1O)O)N,0.2214
CC1CCC2=NOC=C12,0.2418
O=C1NC2(CC2)C1C#C,0.2681
C1CC1(C=O)C=O,0.2156
COC1CCC11CO1,0.3206
C1C2C3OCC(CN12)O3,0.3045
CC1(O)CN2C=NC=C12,0.2522
O=C1C2CC1(OC2)C#C,0.2011
CC#Cc1c[nH]nn1,0.2222
CC#Cc1conc1O,0.2113
OC1(CCC=CC1)C=O,0.2071
CC12C3OC1C(C#C)C23,0.2785
Cn1c(cc(=O)nn1)O,0.1735
CC1C(O)C2(C)CCC12,0.3057
CC1=NNC(=N)N=C1F,0.1553
CCC1COCCC1=O,0.2235
O=CC1(CN=CN1)C=O,0.1885
OCC12CC(C1)C1NC21,0.3013
CC1OCC1(N)CC#N,0.2758
CC1OCC(=C1)C(C)=O,0.1879
CNC(=O)C1CC1C=O,0.2187
c1cn(cn1)C2CCC2,0.2502
CC1C2C(O)CN12,0.2879
O=C1NC2CC(N1)C=C2,0.2337
CC1C(CCC=O)N1C,0.1977
c1c(c(c(o1)O)N)CO,0.2177
C1C2C=CC3CC12CO3,0.2375
N=COC1CC2(CN2)C1,0.2707
COC(C)C1NC1C#N,0.2761
CC#CCCC#CC#N,0.2215
O=C1CC(CC#N)CN1,0.2715
COC1CC2CC2O1,0.329
CN=COC1CC1C,0.2704
CC1CC1C(=O)CCO,0.2308
C1CC(C1)CC(=O)N,0.278
NC(=O)C1OCC1=O,0.2031
OCC1C2C1C1CC2O1,0.3228
C1CN1C12CC1OC2,0.2919
CC(=O)OC(C)(C)C#C,0.2774
CC1CC(C)(O1)C=O,0.2127
CC1(CO1)C#CC1CC1,0.266
NC1=C(NN=C1)C1CN1,0.2186
COC(CO)C1CCC1,0.3173
CCc1c[nH]nc1,0.259
OC1CC2CC(=O)C2C1,0.2197
CCC#Cc1ccon1,0.2182
CCOCC(C)C#N,0.3079
CC12NC1C(O)C21CO1,0.2996
CC12CC(O)(C1)CCO2,0.3141
COCC1N=CNC1=O,0.2245
Cc1c2cnoc2on1,0.2304
CC1OC11CC(C)C1=O,0.1997
NC1=C(OC=N)C=NO1,0.2183
CCC12OC(C=C1)C2C,0.2324
CCC1=NNN=NC1=N,0.1792
COC(CCCO)C#C,0.2997
CCC12CC3C(O1)C3O2,0.3211
CCOc1cc(n[nH]1)C,0.256
CCC(C=O)C(=O)CO,0.2035
CC#CC12CC(C1)C2=O,0.2399
O=C1CN2C3CC(=C1)C23,0.1608
OC1C=CC(=O)C1C#C,0.1803
OC12C3CC1C(=N)OC23,0.261
CC(=NO)C12CCC1N2,0.2361
CC1C(C)C2(C)CCC12,0.3288
N#CC1CC2OCC1O2,0.2945
OCC1(O)CC2(CN2)C1,0.2988
OCC1(CO)CC1C=O,0.2266
C1C=CC=C(CO1)CO,0.1886
O=CC12CC(C#N)C1O2,0.2191
CNc1cc(nn1C)O,0.2378
OC1(CC2CC1C2)C#N,0.3065
N=C1OCCCO1,0.2889
CCC(C)C(F)(F)F,0.4177
CC(CO)C1(C)CC1C,0.3341
CCC12CC(C1)C2C#N,0.3225
O=CNC12CC1NC2=O,0.2382
CC1CC1C(=O)CC#C,0.2217
OCC12COC3C1NC23,0.3043
c1coc(c1CC#N)N,0.2196
CC#CC12CC(C1)CC2,0.2912
CN1C2CC1C2OC=N,0.232
CC#CCC(C)C#CC,0.2877
CCOC(C)COC=O,0.2808
CC1C(CO)CN1C=O,0.2639
CCC(C)CC1(C)CC1,0.3405
CCC1OCOC1=NC,0.276
N=C1OC(=O)OC=N1,0.2281
CNC(=O)C1CC1OC,0.2675
CC1C(O)C1(C=O)C=O,0.2132
CC1C2CCC1C1CC21,0.3446
CC1=CCOC1C1CO1,0.252
CCC12CC(O1)C2=NO,0.2555
CC1=CCc2c1cco2,0.1963
CC12CC(C)(C1)C2C=O,0.2176
C1CC11COC2CC1C2,0.3232
OC1C2C=CC3CN3C12,0.2219
CCc1c(c([nH]n1)O)C,0.2511
CCC(OC)C1CN1,0.3151
CC12COCC1(C)C2O,0.3043
CC1OC11CC(C1)C=O,0.2263
CC1C(O)C2(O)CN1C2,0.276
CC1OC(OC1=O)C=O,0.2106
C#CCCCC#C,0.297
CC1(OC1C#C)C=O,0.213
CC1=CCC(=O)C1C=O,0.2005
CC(O)C1CCC2NC12,0.3024
N=COC1C2CCCC12,0.2717
CC1CC2NC1(C)C2=O,0.2361
C#CC1C2C3CC1CC23,0.3055
C(C(=O)C(=N)NC=O)O,0.1831
Cn1cc(c(c1)N)C#C,0.2019
CC1OC1C1CC(=O)C1,0.2232
OC1CC=CCC(=O)C1,0.218
O=C1COC2OC1C=C2,0.1976
CC(CC#C)(C=O)C#C,0.2214
CC1CC1(C=O)C#C,0.2191
CN=c1c(=O)[nH]nn[nH]1,0.1989
CC1NC(C2CN2)C1=O,0.2009
NC1=[NH+]C=C(N1)C([O-])=O,0.1749
CC(C1CO1)C1(C)CC1,0.3425
COC1(C)C2OCC12C,0.2941
CC(C=O)N(C)C=O,0.2061
CCC1C2OC2C1(C)C,0.3314
C1OC2OCCCC2=C1,0.2537
CC(=O)NC(CO)C#N,0.2718
CC(C)(CO)C(=O)C=O,0.1542
CC1NC1C12CN1CC2,0.3004
c1c(cncc1F)O,0.2107
OC12CC3C4CC1C2C34,0.3232
CC12CCC1C(=O)C=C2,0.1882
CC1CC1(C)C(F)(F)F,0.3751
NC1(CC1(N)C#N)C#N,0.2558
O=CC12CC1CC1OC21,0.2305
CCN1C=COC1=N,0.2191
CC1=CC(=O)OC1C#C,0.2251
CC1OC11CCC1C,0.3297
CC1(CCC=C1)C,0.2651
CNC1=NC(CO1)C#C,0.2616
O=C1CC2C(OC12)C#N,0.1996
OCC1(C=O)C2COC12,0.2162
CN1N=CC=NC1=N,0.1476
CC1(O)CN2C1CC2=O,0.2377
CC1=CC(O)C2OC12C,0.2394
c1c(oc(n1)CO)CO,0.2362
NC1=C2C3CC3N2C=N1,0.1976
OC1CN2CCC12C#N,0.2388
CCC([NH2+]C)C([O-])=O,0.2681
CCC(C)C(C)C#C,0.3148
CC12CC3(C)C4C(C14)N23,0.3073
CC(O)C1(CO)CN1C,0.3044
CC1OC2(C)CC1C2O,0.3059
CC1CCCC(O1)C#N,0.2939
OCC1C2CC3NC3C12,0.3017
CC1(CO)C2CCC12,0.3241
CCC1OC(C#C)C1O,0.2717
CC12CC3C(CO1)C3O2,0.3129
CC12CCC1C2N1CC1,0.3213
OCCC(C#N)C1CO1,0.3009
C1C2C3C4C(CN23)N14,0.2976
CC1(CO)OC1(C)C#N,0.28
C1C2C3OC22COCC132,0.3063
CC1C2C(C1=O)C2(C)C,0.2252
CC(O)C1(CCO1)C#C,0.2751
CN1CC(C1)(C(=O)N)N,0.245
CCOC(=O)NC1CC1,0.3069
CC1NC1C1CNC1=O,0.2826
C1C23COC12CCC3,0.2916
COC(C=O)C(F)(F)F,0.2217
CC(CC#N)C#CCO,0.2814
O=CC1NC1C(=O)C#C,0.1698
CC1CCC1(N)C#N,0.284
CC1(O)C2OC(C#C)C12,0.2452
CC(C#C)C(C#N)C#N,0.2752
OCC1(O)C2C3C1CN23,0.29
CC(C=O)C=O,0.1986
NC(=O)CC12CCC1N2,0.2672
OC12CC(C1)OC2C=O,0.2039
c1nc(no1)NCCO,0.2209
CC(=O)CC(CO)C=O,0.2192
CC(NC=O)C(C)(C)O,0.2815
CCC1OC(CC)C1C,0.3197
CC1C2C1C(C)(C)C2C,0.3259
NC(=O)C1(CN1)C1CN1,0.2587
C1CN(C1)C=O,0.2661
Cc1ccn(n1)C(C)C,0.2597
CC1C2CN2CC1C#N,0.2716
CCCC(C)N(C)C=O,0.2722
OC12CC1CC1CC2O1,0.3088
CC(COC1CC1)C=O,0.2262
CC1(C)N2CC11CCC21,0.2569
C#CC1=CC2CC2OC1,0.1953
CC1CCC1C#N,0.3306
N=C1ON=C2C=CCN12,0.1666
CCC(O)(C#N)C(C)C,0.3077
CCC1(CO1)C1CCO1,0.3212
CC1(C)C2COC12C#C,0.243
OCC1OC2CC2C1=O,0.2162
CC(O)C1NC(C)C1=O,0.2092
CC1C(CO)N1C(N)=O,0.2748
CC1(CC2(C1)CC2)OC,0.3267
CC(C)CC1(CN1)C#C,0.286
CC(O)C1=CC(N)=CO1,0.2168
CC1OC2=COC=C2O1,0.2422
CCC1(C)CCCOC1,0.3178
CCCC(O)C1CCO1,0.3242
c1c(c(n[nH]c1=O)N)N,0.1731
OCCC(O)CO,0.3181
C1CC23OC2CCC=C13,0.2331
Cc1c[nH]nc1CC=O,0.2131
N#CCOC1CC2CC12,0.2798
Cn1cc(cc1O)C#C,0.2062
OCC1OCC11CCO1,0.3016
O=C1NC2C=CCCC12,0.2487
NC=[NH+]CC(=N[O-])C#N,0.172
CC1(CC1)C2CCC2,0.3394
CC12CC3(CC3)CC1O2,0.3451
CC(=O)c1cc(n[nH]1)N,0.1642
c1c(non1)C#CCO,0.2045
CC(=O)C1CC2CC12C,0.2196
CC1(CCCC1)C2CC2,0.3442
C1COC(=NCCO)N1,0.2749
C1Oc2c(oc(n2)O)O1,0.1999
OCC1N=C2CC3C1N23,0.1953
N#CC1OC2CCCC12,0.2753
CC(C)(CC(=O)C#C)O,0.1878
CC1OCC1C(=O)C#C,0.1846
C1C(CO1)(C=O)O,0.2129
C1C2COCOCC12,0.3369
CC(O)C1=NNN=C1O,0.2309
COC12C=CC3C1OC23,0.2165
c1c(nn[nH]1)C2COC2,0.2433
CC12CC3(C1)OCOC23,0.3239
O=C1CNC2C3NC2C13,0.2049
OC1(CCC2NC12)C#N,0.269
CC12NCC1OC2C#N,0.2438
C1C2COC=NCC12,0.2591
CCC(CC)C(=O)C#C,0.2033
CCOC1CC1COC,0.332
C1C2C3C4C5C(C4N13)N25,0.2725
CC(=O)Cc1nc[nH]n1,0.2336
OCC12CC(C1O)C2=O,0.235
OC(C#C)C1OCC1=O,0.2206
CN1C(CO)C1C#C,0.2559
CC1C2C3OCC3C12O,0.3026
c1c[nH]c(cc1=NO)N,0.1694
CCn1cccc1C#C,0.1996
COC1(C)CC2C(C)C12,0.3226
c1c2c(no1)NCCC2,0.2215
CCC1CC=CC1OC,0.2586
C#CCC(=O)C#CC#C,0.1838
[O-]C(=O)C1[NH2+]C2CCC12,0.2628
CC1C2CC3C(C)C2C13,0.3597
Cn1ccc(n1)CC#N,0.2582
N=COC1C2CC1OC2,0.2586
CCC#CC1CC(=O)C1,0.2168
COc1ncc(o1)C#C,0.1961
c1cn2c(n1)[nH]c(n2)O,0.2397
c1cc(=O)[nH]nc1CO,0.1745
C1CC=C(C1)CCO,0.2584
CCCCC1(C)CC1O,0.333
CN1C2C3C(O)C3C12,0.2699
CC1=C2CC3(C)C(C1)C23,0.1723
CC1(C)CC1(C)C#N,0.3118
C#Cc1cnc(=O)on1,0.1616
NC12CC1(NC2=O)C#C,0.2128
CC12NCC1NC2C#N,0.252
COCC(=O)OCC#C,0.2756
c1cc(oc1C=O)C#N,0.1748
CC12CC3OC1CC23C,0.3186
CC1OC2CC11OCC21,0.2835
O=C1NCC(N1)C1CN1,0.301
Cc1cc(=O)nco1,0.2071
O=CC12CC3NC3C1N2,0.2184
OC12CC3C1N3C(=O)C2,0.2364
C1CCC(C1)OC=O,0.2861
C1CNC(=O)C(=O)N1,0.2096
CCC(C=O)C(C)C,0.2259
OC1(CC(C1)C#C)C#N,0.2781
C1OC2C3CC1COC23,0.2845
CN1C2C3CC(C3)C12C,0.2978
CC1CCC2C(C#C)C12,0.2865
CC12NC1C=CC1CC21,0.2405
CCn1cc(nn1)CO,0.2467
CC1(C)OC2CCC2O1,0.3215
CC(C)(C1CC1)OC,0.3266
OC1CN2C3C=CC1C23,0.2188
O[C-]1C(=[NH2+])NC=CC1=O,0.1822
CC1=CC2(CC1C2)C=O,0.1998
Cc1c(ncn1C)N,0.2193
Cc1c(nc(o1)N)N,0.2162
CC12OC1C=CC1CC21,0.2376
CC1CN1CC1(O)CC1,0.3121
O=C1OC2CCC=CC12,0.2478
CN1C2C1C1(O)CC21O,0.2651
CCC1(C)C2OC(C)C12,0.3123
CC1C2OCCOC12,0.3019
CCOC1CCC1C#N,0.2954
C1OC2CC3CC1C2O3,0.3188
C1C2C1C1NC1C1NC21,0.2854
CCC1OCCCC1C,0.3221
OC1CC2OC1CC2O,0.3134
OC(CC#N)C=O,0.2347
C1OC1C12COCC1O2,0.3297
CC(C)CCCC1CO1,0.3467
OC1CC2(CC2)C1C#C,0.2914
C(=O)Oc1c([nH]nn1)N,0.2205
CC1C2CC3CC=C1C23,0.219
N=COC(=O)CC1CN1,0.223
[O-]C(=O)C12CC3[NH2+]C1C23,0.1568
c1c[nH]c2c1CNC2=O,0.214
OC1=CC(F)=CC(=N)N1,0.1767
CC1(C)CC2C(O)C12O,0.3097
N=C1C=CC(=N)N1C=O,0.1639
N=C1N2CC2CC1=O,0.1684
CCc1nc(on1)C,0.2613
OCC1C2OC3CC2C13,0.3122
O=CC1CCC11CC1,0.2205
c1c2c(co1)COCC2,0.2339
CC1=C(C=O)C2CC1C2,0.1847
CCCCC1C2CCC12,0.3332
OCC12CC(CCC1)O2,0.3168
COC1(C)CCC=CC1,0.2674
OC1CC2CC(O2)C1=O,0.2086
CC12NC1C1(NC21)C=O,0.1782
CCC1C2(C)CC1(O)C2,0.334
OC12CCN3C(C13)C2=O,0.2208
C(CO)N(C=N)C=O,0.2157
Cc1cnc(c(n1)C)O,0.1938
CCC(C)(C=O)C(C)=O,0.2059
CCC1CC1(CO)C#N,0.3059
CC(C)C(C)C1(C)CO1,0.3372
c1conc1C(=O)CO,0.1997
O=C1CN2CCCC12,0.2038
NC1(CC1(O)C#N)C#C,0.2454
C1CC1OC1=NCCC1,0.2766
COCC12CC1C=CC2,0.2492
NC1=NN2CC(O)C2=N1,0.2211
CC1(CN1)C1=COC=C1,0.2383
CC12CC1OCC2CO,0.2926
CC1N2C3C4C=C1C2C34,0.1819
CC(=N)OC1=NNC=N1,0.2666
CC1(O)CC1CCC#N,0.2985
CC(N)(C#N)C(O)C#N,0.2784
CCOc1coc(=O)o1,0.2558
OC12CCCN3C1CC23,0.2828
OC12COC1CC2=O,0.2151
C1OC11C2CC3C2OC13,0.3051
C1C2NC2C2NC12,0.2895
CCOc1cc(oc1)N,0.2271
CCC(C)C(C)C(C)=O,0.2297
Cc1cccc(n1)C,0.224
O=C(C#N)C#CC1CN1,0.1665
OC(CC1(O)CC1)C#C,0.2746
NC12CC1(NCC2)C#N,0.251
C1N2C3CC4CCC13C24,0.3022
CC1(C=CCN=CO1)C,0.2566
C#CC1CC1OCC#N,0.2513
OC12CC3(C1)COCC23,0.3182
CCC(CO)C(C)CO,0.328
C1OC23C1OC1C2NC31,0.2857
CC(O)C(C)C1(O)CC1,0.3055
CCCC(C=O)C(C)=O,0.1993
O=C1C2CNC1C2C#N,0.2108
CC1C2CN(C2)C1C#N,0.2691
CC1C2CCCC1C2C,0.345
C1CCC(=C2COC2)C1,0.2371
Cn1cc[nH]c(=O)c1=O,0.1769
c1ccnc(=O)c(c1)N,0.1467
CC(C=O)(C=O)N(C)C,0.1721
CC(C)(O)C(C)(N)C#N,0.2845
CC1(CCC#N)CO1,0.3142
CCC1=NC2(C)CC2O1,0.2624
CC1=CC2CC3OC2C13,0.2405
CC1C=CC2COC1C2,0.2556
CC12CC3C(CO1)N3C2,0.3014
OC12C3C1N1CC3C21,0.2887
c1nc2n(n1)CC2,0.2752
C1C=CC2=CCCOC12,0.1976
CC(C#C)C(=O)C#N,0.1934
N=C1C=CN=CN=C1,0.1632
OC12C3OC1CC23C=O,0.2191
C1CC2C1C21COCO1,0.321
CC1(C)C2CC3CN2C13,0.3098
FC1=NC=NC(=O)O1,0.2049
CCC1(CO)CC(C)O1,0.322
c1coc2c1OCCN2,0.2109
OC1CCC(C=O)C1O,0.2229
CCOc1cc(c[nH]1)C,0.2427
CC1NCC2=C1N=NN2,0.2231
CCC1OCC(O)CO1,0.3311
CC12CCN1C(=O)NC2,0.2853
CC12CN1C1C(C#C)C21,0.2575
COC1CCC=C1,0.2639
C(CNCC(=O)N)C#N,0.2591
c1c(c(co1)N(=O)=O)N,0.1401
C#CC1CC=C2COC12,0.2407
OC1C2CC2C1CC=O,0.2302
CC12COC1(C)C2C#C,0.2661
C1C2C=CC11COCC21,0.2356
C1OCC2OC3C1OC23,0.3046
OC1C2NC2CC1=O,0.2124
NC1=NC(=NN1)C1CN1,0.2366
c1c(=O)cnoc1N,0.1839
COC1C2NC(=N)C12O,0.2481
CCCC#CC(=O)CO,0.2098
O=CCC1NC1CC#N,0.2226
OCCC(CO)C1CC1,0.3334
CNC1=NOC(=N)N1,0.2471
c1c2conc2ncn1,0.1707
Cc1ccc([nH]c1=O)O,0.1788
O=C1CC2C(CC#N)C12,0.2281
N#CCC1C=CC2CN12,0.2278
CC1=COC(=N)C(=N)N1,0.1735
NC1=CC(=N)OC1,0.2134
C1C2C3C4C2OC1CN34,0.3054
CC(CCC=O)OC=O,0.2299
C1CC23C4OC2C4CN13,0.2836
OC1C2OCC12C1CC1,0.2913
C(C#N)N=C(C(=O)N)N,0.2198
C(CNCC#N)CO,0.2706
C#CC12CC1C1CC21,0.2429
CN1C(C#C)C1C1CO1,0.2574
N=C1OCC2=NC=CN12,0.223
CCC1OC(=N)C2NC12,0.2645
Cc1c[nH]cnc1=O,0.2101
CN=C1CC(O1)C1CO1,0.2817
CCC1C(CO)C2CN12,0.2956
OC12CC3(O)CCC1C23,0.3175
O=CC1CNC(=O)N1,0.2115
C#CC1C2CCN=CN12,0.2272
CC#CC(C)(O)C1CN1,0.2712
CCC1CC1C#N,0.3173
CC1=CC2CCC1C2,0.2529
CCC1=CCCC12CC2,0.2425
N=COCCC(=O)C#C,0.1975
C#CCC12CN1C1CC21,0.2729
OC1C2CC1C2C=O,0.2203
N=C1CC=CCCO1,0.2546
NC1C2N=COC12C#C,0.2255
Cc1nnn(n1)C=O,0.2093
CCCC(O)C(C)=O,0.2386
COC1=CC(=N)C=NO1,0.1694
CN=C1CC2(CN2)CO1,0.272
OC12C3CC1=CC(=O)C23,0.1552
CC1CC(=CC1C)C#C,0.2087
C(C#N)C(=O)CO,0.2372
CC(C)n1c(=O)ocn1,0.2385
OCCCC1CC2CC12,0.3316
C#CC12CC(C1)C1NC21,0.2752
CC1=CNC(=O)OCC1,0.2258
c1c2c([nH]n1)CC(=O)N2,0.2081
CCC1OC1C1(C)CO1,0.3397
CC12OC3C1C2C3=NO,0.2457
Cc1[nH]c(c(n1)C#C)O,0.2165
COc1ncnc(n1)F,0.2359
N=C1NC(=O)OC1C#C,0.2648
CN=C1N(C)CC11CO1,0.2371
Cc1nc(nn1C)OC,0.2393
CC12CC1N1CC21C#C,0.235
CC(C)(C#N)OC=O,0.2786
C1C=CC(=NO)C1=O,0.1725
C1NC11C2NC3C2NC13,0.2774
C1CC2OCC1O2,0.3343
c1c[nH]nc1CCCO,0.2676
CC1C(=N)OC11CC1,0.2771
COC1(COC1)CC#C,0.2911
CC(OCCC=O)C=O,0.2237
O=C1CCC2CCC2=C1,0.189
N=COC1=NOC=N1,0.2394
C1C2C3N=COCC1C23,0.2525
Cc1conc(c1=O)N,0.1789
[O-]C(=O)CNC=[NH2+],0.2454
CC1(CC(=O)C#C)CN1,0.1862
C1OC2C3OC22C1OC32,0.2047
N=C1OC=CN=CC1=O,0.1482
CC12CN1C1C(C=O)C21,0.1942
CC1=C(CN(C1)C)C#N,0.1829
CC1(O)CC(O)C1,0.3264
OC1C2OC3C2C13O,0.2937
OC1CCCC=CC1,0.2563
c1c(c(c(=O)on1)F)N,0.1734
O=CC12CC(C#C)C1O2,0.2126
CC1(CC1)N(C=O)C=O,0.214
CC#CCC(O)CC#C,0.2787
CC(=O)NCC(O)C=O,0.2006
c1c(nc(c(n1)O)O)F,0.1839
CC1(CCC1)C2COC2,0.3155
CC12CC1NC2C#N,0.2498
Cc1c([nH]c(n1)O)N,0.2482
OC1C=CC2C3C1CN23,0.2196
CCC1C2CN2C1C=O,0.2078
Cc1c(c[nH]c1N)O,0.2348
CCCOC(C)C,0.3336
CC12CC(O)(C1)C1CC21,0.322
NC1=NC=CC(=N)O1,0.1823
OCCCC1(CN1)C#N,0.2956
N=C1NC=NCC11CO1,0.2217
CC12CC(=O)C1CC2O,0.2211
CC1(CO1)C(=O)CCO,0.2232
OCC(=O)C12CC1CO2,0.2182
CC1CC(C)C1C=O,0.2203
C1CC2C3C4OC3(C1)C24,0.3041
NC(=O)C1OC(=N)C=C1,0.2053
CCCOC(=O)C1CC1,0.2838
N#CC1=NCCC2CN12,0.2002
COCC#CCC#N,0.2756
CC1CC=CC2CC1O2,0.2385
CCC1CC2(CC2)O1,0.3063
ON=C1C(O)CC1C=O,0.2175
CC1NC11C(C)OC1=O,0.2651
CC12COC(COC1)O2,0.3254
CC1OC(C=C1)C(C)=O,0.2055
c1c2c(n[nH]1)CCOC2,0.2539
OC12CC1C1C(C#N)C21,0.2446
CC1OC(C)C1CO,0.3066
CC(C)(C=O)C(O)CO,0.228
COC1C2COC1C2C,0.3113
CC12CN3CC1C23CO,0.2961
CC(O)C12CC(O1)C=C2,0.2372
CCCC(C)C=O,0.2268
CC1=CC(=O)C=CCC1,0.1792
CC1=CC(=O)C(N1)(C)C,0.1903
OCCC(=O)CC1CO1,0.2339
N=C1CN=C2CC=CN12,0.1987
COC=NCC(=O)C=O,0.149
CC1COC(O1)C(C)=O,0.2127
C1C=CCC2OC3C1C23,0.2581
Cn1ccc2c1CCC2,0.2352
CC1N2C3C4C3C1(C)C24,0.2963
N#CC1OC1C#N,0.2853
CC12CCC=C1C1NC21,0.2263
C[NH2+]C(C)(CO)C([O-])=O,0.2545
C#Cc1c(=O)[nH]ccn1,0.1511
Cc1nnn(n1)CCO,0.2572
CN1CCc2c1c[nH]n2,0.209
CCN(C=O)C(=N)C#C,0.208
Cc1cnc2n1nc[nH]2,0.208
OCC1=NC(=N)NC=N1,0.183
O=CC1CCN1C=O,0.2046
CCCC1(COC1)C,0.3147
CC#CC(=O)N(C)C=O,0.2028
CC(=O)CCC1(C)CO1,0.235
C1=CC(=O)NC(=O)C1=O,0.1434
CC1C2C(O)C2C1CO,0.3156
CC(NC(C)=O)C(N)=O,0.2488
CC1OCC2C3CC1C23,0.3192
OCC1OCC11COC1,0.2999
OC1CC2OCC12,0.3119
CC12CC(C1)C(O)CC2,0.3263
OC1C2C3CC(O)C2C13,0.3368
CC(=O)C1(CC1)O,0.2252
O=C(CC1CCO1)C#C,0.1886
c1nc(nn1CCO)O,0.2426
CC(C)(C=O)NCC=O,0.2107
CC(O)(CCC#N)C=O,0.2175
OCC1(O)CC2CC12O,0.2777
C1CC11OC2COCC12,0.3062
O=CC1CCCCO1,0.2265
CCC12CC1C1CCC21,0.3087
COCC1OCC(=O)O1,0.2642
CCCCNC=O,0.2835
COC1CC2CC12,0.3289
CN1CC2(O)CC12C#C,0.2366
Cc1cc2cnoc2o1,0.2153
OCC1(NCC1=O)C#N,0.2108
CC1(CC(=O)C1)C#C,0.2198
OC1C2CC3C=CC1C23,0.2422
CC1OCC(C)(CO)O1,0.3378
CC1CC2(CN2)CC1=O,0.2153
CC(C)C1(O)COC1C,0.3134
CCNC(=O)C1COC1,0.2634
O=C1CC2C3CC2C3N1,0.2663
N#CC12CNC1C1NC21,0.2473
CCC1CC(O)CC=C1,0.2645
C#CCC1=CC2CC2C1,0.242
O=CC12CC1C1NC1C2,0.2298
CCC1(CC1)C(=O)NC,0.2774
CC#CC12CC(C)C1O2,0.2594
NC12CC3N(C1)C23C#N,0.2561
CC(CO)C#CC#N,0.2459
CN=C1C=CNC(O)=N1,0.1929
OCCC1COC=N1,0.2678
CCC12CC1C(C)C2=O,0.225
C1CC(=NO)C(=O)OC1,0.2001
CC12NC1C(O)C2(C)C,0.3046
C1C2OC3=NNC=C3C12,0.2339
CC#CC1=CCCC1=O,0.1857
OCC12CC(C1)N2C=O,0.2497
CC1=CC2(O)C(O)C2C1,0.2336
CN=C1NN=CC=C1C,0.1582
c1c(c([nH]c1O)C=O)N,0.1724
CC1=NC2C3N1CC23O,0.2183
O=CC1C2CN2C1=O,0.2115
CC12C3C4CC1(O)C2C34,0.2837
O=CC1C2C3C=CC2N13,0.1904
CCC(O)CC1OC1C,0.3304
CC1NC2C1OCC2=O,0.1996
CC12COC1=NCC2=O,0.2056
CCC12CC1C(=O)NC2,0.2666
CC(C)C#CC1CO1,0.2735
C1C2CC3OC(CC13)C2,0.3166
COC12COC1C(C)C2,0.3
COCCCC(N)C#N,0.286
OC(C=O)C(C#C)C#C,0.2162
C1OC2C3COCC12N3,0.2693
CC1C(C)=CC2CC12O,0.2426
CC1CC(=O)N1CC#N,0.2744
CN1C(COC1=N)C#N,0.2504
CNc1cncc(=O)[nH]1,0.1626
CC(O)(CC#N)C1CO1,0.3129
N=C1CC2(CO2)C(=O)N1,0.2404
CCc1ncn(n1)C=O,0.2195
C1OC2CCCC3C1C23,0.3107
c1c(nnc(n1)O)C=O,0.1646
COC1(C)C2OC1C=C2,0.2292
COc1cc(ccn1)N,0.224
CCC12CC1OCO2,0.3149
CC(=N)OC(CO)CO,0.287
CC1CC2NC12C1CO1,0.2994
O=CC1=CC(=O)N=NO1,0.1568
OCC1=CC2C3C1CN23,0.2279
CCC12OC3CC1(C)C23,0.3066
OC1(CNC1=O)C1CN1,0.2553
Cc1cocc1C2CC2,0.2408
CC(=O)C1N2CCC12C,0.2119
CCC#CC1CN1CC,0.2605
OC1C2C3C1C1(CC1)N23,0.3027
CCC1OC1COC=N,0.2826
C12CC34CC(C3)C4(C1)O2,0.3277
CC1OC1C1(O)CC1C,0.3202
c1c(non1)CCC=O,0.2143
c1c2c(ncn1)COC2,0.2095
c1cn(cc1O)CC=O,0.1602
CC(=O)NCCCCO,0.2767
C(C1C2COC12)N1CC1,0.3029
CC(C)C([NH3+])C([O-])=O,0.2666
CCCC1(C)CC2CC12,0.3352
CC1CCC(=O)C(=O)O1,0.1781
CCC(=N)NC(=O)OC,0.2598
COCC12COC1C2O,0.2943
CC1(CO1)C1CCCO1,0.3238
c1c(cc(nc1N)F)N,0.2212
OC1CC2C1C=CC2O,0.2428
CC1CCN2C=NC=C12,0.2492
C1CC11NC2COC12,0.2901
C1CC1C12CCCC1O2,0.3384
COc1cc([nH]c1N)N,0.2246
OCC1CN=C(O1)C=O,0.1842
CCC1(C)CCN=CO1,0.2765
CCC12CC(CC1O)O2,0.311
C1CC2(C1)C1C3CC1C23,0.3598
C#Cc1cnc(o1)C#C,0.1744
CC1OC(=O)C1(N)CO,0.2464
OCC(O)C1=CN=CN1,0.2451
c1nc(c(o1)C#N)N,0.1896
CN1C(C=O)C1C1CN1,0.1931
CN=CN1CC1(C)C#N,0.2456
C1CC1C(=NO)C(=O)N,0.2099
O=COC12CN(C1)CC2,0.2446
OCC1C2C3CC3N12,0.2801
CCc1[nH]c(cn1)OC,0.2372
C1N2C=NC3COCC123,0.2457
O=CC(=O)C1COC=N1,0.1501
NC(=O)C1(O)CC1CO,0.2658
CC(O)C1C2CC1O2,0.3026
CC1NC(=O)C1C(C)=O,0.2281
OC12CCC1C1CCC21,0.3124
CC(=O)OC(C)(C)C,0.2787
CN1CC1C1NC1CO,0.2906
C(CC#N)COC(=O)N,0.3093
CC1CC1OC(=O)C=O,0.1803
C1C(CC1(C=O)C=O)O,0.2052
OC12CCC1C21CCO1,0.2817
[NH3+]C12CC1NC2C([O-])=O,0.243
NC1=CNC(=C1)C1CN1,0.2141
CC1=CC2COC2(C)C1,0.2571
CC1(C)C2OC1C2CO,0.3057
CC1(C)C2C3CC1CC23,0.3444
OC1C2C3CN3C1C2O,0.2836
C1CC2CC=CCC12,0.2625
OC12CC3C(C13)C2=O,0.2474
CC1=CCCC(C1)C#N,0.2601
CCn1cnc(c1C)C,0.2407
CC12C3CC(C13)C2O,0.3205
CC(C)(O)C1CN1,0.2944
CC1=CCC(=O)N1,0.216
CC(=O)CC1C2CCN12,0.2221
C1CC2(CCC1=O)CO2,0.2237
CN=c1occ(o1)OC,0.2391
OC1=NNC(=N)C(=N)N1,0.1811
C1C2OC1C1=CCCC21,0.246
OCC(C#N)C1(O)CC1,0.2889
CC(CC1CO1)OC=O,0.2747
c1c(c(oc1N)CO)N,0.2056
CC#CC(=O)NC=NC,0.2052
C1C2C3C4C5C2C1C5N34,0.2923
OCC1CCC(=O)C1=O,0.1417
CC1C2CCC(O)C12O,0.3068
OC1CCCC(O)C=C1,0.2523
OC1C(O)C(=O)C1O,0.1836
CC([NH3+])C1(CO1)C([O-])=O,0.1684
O=C1NCCNC1C#C,0.2576
OC1C2CC1C(C2)C=O,0.2227
CC12CC3(CO)CN1C23,0.2895
CC(O)C12CC(C1)C2C,0.3284
C(#N)c1c(onn1)C#N,0.1932
CCOC1C(C)C1O,0.2941
CC(C([O-])=O)C1([NH3+])CC1,0.2737
OCC12CN3C1CC23,0.292
CC1OC(=N)OC1C=O,0.211
O=C1OC2COC1C2,0.2533
COC1C2CCC(C)C12,0.3121
COCC#CC(O)C=O,0.2166
c1cnc-2nconc12,0.1459
CC1=CC(C#C)C(O)C1,0.2589
C1CC2N=COCC2=C1,0.2481
CCC1(C)C(C)NC1=O,0.2779
CC(O)C1(CC1O)C=O,0.2259
CC1CC2C3OC3C12C,0.324
CC1C2CCC3(CO3)C12,0.3236
NC1=CC(=N)OC=C1,0.1688
Cc1c[nH]ncc1=O,0.1894
N=COCC1=NOC=C1,0.2512
O=C1C=CC2NC12C#C,0.172
CC12CC(C1)(C#N)C2=O,0.2496
CC1=NC(CO1)C1CO1,0.2678
C1C(COCO1)(C#N)N,0.3032
Cc1ccc(o1)N(C)C,0.2108
NC(CC(O)C#C)C#N,0.2717
OCCC1(CO)CN1,0.3116
CC1=CC2=CCC3C1C23,0.1747
C1CN2C=CCOC2=N1,0.2082
OC1CC2C1CN2C=O,0.2645
O=C1CCC1C1CO1,0.2182
CC1CC1C1C(C)C1C,0.3191
CC(=O)N(C)C(C)(C)C,0.2643
N#CC#CC12CC(C1)O2,0.1997
CCC1=NCCC(C)O1,0.2737
COc1c2n(nn1)CC2,0.2255
CN1C(=N)N=CN=C1F,0.1904
C#CC12CC1CCC=C2,0.2397
CC1(CC1)C12CC(C1)C2,0.3456
FC1=NOC(=N)C=C1,0.1634
CC1N2CC2C2NC12C,0.2882
Cc1cc([nH]c1OC)O,0.2383
CCOC1(C)C(O)C1O,0.2936
OC1C=CC2C1OC2=N,0.25
CC1C2C3CC2(O3)C1=O,0.2099
N#CC12CN1CC=C2,0.233
CCC1C(O)C1(C)OC,0.2974
CC1(CO1)C1=CNN=N1,0.2452
COC1(C#C)C(C)C1O,0.2536
N#CC1OC2CC=CC12,0.2567
COCC12CC(CC1)O2,0.3193
CC1CC2(O)CC1C2=O,0.2255
CC1C2CC=CN2C1=O,0.2165
CC1OC2CC2C=C1C,0.2426
CC(O)(C#N)C(N)C#C,0.2773
CC1(C)C2C3CC1CN23,0.3167
CC12CC1(O)C(=N)O2,0.2759
O=CCCC(C=O)C#N,0.2026
[NH3+]C(CC#C)C([O-])=O,0.2661
CC1=CCC2CC3C2C13,0.2462
OC(C#C)C1(CN1)C#C,0.2712
CNc1nc(co1)C=O,0.1681
CC1(NCC1CO)C#N,0.2716
OCC1CC(C#C)C1O,0.2871
OCCC1CCC1C=O,0.2232
CC1(CC1)OC(=O)C=O,0.1774
CCc1c[nH]nc1CO,0.2548
CC1C2C3CC(C1O)N23,0.2862
Cc1ncc(nn1)C#C,0.1591
C(#N)C(=O)c1nnon1,0.1931
COC1C(C)C1N1CC1,0.2813
CCn1cccc1CO,0.2381
CC1N=COC1C=O,0.2163
NC(=O)C12CCC1N2,0.2582
C1CN(C1)C(=O)C#N,0.2191
O=C1C2C3CN2CC1N3,0.1801
O=COC12C3CC1CC23,0.2589
CC1(N)C2OCC12C#N,0.2427
CN=C(C=O)OCC#N,0.1729
OC1C2C(O)C(O)C12O,0.3113
[O-]C(=O)C1CC2(C[NH2+]2)C1,0.2693
OCC1NC1C1CCO1,0.3078
CC12CN3C4C3C1OC24,0.3027
OC12CC1C1OC1CC2,0.3179
CC(C)C12CC(C1)C2,0.3655
COC12CC(O)(C1)C2=O,0.2309
C1C2C=CC3=CN=C1N23,0.1506
FC1=CN=COC1=N,0.1816
CCC12C3C4C(N13)C24C,0.2758
CN1C2C3NC3CC12C,0.2726
COC1CC2(NC12)C#N,0.2617
ON=C1C2CC2C1C=O,0.2174
C1C2CC3=C(CCC3)C12,0.2412
OCCC1CC1C=O,0.2283
C(CO)COC(=O)C=O,0.1816
O=C1OC2CC=CC2=C1,0.189
CC#CC1=NCC(C)O1,0.2175
CN1C2CC2C(=O)C1=O,0.1731
CC#Cc1cn(nn1)C,0.2199
CCC1=CCCC1CO,0.2571
NC1=CC(F)=COC1=N,0.1574
CC(CCC#N)CC#N,0.3444
c1c(c([nH]n1)N2CC2)N,0.2221
CC12CC1(O)COC2=N,0.2781
O=CC12CN1CC2=O,0.21
O=CC1NC1CC1CC1,0.2217
CC1CC(=O)CC2OC12,0.225
C1OC11C=CCC2NC12,0.2455
CC12CC3C4OC1C2C34,0.305
Cc1c(onc1C#N)C,0.2151
N=C1C=CC(=O)NN=C1,0.1721
CC1C=C2CCC2C1=O,0.2219
COCC1=CCC(O)C1,0.2608
CC1COC(=O)C1,0.2789
CN=C(c1ccco1)N,0.1979
[O-]C(=O)CC1[NH2+]C2CC12,0.273
CC12OC1CC1(O)CC21,0.3251
CC1C(C#N)N(C)C1=O,0.2679
N=C1NCC2(CN2)C1=O,0.1816
CC1CCC2(C)OCC12,0.3192
N=C1OC(C#N)C11CN1,0.262
Cc1c(c(no1)N)CO,0.23
CC(C#C)C1CC1(C)O,0.3011
CC1CCN2CC1(O)C2,0.2759
C1C2OC3CC3C=CC12,0.2453
NC(=O)CC1CCO1,0.2699
CC(CO)C1(O)CC1,0.3252
C1C2C3C4C(CN13)N24,0.2747
OC1C2OC2(C#N)C1=O,0.1994
CCC(C)(O)C1(C)CC1,0.3237
OC1CCC(C1)C=O,0.2289
OCC1CC2(CO2)C1,0.3304
c1c(n[nH]c1N)CC=O,0.1979
O=C1CNC11CCOC1,0.2065
CNc1cc(on1)C#C,0.1843
CC(O)C1(CN1)C1CN1,0.2969
CCC1COC(O1)C#N,0.3038
C1C2C3CC4COC13C24,0.3256
OCC(O)C1CC1CO,0.315
c1cn(nc1C#N)C=O,0.2098
O=CCC1COCO1,0.2266
CC1C2C3CN1C3C2=O,0.2205
CC1=CN2CC2(C)C1=O,0.1909
CC1(N)C2OC2C1C#N,0.2843
OC1C2C(O)C1C2C#N,0.2875
Cc1c[nH]c(n1)CO,0.2438
CC(=O)C1(O)CCC1O,0.2099
C#CCC(=O)C(F)(F)F,0.2186
Cc1c(cco1)CC#N,0.2311
CCC(C)C(C)(O)CO,0.3156
COC1CC1C(N)=O,0.2662
C(CO)COCCCO,0.3276
OC12CC1CC2C1CO1,0.3177
CC12CCC34CC(C13)C24,0.35
OCC1C2NC2C11CC1,0.2974
COC(C=O)C1CC1,0.2202
CC1CC2OC1C2(C)O,0.3105
CNC1=CON=NC1=N,0.1421
CCC1=CC2OC1C2=O,0.2464
CCC1CC2(O)CC12O,0.2859
C#CC12CN1C=NCC2,0.2335
CN1CC(C1)(CO)OC,0.2863
OC12C=CC3CC1C2C3,0.243
COCc1ccccc1,0.2385
CC(=NO)C,0.2584
COC1(C#N)C(C)C1N,0.2543
NC(=O)C(C#C)C1CC1,0.2645
CC1=CC2OC1CCO2,0.2516
C#CCN1C2COCC12,0.2754
CN1C2C3C4NC4C2C13,0.29
O=CC1OCCC11CC1,0.2126
CNC1C2CN2C1C#N,0.2443
Cc1ccc(o1)CC#C,0.228
CN1CCC1C#CCO,0.2529
CCc1[nH]c(=O)ncn1,0.2016
CC1=CCCCC2NC12,0.2347
O=C1CC2C=CCN2C1,0.1891
COC12CC1CC(C)=C2,0.2435
Cc1c[nH]c(=O)c(n1)F,0.1723
CC1CC1N1C=NN=N1,0.2618
CCN=C(N)C(=N)OC,0.2098
CC12OC1CC(=C2)C#N,0.208
OCCCC1COC1=O,0.2779
CC(O)C1(CO)OC1C,0.3194
CC1(C)C2C3CN3C12,0.2812
CC1(C)CCC1(C)O,0.3213
CN1C(CC1C#C)C=O,0.1828
CC1CN1CCCCO,0.3019
OCC1CC2C1C1CN21,0.2918
OC1CC2(CC12)OC=N,0.2772
CC(=O)C(C#C)C1CO1,0.2262
CC(C)(C)C1CCC=C1,0.2614
N#CC1CN2C=NC=C12,0.2452
CN(C)C1(CC1O)C#N,0.2701
C1C(=CC(=O)N1)CO,0.2177
CC1OCC1(C#C)C#C,0.2759
CN=COCC(C)C=O,0.2199
CC1(C)CCC1(O)C=O,0.221
C#CCCC1(CO1)C#N,0.2691
C1NC1C1CN1,0.3032
c1c(c(nc(=O)o1)N)N,0.1887
CC1(C)C(O)CC1O,0.3172
CCC(=O)N(CC)C=N,0.2344
CC(O)C1CC(C)(O)C1,0.3219
C1COCC(=NO)C1=O,0.1815
CN=c1c(ccc[nH]1)F,0.1651
Cn1cc(cc1C#N)O,0.1896
C#CC1(CN=CN1)C#N,0.2423
CC12C3CCC1OC23,0.3092
C1CC1c2[nH]c(=O)on2,0.2454
CC1CC2OCC1C2=O,0.2072
N#CC12CCC1CN2,0.2527
CC(C)OCCCC=O,0.2299
C1CC1OC1CC=CC1,0.2635
CN1CC1C#CCC=O,0.199
CC1CC=CCOC1C,0.2591
C1CC1C2(CC2)CC=O,0.2256
O=C1OCC2N=CNC12,0.2376
CC1=CC2OC3C1C23O,0.2296
O=C1C2CC3N2C13C#N,0.2326
CC12CC1(C)C(N2)C#N,0.2488
C1CN2CCOCC2=N1,0.237
C#Cc1cn[nH]c1CO,0.2243
CC1C(=N)OC11CC1O,0.2779
CC(C)CC1CC1C=O,0.2284
Cc1[nH]cc(n1)C#N,0.2275
N=C1CC23CC(N2)C3O1,0.2762
c1c(nc[nH]c1=O)C=O,0.1642
COC(=O)CN1CCC1,0.2329
CCC1C(=N)OC11CC1,0.2765
OC(C#C)C1=CC=CN1,0.2223
CC12OC1C=CC2C#C,0.2425
Cc1cc(co1)C#N,0.2159
CC1COC(CC#C)=N1,0.2651
OCC(O)C1OCC1=O,0.2218
C1CC11CC2COC12,0.3072
OC1C2NC2C11CN1,0.2986
CC12CC(C3NC13)C2O,0.2966
O=CC1CCC2OC2C1,0.2258
CCCOC(C#C)C#C,0.2757
CC(O)C1=CC(C)=NN1,0.2565
CCC12CC3C(O1)C23,0.3026
CC1C(O)C1(O)CC=O,0.2135
CC1OC1C1=CNN=C1,0.2494
O=C1COC2CC12C#C,0.2097
Cn1c(ncn1)N(=O)=O,0.1928
O=CC12CC3C(CN13)C2,0.2102
CCOCC1CC1(C)C,0.3323
c1c(=O)[nH]c(c(n1)N)F,0.1403
CC1C2C(C)CC12C#C,0.2667
C#CCC1(CN1)C#C,0.2812
N=C1OC2CN3C2CC13,0.2454
CC(O)C1(CN1)C#C,0.2796
N=C1CC=CCC(=O)O1,0.2357
CC(C)(C)CCC1CC1,0.3452
CC1CC2(C)C(CO)N12,0.2934
CC1(CO1)C1CC1CO,0.3159
CC1(CN1)C1CC(=O)O1,0.2708
NC(=[NH2+])C1=COC([O-])=C1,0.149
C1OC2CCCC=CC12,0.2454
COCC1(CCO)CN1,0.3161
C1OC1C1OC11CCC1,0.3225
C1COCC#CC=CC1,0.2014
Cn1cnc(n1)OC,0.2381
CC1CC2(C)CC1C=C2,0.2544
CCCCC1CC1,0.3635
CC1C2C3C(C#N)C2C13,0.3291
CC12NC3=NCC1C23O,0.1614
CC1C2(C)NCC12C#N,0.2493
C(C#CC#N)C(=O)N,0.2319
CC1CC11N2CC1(O)C2,0.3146
CCC(=O)C(C)CCO,0.2317
OC1C2CC1(C2)OC=O,0.2781
O=CC1CCC(C1)C#N,0.2281
CC1CC2CNC(=O)N12,0.2874
CC1N2C(=O)CC12CO,0.2356
CCC1C2CC1(C)CO2,0.3097
CCC1CC(C)N=CO1,0.2714
CC1=CCC(O)C1=O,0.1951
CCOCC(=O)C,0.2346
Cc1nc(no1)NC=O,0.2299
O=C[C-]1[NH2+]C2CC2C1=O,0.1953
CC1CCCC1=NO,0.2515
CC(=N)N(C)C(=O)N,0.2464
CC(=O)C1(CN1)C(=O)C,0.2089
CC1CN(CC=C1)C=O,0.2515
CN=c1n(nc(o1)O)C,0.2339
c1[nH]c2c(n1)n[nH]n2,0.2168
CC12CC(C1O)C2CO,0.3171
Cc1c(=O)[nH]nc(n1)O,0.1592
CC1(CC=O)CCC=C1,0.2198
CC1CC(OC=N)C1O,0.2688
N=C1CC2(CC2)OCO1,0.2789
CC#CC1OCC2OC12,0.285
CC1=CC(N)=COC1=N,0.1534
NC1C2N3CC3C12C#N,0.2423
CC1=NC2CC2OCO1,0.2496
CC1C2N1C1CC1C2=O,0.2107
COc1cnc(=O)on1,0.1673
CC12CCOC1C2CO,0.3185
CC12COC11CN(C1)C2,0.3129
CC1(CCN1C=O)C,0.2686
CC(=O)C1CC1N1CC1,0.2132
[NH3+]C1CC2C1C2C([O-])=O,0.1222
O=CCC12CC(=O)C1O2,0.2089
N#CCCC12CC1CC2,0.3011
CC1CC(C)C(=N)O1,0.2831
CC(O)C(OC=N)C#C,0.2821
CCOCC1(C)CCO1,0.3213
c1c2c(cnn1)non2,0.1456
O=CC1NC2C(C#N)C12,0.2121
N#CC1NC2(CC2)C=C1,0.2287
OCCC1NC1C1CO1,0.3155
c1cnc([nH]1)C#CCO,0.1982
CC12CCC(O1)C=CC2,0.259
COc1nnn(n1)C=O,0.1866
CC(C)(c1cnon1)O,0.2456
C1CC2CC3C1C3C=C2,0.2412
CC1C2CNC2=CC1=O,0.2051
COCC1COC(C)C1,0.3317
CN1CCc2c1noc2,0.2162
COC(C)C1=NC=CO1,0.2408
O=C1OC2OCC1C=C2,0.2289
CC1=CC2NC2C2NC12,0.241
CC1=C2CCC2C(=O)N1,0.2017
OC1C(=O)C2N3CC12C3,0.1806
c1c(cn[nH]1)CNC=O,0.2552
CC1=CC2CC1C2C#N,0.2281
O=CCOC1CC2OC12,0.2269
NC1=CNC=C(F)C1=N,0.1708
OC1CCC2CC12O,0.317
CCCN=C(C=O)N,0.1832
NC(CO)C1=NNC=N1,0.232
NC1=NC2=C(O1)N=NO2,0.1431
CC1CC11CC(C)(C)O1,0.3033
C1CC1C1COC2CC12,0.3093
C(C1CO1)C1=CC=NO1,0.2437
OCC1OC=NC1CO,0.2582
CCC(C=O)C#C,0.2203
COC1C2CN2CC1=O,0.1882
C(c1c(=O)nnon1)O,0.1532
CC1(C)C(O)COC1=O,0.2774
CC1=CNC(=O)CC=C1,0.1912
CCC1C2CC(C)C1O2,0.318
CC12CC1C1=CN=NN21,0.2357
COC1C(O)CNC1=O,0.2494
c1c(cnc(c1F)N)F,0.1886
Cc1c(noc(=O)n1)F,0.1753
CC1C2CCOC(C)C12,0.3182
CC12C3C4C1C4(C#N)C23,0.2568
O=CNCC1CCO1,0.2787
CC1OC(=N)C11CCN1,0.249
CC1C2CC2C1OC=O,0.281
CC12CCC1(C#N)C2O,0.273
CCC12CC=C3CC1C23,0.1775
CCC1(C)COC(C)=N1,0.2712
Cc1[nH]c(cn1)COC,0.2395
CCOC(=O)CCO,0.2852
CC1(CC1)COCC#N,0.2918
CC1CC(=O)C=CC1O,0.1861
OC1C2OCC3(CN3)C12,0.2998
Cn1cc(nc1N)C#C,0.2067
C1CN1c2c(nno2)O,0.1867
CC1C2CCOCCN12,0.3019
CC1OCC11NC1C#C,0.272
CN1C2CC3(CN3)C12,0.298
C1CC12CCN=CO2,0.268
[NH3+]CC1=C(N=N[N-]1)C#N,0.2396
O=CC12CC(C=C1)C2=O,0.2107
CC1=NC2CC2(N1)C#N,0.239
C1CC12COCC2=NO,0.2387
N=C1OCC=C1CC#N,0.2193
FC1=CC(=N)C(F)=CO1,0.1984
c1nnnn1CCC#N,0.262
CCC1(C)CC1CCO,0.3387
CCCOc1nc[nH]n1,0.2469
CC(C#C)C1C2COC12,0.2959
CC1C2CC1C1(C)CC21,0.3377
CC(C=O)C1NC1(C)C,0.2249
CC12C3CC4C(C13)C24C,0.3024
CC1CCC=CC1,0.268
O=C1C2CN3C2C=CC13,0.1831
CC1COCCCC=C1,0.2563
O=CCC1(CN1)C#N,0.223
COC1C2CC1C1NC21,0.3045
C1NC1C1(CO1)C1CO1,0.322
CC(=NO)C1(CC1)O,0.2432
C(CO)c1[nH]nc(n1)N,0.2311
OCC12OCC1C1CC21,0.2974
C#CCN1CCNC1=O,0.2785
c1cc(=O)occ1CO,0.1751
O=COC1CNC1C=O,0.207
Cc1c(nc(o1)NC)N,0.2146
CCC1CCC1(O)C#C,0.2903
OCC1OCC=C1CO,0.2486
CC1(CN2CC2)CC1O,0.3088
COCCC#CCC#C,0.2905
CCC(C)C(O)CC#C,0.3056
CC1(CN1)C12CN1CC2,0.3026
COC1C(OC)C1C=O,0.2205
O=C1C2OC3OCC2C13,0.2162
C1CN1C(=O)C#N,0.2189
CC1(CCN1C(=O)N)C,0.2884
C1CC=CC2(C1)CCC2,0.2595
CC12CC(CO1)C21CO1,0.3162
NC(=[NH2+])[C-]1N=COC1=O,0.1743
C1C=CCC=CCC=C1,0.2415
COC12CC3(C)C1CC23,0.3411
c1nc2[nH]nc(n2n1)N,0.2242
CCC(C)(N)C(F)(F)F,0.3286
CC12CC3(O)C1OC23,0.3008
CC(=O)N1C2CC1C=C2,0.2206
C1OC2C3OC12C1NC31,0.2995
CCC12COC1C(C)O2,0.2997
CCNCC(=O)OCC,0.2401
N=C1CC(CO1)C1CO1,0.2861
C#CC1CC2OCC1O2,0.299
NC(=[NH2+])C1=CN[CH-]C1=O,0.1848
C1CN1CCC(=O)C#N,0.1635
CC(C)C#CC(=O)OC,0.2328
OC12CC3CC1C23C#C,0.2588
O=C1C=CCC2CC1O2,0.1793
COCc1cocn1,0.2463
CCCC(=O)NC(=O)N,0.2429
C1C(CO1)CCCCO,0.3181
Cc1ccnc(=O)cn1,0.166
OC1CCC2CCOC12,0.3013
CC1(C)C2OC3CC3C12,0.316
CC#CC1(CC1)C(C)C,0.287
CN1CCC1C(N)C#N,0.2534
C#CC12CC3NC3C1N2,0.2714
CCC1C2C3OC1C23C,0.3013
Cc1cccnc1C#N,0.2068
CCC1OCC(=O)C=C1,0.1778
CC(C([NH3+])CN)C([O-])=O,0.277
O=C1NC(=O)N2CC12,0.2357
O=CC1CCNC(=O)C1,0.2121
C1CC(C1)(C=O)N2CC2,0.1924
c1c2n(nn1)C=CC2,0.2113
CC12C3CN1C(=O)C23C,0.2426
COC1CC1(N)CC#N,0.2671
CC(C)(O)C(O)CO,0.3145
COC1(C)CC2CC1O2,0.3217
CC(=O)c1cc([nH]n1)N,0.1904
O=C1C2CC1C(=O)NC2,0.2203
CC1(C)C2COCOC12,0.3256
OC1CC2CC(O)C12O,0.2888
COCC1(C)COC1C,0.3196
CC12CC3(C)OC1C23O,0.2853
CCC#CC1(CC1)CO,0.2836
FC(F)(F)C1CCN1,0.3169
CN1C=CC(=NO)C1=N,0.1389
CC(=O)Cn1ncnn1,0.2346
Cc1c(oc(n1)OC)N,0.2385
CC1=CCC(=O)N1C=O,0.2055
O=CC#CC1COCO1,0.2043
CC(=O)N1CC1C(N)=O,0.2403
O=CC(=O)C1CO1,0.157
C1CC(C1)(C(=O)C#N)O,0.1849
O=C(NC1CC1)C1CO1,0.258
c1cncc2c1onc2,0.2081
N=C1OC=NC(=O)O1,0.2232
NC1=NCC2OC12CO,0.2445
CC1C=CC(=O)N1C,0.2092
N=COC1(COC1)C#N,0.2711
C1CC(=NO)C(=O)C1,0.1655
c1cc(=O)c(cnc1)O,0.1501
CC(C)(O)C(O)CC=O,0.2237
CC(=O)C1NC1CO,0.2228
OC1CC1COC=N,0.2813
CC1OC(=NC1C)C#N,0.2179
CC1CC2C3OC12C=C3,0.2205
CC1(N)CC1(O)C#N,0.2534
OC1C2C3C(C=O)C2C13,0.2183
O=C1C2OC2C=C1C#N,0.1663
N#CC1C2NCC12C#N,0.2452
c1c(c([nH]n1)C#N)N,0.1897
NC1(C=CNC1=N)C#N,0.2025
C1NC1C12OC1C1OC21,0.2858
C#CCOC1CCC1,0.2858
COC1C(O)CC=C1C,0.2591
N=COC1C2OCOC12,0.2553
CNC(=[NH2+])[C-](C#C)C#N,0.1889
CC(O)C1C2CC1(C)O2,0.2983
C#CC#CCC(=O)C=O,0.1413
NC(=O)C12CC1(O)CN2,0.2254
CCC1OC2(C)COC12,0.3049
CN1CC2(C)C3OC2C13,0.2839
CC1(C)NC1(CO)C=O,0.216
CCN(CC=O)C=O,0.2127
CC12C3CC1C3OC2=N,0.2755
Cc1c2c(c[nH]1)CCC2,0.2321
O=C1NCC2NC12C#C,0.2412
COC(C)(C)C1(C)CN1,0.3052
c1c[nH]nc1C(=O)CO,0.2054
CN=c1cnoc(n1)O,0.1909
CC12C3C1C1=CC3C2C1,0.1186
CC(O)C1CC1C(C)O,0.3304
CCC1(NCC1N)C#N,0.273
O1C2C3C4C5C3C1C2N45,0.3173
CC12CC=CC3C1CN23,0.228
CC1OCCC1C(N)=O,0.2698
OC(C#N)C1=CC=NO1,0.2391
OC1(C=O)C2C3CN3C12,0.1914
C1CC(=O)CCC1C#N,0.2235
COC(CC#C)C#C,0.2883
N=C1NC2CNC12C#N,0.2404
OC12C3C4N3C1C24C=O,0.1829
OC12CCC3(O)CC1C23,0.3162
OC1CC2(CC12)N1CC1,0.2889
CC1CC11C2CC1(C)O2,0.311
CC(O)C1=NOC(=O)N1,0.2466
OC1CCCOCC=C1,0.2409
CC1CC(N1)(C#C)C#N,0.2498
N#CC12CC1CCCC2,0.311
C1NC11C2C3CC=C1C23,0.1729
CC1(C#C)C2CCN12,0.2745
OCC1CC(=O)C2CN12,0.22
N=C1OC(CC#N)C=C1,0.2145
COC1(C)C(N)C1C#N,0.266
O=C1C(C#N)C2CN12,0.2354
CC1N2C=NCC12C#C,0.2329
CC12C3CC4C(C13)N24,0.3025
CC(C)OCCCOC,0.3314
CC12OC(C1O)C2C#N,0.2848
C#CC1=NCC(=O)N1,0.2016
CCNC(=O)NC(=N)C,0.2432
Cc1cnn(c1OC)C,0.2484
CC1CN(C1)CC(=O)C,0.212
CC#Cc1cnco1,0.1995
COC1=NNC=CC1=N,0.1822
Cc1cc(oc1C)C,0.228
[NH3+]CCC#CC([O-])=O,0.2371
CCc1cnn(n1)C,0.2483
CC1C2CC1C1CC2O1,0.3116
OC12C=CC3CC1CC23,0.2481
CC1(CC1O)C(=O)C#C,0.2031
OC1C2C3C4CC2C1N34,0.3344
O=C1OC=NC1CC#C,0.2352
c1cnc(c(c1N)F)F,0.226
c1c(=O)[nH]nc(n1)CO,0.1671
c1cncoc1=O,0.1966
OCC1CCC2CC12O,0.3255
CC1C2OC3CC2C13C,0.3223
CNc1ccnn1C,0.2377
CCC1OC1(CO)C#N,0.2894
CCC(O)C(O)C#C,0.283
CC(=O)NC(=O)C(=N)N,0.1989
CCc1c(=O)[nH]ccn1,0.1749
C#C,0.3351
CN=C1NC2C(O)C2O1,0.2658
C1C=C(NC1=O)C(=O)N,0.1877
CC1=C(C)C(=N)ON=C1,0.1651
CCCNC(=O)C(C)O,0.276
c1c(c([nH]n1)C(=O)N)N,0.1757
OC12CC3(C1)NC(=O)C23,0.2459
CCCC1OC1CCC,0.3498
CC1C2CC1N=COC2,0.2677
C1C2CN1C1=C2OC=C1,0.215
CC1OC(C)C(=O)C1O,0.2205
CC1C2CC3(C)CC1C23,0.3364
CCC(C)(O)C(=O)OC,0.2639
OC12CC1(CC#N)NC2,0.2692
CN1CC11CCNC1=O,0.25
O=C(C#N)C1CCO1,0.1848
[NH3+]C(CC([O-])=O)C1CC1,0.2773
C1C2NC2C11CN=CO1,0.2647
CC1COC1CC(N)=O,0.2712
CC(=NO)C#CCOC,0.2028
CC1C2N3C(=O)C1C23C,0.2492
Cn1ccc(=O)cc1F,0.2051
OC1CC1C1CN2CC12,0.3026
CNc1[nH]cnc(=O)n1,0.212
CN1C(=O)CC11CC1O,0.266
O=C1CC2OC2C11CC1,0.2273
CCCn1c(ncn1)O,0.265
CC1N2CC1(C)C(=O)C2,0.2048
CCc1c([nH]nn1)C#C,0.2085
NC(CCC#N)C#N,0.2841
CC(C)(O)C(O)CC#N,0.3167
CC1=COC(O)=CC1=N,0.2005
O=C1CC2C3CCC1C23,0.2212
OC1CNC2=C1N=NO2,0.1725
Cc1cnc(cn1)C,0.1956
CC1C2CC(C)(C=O)N12,0.209
CCC1([NH3+])CC1C([O-])=O,0.1359
NC1C(C#C)C1C#N,0.2541
CC1CC2(CC#N)OC12,0.293
CCC12C=CC3CC1C23,0.237
OC1C2C1C1CC2C1=O,0.2293
OC1CC2NC12C1CN1,0.3108
NC(C#N)C(N)=O,0.2626
OC12CC(CC=C1)C=C2,0.2338
CC1(C2CC1C2)C(N)=O,0.2716
OC1C2CNC1C(=N)O2,0.2624
CC12CC3OC1C2C=C3,0.2368
OC1C=CC2CCC=C12,0.2443
CCC1(O)CC(C)C1,0.3204
O=C1CNC2CC(C2)O1,0.2325
CC(C#N)N(C)C=O,0.2703
COC1CC(=O)C1,0.2212
CCC(CC)C#C,0.3135
C#CC(=O)C#CCC#N,0.1901
CCn1ccnc1O,0.2504
OC12CC3OC1OC3C2,0.3127
OC(C#C)C1(CN1)C=O,0.2145
OC1(CN2CC1C2)C=O,0.1933
CN(C)C(=O)C1(C)CN1,0.2526
[O-]C(=O)C1C2C[NH+]1CC2,0.2309
CCC(C)OC(=N)C=O,0.1931
CC(CO)C1=NNC=C1,0.2661
CC1CC11OCC1O,0.2872
CC1(C)CN2CC12CO,0.3058
OC1C2C3CCC1C23O,0.2989
CN1C(C#N)C(N)C1=O,0.246
OC1C(C#N)C(O)C1=O,0.2078
C1CC2(C1)C1C3CC2N13,0.3122
COCC1C2CC1(O)C2,0.3277
CCC1CN1C(=O)NC,0.2887
O=C1NC2C(C12)N1CC1,0.2446
CCC(O)C(C)C(C)O,0.3211
CN=C1C=C(C)NN=N1,0.1609
O=C1CC2(CC2)C2CC12,0.2235
CCC(OC)C1(C)CO1,0.3267
C#CC12CCC3CC1C23,0.2845
CCCC#CC(=O)C,0.2084
CCC1C2CC(=O)C12C,0.2293
c1(c(nc([nH]1)O)O)O,0.2359
C1CN(CC=C1)C=O,0.2542
O=CC1CC(C1)C=O,0.2081
OC12C3CC(NC1=O)C23,0.2616
OC1COCOC1=O,0.2764
C1CNC1(C=O)C=O,0.1853
CC12C(O)C1CC2C#C,0.2853
C(C(=O)N)(C(=O)N)N,0.2334
c1nc(nnn1)C(=O)N,0.1567
c1(c(=O)nc([nH]n1)N)N,0.1936
CC1CC2(C)OC=NC12,0.2617
CC1CC2C3CC3OC12,0.3034
O=C1CC2CC11COC21,0.2282
[O-]C(=O)C12CC1C(=[NH2+])N2,0.1623
OC1CC2OCC1C2=O,0.2055
CC1C2COCC1O2,0.3163
CC12OC(C)(C1O)C2O,0.3055
CCc1c(cn[nH]1)C#N,0.2381
CC1=NCC(CO)CO1,0.2725
CC1CC(C=C1C)=NO,0.1913
CC1COC2CNC2=N1,0.2521
Cc1c(c(ncn1)C)N,0.1982
OC1C(CC#N)OC1=N,0.2833
C1C2NC2C2=CN=NN12,0.2449
CCC1(O)CC(CO)C1,0.3199
CC12CC3C1COCC23,0.3279
CC(=O)c1ccoc1N,0.1793
CCCC1(C)C(O)C1O,0.2827
N=COC1CCC1C=O,0.2241
C(C#N)OC(=O)C(=N)N,0.1939
CC12C3OC(C13)C2C#N,0.2672
N=C1OC=CN1CC=O,0.1664
CCC1C2CN2CC1O,0.2834
CC1C2CC3(O)CN1C23,0.2711
C(C(=O)C#N)NC=O,0.1649
C(CO)NC(=O)NC=N,0.2557
Cc1c(con1)C(C)C,0.2486
CNC(=O)N(C)C,0.2918
O=C1COC1C1CC1,0.2206
NC1=COC(=N)C=C1F,0.1556
Cc1c(c[nH]c1N)CO,0.2475
CCC1CC(C)C1CC,0.3473
CN=COCC1CC1,0.2728
CC1(O)C2CC1(O)C=C2,0.2395
CC1OC(=N)CNC1=O,0.2618
CC1(C)NC1C(O)C#C,0.2734
OCC(CC#C)OC=O,0.2733
CCC(O)C(O)C(C)C,0.313
COCC(C)C(C)(C)O,0.317
CC1(C)C2NCC12C#N,0.2508
O=C1CC2(NCC12)C#N,0.2145
CC12CN1C(=O)COC2,0.2287
C1C(N1C=O)(CO)CO,0.2495
OCC(O)COCC#N,0.2681
CCC1(O)CN2C(C)C12,0.2835
CC1C(O)C1(C)CCO,0.3066
CCCC1N2CC2C1=O,0.2187
CC1C=CC2N=COC12,0.2551
CC1OC(=O)C(N)C1O,0.274
NC(=O)C1CC=CCO1,0.258
CCC(=O)OC=N,0.2539
C1CC2C3OC2C13,0.3046
CC1(CC1)C(=NO)C#C,0.2049
Cc1c(nc(o1)C)C#C,0.2101
CCCc1n[nH]c(=O)o1,0.2473
N=C1CC2=C(N1)C=NO2,0.1926
Cc1c[nH]c(c1N)C,0.2396
C#Cc1cc(oc1N)N,0.2006
c1c(nco1)NC(=O)N,0.2205
CN=C1NC2(C)CC12O,0.2327
OC1C2C1C1OCC21,0.3043
COC12CCC1OC2=N,0.2693
CC#CC(=N)OC(C)=O,0.2239
CC1C2CC3(C)OC2C13,0.3203
CC1NC11C=CC2CC12,0.2352
CCNC(=O)C(C)(C)C,0.2736
CC([NH3+])COCC([O-])=O,0.2702
N=COC1COCC=C1,0.2537
CC1OC2(C)CC1(O)C2,0.3023
CC1CC(C)(O)C1(C)C,0.3193
CC(=O)COC(=O)N,0.2351
CNc1cnn(n1)C=O,0.1728
CN=C1OC(O)=NC=C1,0.1828
NC1=C(CN2CC12)C=O,0.1781
CCC(=O)CC(=O)CO,0.2091
CC1=CCC2OC3C2C13,0.2409
CC1C2C(C)C(C)C12C,0.3161
O=CC1CCC1C1CC1,0.2235
CC1COCC11CCO1,0.307
CCOCC(C)C,0.337
CN=C1COC(O1)C=O,0.2072
OCC1=CC2CN2C1=O,0.2016
COC(=O)C(O)C#C,0.2609
C#Cc1c([nH]nc1N)N,0.2201
CCNC(CC=O)C#N,0.1985
OC1C2NC1C2(O)C#C,0.2696
C1C2C3C=CC=CC2C13,0.1782
COC(C)C1=CNC=C1,0.2507
CC1=CCC(O)(CO)C1,0.2592
OCC12CCC1C1CC21,0.3011
C1CC(C1)NC(=O)N,0.2985
CCC1OCOC1=N,0.2883
c1coc2c1OCC2,0.2101
CNc1[nH]nc(n1)O,0.2492
OC12CC3C1N3C2C#C,0.2542
NC(=O)C1CC2CN12,0.262
OC1CC2N=COCC12,0.262
c1c(nc[nH]1)N,0.2241
CC1(C)C2C=CC1C2=O,0.2472
CC1C2(C)OC1(C)C=C2,0.2362
COC1COCC1=O,0.1968
CCOC1(C)CC1C=O,0.2271
COC12CC=CC1C2C,0.2451
CN1CC1(C)C(C)(C)C,0.298
CCC#CC1CCC1O,0.2856
CC12OC3CN4C1C2C34,0.2698
CC1(CO)C=CC2CC12,0.2488
NC1CCC2OC12C#N,0.2508
CC1CCCC(=O)C1,0.2243
C1C(CO1)N=C(C=O)N,0.1801
O=COC1CCCO1,0.2786
CC12CC3C(OCO1)C23,0.3232
NC1=NOC(=N)O1,0.2581
CCOc1c([nH]cn1)O,0.2172
CC1(O)CC2CC1(O)C2,0.3212
N=C1NCCOC1=O,0.1981
CC1C2C(CCO)CN12,0.2973
C1OC2C3CC1C2O3,0.3256
CC12CC(CC(=O)C1)O2,0.2232
O=CC12CCC1N=CO2,0.2127
CC#CC12CC(C1)O2,0.2566
CCC1C2N(C)C1C2=O,0.2475
CC#CC1C(C)C1(C)O,0.2734
CC12CC1COCC2,0.3265
CCNC(CC)C#N,0.2746
C1CC2(CC3NC3C2)O1,0.3088
CC#CC1CNC1=O,0.2645
C1C2CC3OC3CN12,0.3137
CN1C(=O)C2NC2C1=O,0.2271
CCOc1coc(n1)C,0.2163
C1CC11CC2CN3C2C13,0.3073
CC1(C)C2N1CC2(C)O,0.2899
CN=C1CC=CN1C=O,0.2033
CC1=CCC2C3CC2C13,0.2471
OC12CC3CC(CC13)C2,0.3329
CC(C)CC12CC(C1)C2,0.3649
CC1(C)CC11COC1=O,0.2753
CC1OCC1CCC#C,0.2963
c1c(c(c([nH]1)O)C=O)N,0.1628
OC1(C=O)C2CN2C1=N,0.198
OC1C2CNC(=O)NC12,0.2707
C(Cc1nnon1)C=O,0.1899
Cc1cocc1COC,0.2431
CC1CC2CC2CC1O,0.319
NC1=CC(=O)OCC1O,0.2047
COCCC1OCCO1,0.339
C#CCN1C2CCCC12,0.2721
CN=COC1CC2CC12,0.2708
CCCC1CC(=O)O1,0.2861
C1C(=NO)C=C(N1)C#N,0.1444
CCC12CC(C1O)C2=O,0.2331
CN(C=O)C(CO)CO,0.2631
c1coc2n1cnn2,0.227
CC1OC11CCC1=O,0.2044
CNC1CCCOC1=O,0.2329
CCC12CC3OC1C3N2,0.3
CC(C1CO1)C1COC1,0.3184
OC1(CC=O)C2CCC12,0.22
CN(C)C(C#N)C1CC1,0.2645
CC(C)(C)N(C)C(=O)N,0.2797
CC1=CC=C(F)OC1=N,0.1715
OC12C3OC3C1C2C=O,0.225
CC1C=C2COC2C1C,0.2411
CC(O)C1C2CN2C1=O,0.2326
Cc1c(nc(=O)on1)N,0.1862
C#CCCC1(CC1)C=O,0.2262
CC1CCC2(OC12)C#C,0.2773
OC1C2C3OC1(C#C)C23,0.2549
CC1OC(=O)C(=O)C1C,0.1715
N#CC1CC11CC2NC12,0.274
CC(C)c1ccncn1,0.2137
CC1C2CN3C2C3C1O,0.2828
OC1COC(=N)C2OC12,0.2553
CC(N1CC1)C(=O)C#N,0.1769
OC1CC=C(C1)C1CO1,0.2462
CCC(C)C1(CO)CO1,0.3406
Cc1[nH]nc(n1)N(C)C,0.2171
COCC1(O)CC(O)C1,0.323
c1c(c2c([nH]1)OCC2)O,0.2343
C(C(C=O)C=O)OC=O,0.2071
CC(C)C1(CO)CO1,0.3401
O=C1CC2CCC2N1,0.2766
CCc1c(onn1)C,0.2255
CCOC1CC(C1)C#N,0.2934
OCC12C3C4C(N14)C23O,0.2694
C1OC1C1=NC=CN=C1,0.1969
CCn1cc(cn1)NC,0.2132
C1C2CC1C2,0.4056
CC#CC(O)C(C)C=O,0.2247
COC(=O)C1CC(=O)O1,0.2672
CC1C(O)C=CC1=O,0.189
C(CO)N=COCC=O,0.2095
C1OC2CC1CCC2,0.3158
CC1NCC2=C1OC=N2,0.2215
OCC1=CNN=CC1=N,0.1761
CC(=O)C(O)CNC=O,0.216
CCOc1nc(co1)O,0.2348
CCCC1C2CCC12,0.3339
C1NC1C12CCC1N2,0.3148
C1CC1C1C2C3CN2C13,0.3137
CC(CO)C1OCC=C1,0.2485
C1OC2COC3CC12C3,0.3086
CC1COCOC2CC12,0.3207
O=C1C(C2CC2)C2CN12,0.2305
CC1OC11C2C3CN2C13,0.3033
C(C=O)c1c(nno1)N,0.1641
c1cnc(oc1=O)N,0.1892
CC12CC(N)C1(O2)C#N,0.2476
CCN1C(C)CC1C#N,0.2561
OCC1C2CCC1O2,0.3091
ON=C1COC2CC12,0.2374
C1C=CC=CC2NC12,0.1978
CCn1nc(nn1)NC,0.2072
CC12CC(C1O)C(=O)O2,0.2718
OC12CC3C=CC1OC23,0.237
CCC#CCC(C)OC,0.2953
COc1concc1=O,0.1771
OCC12COC1C1NC21,0.2884
CCCOC(=O)C(=N)N,0.2125
CC12CC1OC(=O)OC2,0.3048
CC(C)C1C2OC1C2C,0.319
CN(C=O)C(=O)OC=N,0.2385
COC1(C)CC(O)C1,0.3215
CC1CNC=C(C1)C=O,0.1885
C1NC11CC2=CCOC12,0.2316
N=C1COC(CC#C)O1,0.2805
CCN=C1OC=CC=N1,0.1622
c1c(c[nH]c1C#N)N,0.1835
CC1CC11OCCC1C,0.3031
NC(C#N)C#CC#N,0.2248
OC1C2C=CC3OC2C13,0.231
COC1CC2C1C2(C)C,0.3283
CCOCC(=O)C(=O)C,0.1575
OC12C=CC3OCC1C23,0.2321
CC1(CC#C)CC1C=O,0.2264
CC1C(O)C2CCOC12,0.2935
CCc1c[nH]cc1C#C,0.2207
C1=CC2C3C4C1C4N23,0.2364
CC1NCCNC1C#N,0.2599
CC#CC(C)C(N)C#N,0.2746
CNCc1nc(co1)N,0.21
CC12CC3(CN3)C1O2,0.3158
CCC#CC#CCC#C,0.2231
OC1CC2C3CC(C1)N23,0.2852
NC1=COC(=N)C(=O)N1,0.1692
CC1=CCC(O)C1C#C,0.2594
CC1CC(C#C)N2CC12,0.2774
N=C1OCCC=CCO1,0.2482
CC1=CC2CC1OCO2,0.2492
N#CC12CNC1CCO2,0.2652
O=C1COCC2OC12,0.2062
OC1CC2C1OCC2=O,0.2136
CCC1(CO)CCC=C1,0.2636
COC=NCC1NC1C,0.2607
ON=C1CNC1C=O,0.2053
CC12CC3(CC3)C1CO2,0.312
CC(CO)(CC#N)C#N,0.3071
CC(C#C)N1N=CN=N1,0.2549
O=CC12CC1C1OC1C2,0.2304
CC1(O)C2C(O)C2C1O,0.2978
CC1CC2(CC2)C1(C)O,0.3168
COC1C(CC1=O)C#N,0.1999
N=C1NC2=C(O1)C=NO2,0.1974
CC1(N)C(O)C1(O)C#N,0.2522
CC1CN2CC1C(=O)C2,0.2002
CC1CN2C3CC3(O)C12,0.2754
CCCCC(C=O)C=O,0.2029
CCCC(C)C(O)C#N,0.3095
CC1(O)CC=CCC=C1,0.2589
CC(C#N)C(CO)C#C,0.2969
CC12CC(CC1)(N2)C#N,0.2789
CC1C2C1C1(O)CC21C,0.2824
CC(O)COC1(C)CC1,0.3303
C1Cn2c1c(nn2)C=O,0.2032
CC(OCCCO)C#N,0.2903
CC(C)c1[nH]cc(n1)N,0.2207
NC1=C(C[NH3+])C=C([O-])O1,0.1682
OC1C2CC1OC(=O)N2,0.2967
OC1C2CC1(N2)C1CN1,0.3044
c1cc(cc(c1)N)CO,0.204
NC1=C(OC=N)C=NN1,0.2268
O=C1CCC=CC11CN1,0.2157
CN1CC1(CO)C=O,0.2091
C1C2C3OC4C3N2CC14,0.2959
NC1C(O)C(N)C1C#N,0.26
CC(C)(C)C1NCC1=O,0.217
C1CC(C1)C2CC(=O)C2,0.2227
CC12NC1C1OC21C#C,0.2327
C1CC(=O)CCOC1,0.2243
CC1=CC(OC1)C(N)=O,0.2351
CC1=CC(=O)CCOC1,0.1887
CC12CC1(O)CN1CC21,0.2953
CC1C2CN1C2(C)C#N,0.2603
CC(C#N)C(C)(C)O,0.3152
CC1N2CCC2C11CO1,0.2872
CCC1OC2CC12C=O,0.2185
OC1C2C3C4C2CC1N34,0.3188
CCC1C=CC(=O)C1C,0.1912
c1c(c(c(nn1)O)N)O,0.1997
CC#CC1=CCCC1,0.2067
CCC#CC1CC(O)C1,0.2921
CC12OC1C1(CO)CC21,0.2918
c1coc(=NCC#N)o1,0.2389
OCCC1CC2CN2C1,0.2998
C1C(=O)CN=C1NC=O,0.2031
OC12CC1CC21COC1,0.3007
CCC(C)C1=CN=NN1,0.2523
CC1CC1(O)CC(C)=O,0.2158
Cc1ccc([nH]1)OC=O,0.2012
ON=C1CCC(O)C1=O,0.1666
CCC#CC(C)CCO,0.2989
FC1=CC(=N)N=C(F)N1,0.2111
CC1CC(C)C(=C1)C#C,0.2081
CC1C2CCC3OC3C12,0.3285
CC12CC(O)C(=O)C1O2,0.2069
C1C=CC=CCN1C=O,0.1905
CC1OC1CC(=O)C#N,0.1897
C(CC(CO)CO)C#N,0.2914
CCCC12CCC1C2O,0.3153
OC1(C#N)C2NC1C2=O,0.2316
OC1COC(=O)C11CO1,0.2506
[O-]C(=O)CC1CN1C=[NH2+],0.2202
CC(CCOC=O)C=O,0.2264
CN(C)C1(COC1)CO,0.2899
ON=C1CNC1C#N,0.2369
COc1cn[nH]n1,0.2343
CCC1OC11C2CC1C2,0.3488
COCC#CC(F)(F)F,0.2691
c1cc(=O)ocnc1=O,0.1843
CC#CC1C(C)CC1=O,0.2099
CC12NC1CC2C#C,0.2777
CC(C)CC1CN=CO1,0.2714
CC(C)CCC1(C)CO1,0.3416
OC(CC(=O)C#N)C#C,0.194
CNc1ccc(cc1)F,0.1899
COC(C)C#CC(C)O,0.2855
CC12C=CCC1C1NC21,0.2552
C1CC2(C1)OCC1NC21,0.3081
OCCN1C2C3NC2C13,0.2803
NC1=C(C=O)C(O)CC1,0.1813
CN1CCOCOC1=O,0.2783
C#CC#CCC(=O)N,0.2283
c1c(onc1NC=O)N,0.2103
O=CCC(CC#N)C#N,0.2247
CC(C)C(C)(C)OC,0.3217
CC(OC(N)=O)C#N,0.3016
CC1(O)COC(=O)C1,0.2784
COC=NCC1CC1C,0.268
CC1CC([NH+]1C)C([O-])=O,0.2555
CC1CC2C(O)C12C#C,0.2661
COC1=NCCN=CN1,0.2353
CC(NCC=O)C=O,0.2092
CC1OC(=O)OC2CC12,0.3095
CCCC1CC1(C)O,0.3244
C1CC12COC23COC3,0.3097
N#CC12CC1CC=CC2,0.2658
C(C(CO)CO)NC=O,0.2827
C#CC12CC(C1)N=CO2,0.2572
CC(=O)CC1CN2CC12,0.2147
CC12CCCC3C1OC23,0.3039
CC1CC2C(O)C2C=C1,0.2363
OC12CC(C=CC1)C2=O,0.2144
CC12OC3C(O)C1C23O,0.2981
CC1C2OC(C)(CO)C12,0.3068
CC1(O)COC1(C)C#N,0.2829
c1c(nno1)NC=O,0.2057
c1c[nH]c2c1OCC2=O,0.1834
CC1=CC=COC1=N,0.1687
CN(CCO)C(=O)C=O,0.1686
OC1(CC2NC12)C1CN1,0.3061
N#CCC(C#N)C1CO1,0.3082
CCCCc1cnn[nH]1,0.252
CCCC1OCC1(C)C,0.3177
C#CC1(CCCO1)C#C,0.2672
CC(=O)C1NC1CCO,0.2216
c1c(nc(o1)C=O)CO,0.1817
OC1C=CC2C3CC12C3,0.2439
OCCC1C2CCOC12,0.3143
N#CC1CN=C2CCN12,0.2382
N#CC1N=COC2CC12,0.2711
CN(CC=O)CC#N,0.2116
C1CC11C2C3CC1C23,0.3362
C1C2CCC3CCC2C13,0.3466
Cn1c(cnc1O)C#C,0.1984
CC1=CCCC(C)(O)C1,0.2618
CC12CC3CC3(O)C1N2,0.3146
CC1C2C1C1C2C1(C)C,0.2768
CNC1C(N)C1(N)C#N,0.2583
CC1(C=CC(O1)(C)C)C,0.2494
CCC1C(O)C1(C)C,0.3047
CC1(CNC(=O)C=C1)C,0.2077
COC(=O)N1CC1C#N,0.2797
N#CC1C2CC1C=CC2,0.2488
COc1c[nH]c(=O)[nH]1,0.2371
c1coccc(=O)c1=O,0.1626
O=C1CNC1(C#C)C#N,0.2098
C1C2OC3CN4C2C4C13,0.307
CC1=NC=C(OC=N)O1,0.2293
CC1(O)C2CC1(O)CC2,0.3186
OC1CC2C1C=CC2=O,0.1887
COC1OCCCC=C1,0.2551
CN1C2C=CC1C2O,0.2086
CC(O)C(C)C1CCC1,0.3266
Cc1cc([nH]n1)COC,0.256
O=C(CC1CO1)C1CC1,0.2333
C1C2OCC3=C2C1OC3,0.1965
CC1OC1C1CC1O,0.3248
c1c2c(c[nH]1)OCCO2,0.2388
C(=O)c1c(oc(=O)[nH]1)O,0.175
CC1(CC#N)OC1C#C,0.2769
c1nc2c(onc2o1)N,0.1906
OCCC(O)C(F)(F)F,0.3406
CC(=O)CN1CC1,0.2285
Cc1c(nc([nH]1)O)C,0.2456
CN1C=NC=C1C1CO1,0.2445
CCN1C(C)C2OCC12,0.2851
O=CC1=CC2CCN2C1,0.162
O=CN1CC2NC2C=C1,0.2041
N=C1[N-]C(NC=[NH2+])=NO1,0.0692
CC1(CO1)C1=NOC=C1,0.2516
Cc1c(ncn1C)CO,0.239
CC#CC12OC3C1CC23,0.2496
CCn1ccc(n1)O,0.2413
Cc1c(cnoc1=O)N,0.1731
CC(=O)C1(O)CN2CC12,0.2116
C1CC2CCOC(C1)O2,0.3178
CCC(=O)c1c[nH]nc1,0.2101
C1c2c(n[nH]n2)OCO1,0.2295
c1c(nn[nH]1)C2(CC2)O,0.2354
CC12CN1CC=C2C=O,0.1692
CC1CCC1C#CC#N,0.2374
O=C1C2C3C4C1C2CN34,0.2427
CC1NC1(C)C=O,0.2229
O=CC1COC1C1CN1,0.2157
OC1CCC2CC(C1)O2,0.3151
OCC1C2C3CCC1N23,0.2877
CC#CC1=CCC2NC12,0.2002
C1OC1C1OCCCO1,0.3494
OC1C2C3N2C1C31CO1,0.318
NC1=CC(=N)C=C(O)O1,0.2046
O=CC1(CCO1)C1CC1,0.2157
O=C1NC2CC1C1CC21,0.2587
CC1(CN1)C1CN=CO1,0.2696
CC1(O)C2CC3OC1C23,0.298
CC1=CC(=NN1)C1CO1,0.2466
CN=C1OC=CC=C1,0.1633
O=C1CCN2C3CC3C12,0.1917
CC#CC12CC1NC2=O,0.2404
CC(=O)NC12CC1OC2,0.2529
CC1(OC1C1CC1)C#C,0.2812
C1C2COC3CC12CO3,0.3365
O=C1C2C3CC4C3N2C14,0.2041
CNCC(C)(OC)C#N,0.2529
Cc1cc(n[nH]1)C#C,0.2246
CC1OC2CC3CCC123,0.3092
CC1OCC(=NO)C1C,0.2503
CC1=CC2C3C2C(=O)C13,0.2046
CCN=CNC(=O)NC,0.2496
CC1(C)CCC2CC12,0.3436
Cc1cn(nc1C#C)C,0.2183
CC1C2OCOC=NC12,0.2477
N=C1NC(=O)N=CN=C1,0.1668
CCC1CC(O)C(=O)O1,0.2744
C(Cc1n[nH]nn1)CO,0.2443
C1C2C3C4COCC24N13,0.304
CCC(O)C1CC(O)C1,0.3227
CCC1=C(CC(=O)C1)C,0.2217
CC1C2CN2C1C#N,0.2637
CC1OC2CC(C2)C=C1,0.248
OCCC1(CC#C)CN1,0.2907
CC1OC=NCC11CO1,0.2687
COc1c(cc([nH]1)O)O,0.2272
COC12CN(C)C1C2O,0.2615
c1c2n(nn1)CCCN2,0.2259
C#CC1(OCCO1)CO,0.2971
CCC#CC(=O)N1CC1,0.2172
c1cncnc1NC=N,0.201
OC12CC3CC1C1C2N31,0.3007
CN=C(CO)NCC#C,0.2512
CC(C)C1NC1C(N)=O,0.2631
CC1OC(C)C2(CC2)O1,0.3331
Cc1c(c([nH]n1)NC)N,0.2363
C1CC12C(=O)C=CCO2,0.18
CC1(CC#C)CC2OC12,0.3026
O=CC1=C2CC3C2N3C1,0.1386
NC1=NN2CC(O)C2=C1,0.2185
CCC(=O)CC1CCO1,0.2293
Cc1cn(c(c1C)O)C,0.2305
N#CC1C2CCCC1O2,0.2768
ON=C1CCC11CN1,0.226
CC12CCOC1C1CN21,0.3014
CCC12CC(C=C1)C2=O,0.2452
Cc1cc(c[nH]1)NC,0.2224
c1cnc(cn1)N(=O)=O,0.1756
OCCCC#CC1CN1,0.2698
CN1C=C(O)C(=N)C=N1,0.1655
CC(CO)(CO)C#C,0.296
C1CC2COC1CCO2,0.3144
Cc1c(nc([nH]1)OC)N,0.2251
C#CC1COCCCO1,0.2827
CC1N=CN(C=O)C1=O,0.2187
OCC1C2OC1C1OC21,0.3067
CCNC(C#N)C(C)=O,0.2043
CC1(C)CC2(CN2)CO1,0.317
CC(=N)OC(=O)C#N,0.2284
CC12CC3OC1C2C3=O,0.2071
COC1C2C(O)CC12C,0.3219
CC12CC(N1)C2(O)C#C,0.284
CC1CC(=CC1=O)C#N,0.1666
O=C1OC2(CC2)C2NC12,0.2487
N=C1CCC2OCC2O1,0.282
CC12CC1N1C=CC=C21,0.2206
CN1C2C3(CO3)CC12C,0.316
c1c(cnc(c1N)O)O,0.1832
CC1C2COC12C1CO1,0.2935
ON=C1CC2(O)CC12O,0.2346
OC1C(O)C2CCCC12,0.2975
CC1C2NC2C1(O)C#N,0.279
CC1CCCN(C)C1=O,0.2629
CC(C)(c1[nH]ccn1)O,0.2515
C1C2C3CC1OCCN23,0.3059
CC(=O)NC1(CCC1)C,0.2726
O=C1OCC2CC12C#C,0.2605
CC1C2CC(=O)C1C2C,0.226
COC1=COC(=N)N1C,0.2368
OC1(COCC1=O)C#C,0.2033
CNC(C=O)(C=O)C=O,0.1732
OC1C=CC2=CNN=C12,0.1973
CC(C)C1(CCO1)C#C,0.2791
CC1CC2OC(=N)C12C,0.2862
NC1=C(F)N=NNC1=N,0.1575
CC#CC1CC=CC1,0.2648
O=C1C2C3OC1C23C#C,0.219
OC1C2CC2(O)C1C#N,0.2817
CCC([NH3+])C#CC([O-])=O,0.2212
[NH3+]C1(CC=CC1)C([O-])=O,0.2581
CC1OC2C(CC#N)C12,0.2912
O=C1CNC1C1CCC1,0.2158
CC(C)C(O)CCC=O,0.2295
N=C1CC2CC2N1C=O,0.2242
C#CC1(CC2CC2)CO1,0.2842
CC1C2NC2(C)C=C1C,0.2437
CC12CC(CCOC1)O2,0.323
CC(CO)C(C)C(C)=O,0.2298
CC1C2OC(C)C12C=O,0.2219
NC(=O)C(O)COC=N,0.2684
CNC(=O)CCCC#C,0.2769
CC1CC(OC=O)C1=O,0.2099
CC1CCN2C(C#N)C12,0.2618
CC12CC=CC3C(O1)C23,0.2394
OCC1N2CCC12CO,0.3036
c1cnccc1NC=O,0.2164
OC12CN3C1CC=CC23,0.2371
CC1CNC=CC(=N)O1,0.195
C1NC1C1NC11CCC1,0.309
C1C(CN1)(C=O)C#N,0.2007
CC1CCCC(=O)C=C1,0.1891
COC=NCC(O)C=O,0.2044
COC12CC1OC2C=O,0.2125
OCC(=O)C1CC=CC1,0.2239
CNC1(CNC1)C#N,0.2626
CC#CC(=NC)OC=O,0.219
CN1CC11CC(O)C1O,0.3182
CC(C)CC1CC1C,0.3452
COC1(C)COCC1=O,0.1963
CNCc1nc(no1)N,0.2244
CN=CNC(=O)NC=N,0.229
C1C2C3OCC3N=CN12,0.2462
CC1(C)CCC11CC1O,0.3228
CC12OC1(C)C(=O)C=C2,0.1708
CNC(=O)c1cocn1,0.2252
CC1C2C(=O)OC12C,0.2742
C#Cc1c[nH]ccc1=O,0.1818
CC(O)C1(CC1)C=O,0.227
CC(=O)C12CC(N1)C2O,0.2166
COC1C2CN(C=O)C12,0.2606
COC1C2COC1C2O,0.2863
CN=C(C)OCC(C)O,0.2783
C#CCOC(C#N)C#N,0.2431
COC(C)C1=NOC=N1,0.2316
CCC(=O)NC(C)CO,0.2763
CC(=O)NCC1(CC1)C,0.2769
CC1(C2CO2)C2CCC12,0.3374
OCCC1OC1CCO,0.3401
[NH3+]CC#CCC([O-])=O,0.1903
COCC12CN3CC1C23,0.2988
CC1(C)C(O)C1(C)C#N,0.2938
c1c2c(no1)CNC2,0.2304
Cc1cc2c(o1)CCO2,0.206
CC12CC3OC1(C#N)C23,0.2454
CCC1(CCC1)COC,0.3292
N#CC1=CC2CC2C1,0.2074
OC(CCC1CO1)C=O,0.228
CC(C)C(N)C(F)(F)F,0.3275
NC1C=CC(O)C1C#N,0.2443
Cc1cc(=O)cno1,0.1828
CC1=C(N)N=NOC1=O,0.1607
OCC1CC(=O)CO1,0.2206
CC1C2(C)CC1(C)C=C2,0.239
Cc1c2c(on1)OCO2,0.2076
COC(C=O)C(C)O,0.2132
CC#CC(=O)NCCO,0.2347
CC12C3CC(O)C1OC23,0.2863
CC12C3OC(C13)C2C#C,0.2683
CC1CC(C#C)C(C)O1,0.2965
N#CC1NC1(C#N)C#N,0.2609
O=CC1CC(O1)C#C,0.2146
C(CC#CC=O)C=O,0.1986
CN1CC1(C)C(=O)CO,0.2173
c1c(nn[nH]1)N2CCC2,0.2037
C1CC(OC1)(CO)CO,0.3101
CC(=O)OC1CC1(C)O,0.2731
C1CC(C1)C12CC(C1)C2,0.3633
CC#CC#CC(C)C#C,0.2247
CC1OCCN2CC12,0.3076
C1C2C1C1CCCC21,0.3215
CCOC1CC2C1N2C,0.3153
COC1C(C#N)C1C#N,0.2743
C#CC1C2COCC12,0.2904
C#Cc1ccnc(n1)F,0.1985
N#CC12C3CC1NC2C3,0.2533
O=CC1N=CNC1C#N,0.2113
CCOC1CC1C#N,0.2901
CN1C(=N)ON=C1C#C,0.178
CCN1CC2CC12C#N,0.2397
CC1CC2OC(O1)C=C2,0.2516
CC1CC=C(CCO)C1,0.2573
CC12NC1C1NC1C=C2,0.2381
c1cc(oc1N)N(=O)=O,0.1527
Cc1c(non1)C2CC2,0.2328
CC(C)Oc1cnc[nH]1,0.2494
OC1(CC#N)CCOC1,0.2763
CN=C1NN=NNC1=N,0.1998
N=COCC1=CON=C1,0.2478
CCC(O)C(CC)C#N,0.3082
CCOCC1(CO)CO1,0.3219
N=C1OC(=O)CC11CN1,0.2453
CC(C)C(C)C(O)C#C,0.2939
CC1(O)C2NC2C1=O,0.2126
CC(=O)CN(C=O)C=O,0.2084
CCC1(C)CNC(=O)C1,0.274
CC1CCC=CC2OC12,0.2371
CC1(NC1CO)C=O,0.2274
CC1(CC2(C1)CCO2)C,0.3107
CCC12CN1C1C(O)C21,0.28
COC12CC3CC1C2O3,0.3099
CC1(O)CN2CC1(O)C2,0.2819
C1OC2C3C=CC12C=C3,0.2142
CC12CNC1C2(N)C#N,0.2485
CCC12CC(C)(C1)C2=O,0.2472
CC1COCC(C)C1=O,0.2247
OC1CC(O)C(=O)C1=O,0.1409
O=C1NCC2C3CC2C13,0.2629
CC1(CO)OC(=N)C1N,0.2656
CCN=C1OCC11CO1,0.2602
COC12C(C)C1OC2C,0.3054
CC1OC1C1=NC=CN1,0.2393
CCC(C)(C)C(F)(F)F,0.4051
CCC1(O)C(O)C1C#N,0.2945
C1C2CC11N=COC1O2,0.2553
O=CC1C(C#N)N1C=O,0.2001
CC1C(O)C=C(C)C1O,0.2555
CC(=NC)OCC=O,0.2255
CC1C2CC(C)CC1O2,0.3076
C1OC11CN2C3CC1C23,0.3264
CC(O)C1COCC1O,0.3034
CC12CC(O)C(CO1)O2,0.3142
CCCC(CCC)CO,0.3398
OC1C2C1C(=O)CC2O,0.2241
CNC(=O)c1c[nH]nc1,0.2403
CCC1(C)NCC1=NO,0.2353
C#CC1C2CC(C#C)N12,0.2508
CC1C(=O)C2OC12C=O,0.1911
CC1=CCC23CCC12N3,0.2186
C1CC(C1)C#N,0.3367
CC(O)C1OCC1O,0.285
CCc1coc(n1)O,0.2482
C1C=CC23C4C2N2C4C132,0.2059
CC1NC(=O)C=C1CO,0.2167
C#Cc1cc(co1)CO,0.195
CCCC(C=O)C#N,0.2253
c1c(c(=O)[nH]c(n1)F)N,0.1767
O=CC1OC2CC(C2)O1,0.2153
O=C1NC=C2C3NC3C12,0.1941
CCCC1C2OC(=N)C12,0.2775
N=C1NCC2CC2C1=O,0.1851
CC(=NO)C12CC(C1)O2,0.2323
CN=C1NC2CC2C1=O,0.1841
CCC1CCC1(C)OC,0.3255
O=CC1C2NC2C11CN1,0.2082
CCC(C)CCCC=O,0.2289
CC1CC(C)C(=C1)C#N,0.2188
CC(=O)C(C#C)N1CC1,0.2162
CC1(CN1)C1(CO1)C=O,0.2071
CCC12CCC1C1OC21,0.3219
c1coc2c1onc2N,0.2078
OCC1COC2C(O)C12,0.31
OCC1C(O)C1OC=O,0.25
CNC(=O)C1CCC1C,0.2702
OC12CC1C(=O)C1OC21,0.2038
CCC#CC(C)CC=O,0.2187
CN1C(C=O)C11CCC1,0.1965
COC=NC(C)C=O,0.2201
CN1CCCOC1=O,0.2949
c1c(nco1)C2COC2,0.245
O=CC1CC2(OC12)C=O,0.1986
CC1=NCC2(O1)CC2,0.2607
CC1(O)C=CC2NC12,0.2417
CCCCC1OCC1C,0.3249
CC1=CC(=O)NCCC1,0.2123
CCC(O)C#CC1CN1,0.2604
CC1OCCC2NC12C,0.3076
O=COCC1CCC=C1,0.2547
C#CC1CCO1,0.274
CC12NC3C=CC1C23O,0.2225
CC(O)CNC(=O)CO,0.276
CN1CCCOCC1=O,0.2524
CC(O)CC(C)CO,0.3276
N=C1OC2=C(O1)N=NO2,0.136
CCC(=NO)C#CC=O,0.1715
N=CN1CC(=O)NC1=N,0.2263
CC(=O)C1CC2OC12,0.2236
CCNC(=O)C(C)C=O,0.205
CN=C1C(=CC(=O)O1)N,0.1817
CC1CC11CCC1(C)O,0.3171
C#CC12CC3CCC1N23,0.255
CCC1CCC(O)C=C1,0.259
NC1(CC1C1CO1)C#N,0.2883
OC1CC23CCC2CC13,0.3117
CC1=CC=C(O)C(=N)O1,0.1651
c1nc([nH]n1)N2CCC2,0.2431
CC1CC(CO)CO1,0.323
CCC12NC1C=CC2O,0.2346
CC1(OC(=O)C1O)C#C,0.2528
CC1CCC2CC2(O)C1,0.3148
OC1C2CC1CC(=O)C2,0.2182
COCC1(CC1O)C#C,0.2703
CC(C)N1C=NOC1=N,0.2234
c1c(c(no1)OC=O)N,0.2028
c1cnc(=O)cnc1N,0.1614
CC1=CC(O)C2(C)OC12,0.2378
CC#CC#CC(C)O,0.2203
C1C(CO1)C(=O)NC=O,0.2128
CCC#CCCC#N,0.2851
CC1NC1(CC#C)C#C,0.2741
O=C1CC2NC2C2NC12,0.2158
OCC(CC1C[NH2+]1)=N[O-],0.1463
CC1(CC(N1)C#N)C#N,0.2636
N#CC1CC=CC11CO1,0.2522
O=CC1C2C3CC(C3)N12,0.2038
CC1C2NC(=NC12)C#N,0.1942
OCC1OC11CC2CC12,0.3281
O=C1NC=NC1C1CN1,0.2141
CCC1OC1C1COC1,0.3283
C1CC23CC4OC2C4N13,0.2976
CCC12OC(=N)C1C2C,0.2769
C#Cc1cnoc1C=O,0.1719
CCC(CC)C(C)O,0.3296
CC1=CCC=CC2CC12,0.2315
N#CC1CC2COC2C1,0.2874
COC1CN(C1)C1CC1,0.2951
CC1CCC(O)CC=C1,0.2595
CC1CC2COC12C#N,0.2696
Cn1c(cnn1)NC=O,0.2134
C(c1c(non1)C#N)N,0.1908
CC(=O)CC(C)(C)O,0.2264
CC1CC2OCC2CO1,0.3145
CCCC(=O)C1(C)CO1,0.2231
C#CC1CCOCC=C1,0.2564
CC1COC(C)C(O)C1,0.3079
CN1C(=O)CCN=C1N,0.227
C#CC1(CO1)C1CO1,0.2815
CC12CC3C4OC1C4C23,0.2992
C1CNCC(=O)C=C1N,0.1817
OC1(COC1=O)C#N,0.2499
CC(C)CO,0.3418
CC1OC2(CC2)C11CO1,0.309
CC1(O)CCN(C1)C=O,0.2654
C1OC2OC3C4OC13C24,0.2928
CCCc1c[nH]c(=O)[nH]1,0.232
COC1OCC2OC12C,0.3339
OC12CC1(O)C(=O)CC2,0.2148
OCC1CCN2CC12,0.3028
OC1=C(F)N=CC(=N)O1,0.1442
C#CC1CN(C1)CC#N,0.2588
N=C1CNCC(O1)C#C,0.2587
CC1CC=C2C3NC3C12,0.237
c1cc(cnc1)CO,0.2303
N=C1ON=CC=NC1=N,0.1699
CC1NC11CN2CC12C,0.2887
C1C2C3CCCCC2C13,0.3668
CC1(CCOCC1)OC,0.316
OC12CC1OC1CC1C2,0.2975
c1(=O)c(nonc1F)N,0.1576
CCc1ncc(nn1)C,0.1636
CC12CN3C(CC13)CO2,0.2994
CC(O)CC1CNC1=O,0.2814
NC1(C#N)C2CCC12,0.2969
CC1NC1C1=CNC=C1,0.2458
CCCC1C2CCC12O,0.3232
CC#Cc1ccoc1,0.2142
CC(C1CC1C)C(C)=O,0.2283
CN=c1[nH]nnn1C,0.1952
N#CC1NC2CN3C2C13,0.2684
c1cnoc1C2COC2,0.2352
NC(=O)C1C=CCC1=O,0.2096
c1cnc(cn1)C2CC2,0.2001
C(=N)Nc1c(nno1)N,0.1951
CC1OC(C)(C)C=C1C,0.2504
CCC1OC11CC2NC12,0.3048
c1cc-2nconc2c1,0.1335
CC1=CC(=N)N=NN1,0.1693
CC12CC3C(CC13C)C2,0.3435
OC12CC1C1OC(=N)C21,0.2759
CCC12COC1C1CN21,0.2798
CCOC1CC1NC=O,0.2709
CCOc1c(cno1)C,0.2299
O=C1C2C3CCC1OC23,0.2084
OCC(C=O)C1CCC1,0.2259
C#CC1OC2CCC=C12,0.2422
CCCOC(C)C1CN1,0.3169
CC1C2CCCC12C#N,0.306
Cn1c(ncn1)NC=N,0.222
COCc1c[nH]c(n1)O,0.2545
O1C2C3C=CC4C1C4C23,0.2226
CC12CN1C1COC21,0.2843
CC(C)(CO)C1CC1O,0.3253
N#CC1COC11CCC1,0.2775
CC12CCCC1(O2)C#C,0.2747
C1C2C3C4OC(CN23)C14,0.293
CC1N=COC1CC=O,0.2232
OC1CC2C=CC1C=C2,0.2379
CCC1C(C)C11CCC1,0.3283
CCC1(COC)CO1,0.3347
COC(=O)C(C)CC#C,0.2721
CC([NH3+])C(C)CC([O-])=O,0.2734
O=CC1COC2CC2N1,0.1849
CC(C)C1(C)COC1C,0.3136
c1cc(=O)[nH]c(c1O)O,0.157
CC1OC(CC#N)C1O,0.2964
CC12OC(C=C1)C2(C)C,0.2314
Cc1c(cnn1C)NC,0.2146
CN(C)c1cn[nH]c1O,0.2508
CC(=O)C(=O)CN1CC1,0.1566
CCC1CCC2CC1C2,0.355
CC1CC(C=O)C11CO1,0.2227
CN=C(C(=O)N)OC=O,0.1927
CC1OCC=C1,0.2484
CCN=c1oc(no1)O,0.2595
O=C1COC11CC2CC12,0.2092
CC(C)c1cnc(o1)N,0.2319
CC(CO)(CO)COC,0.3045
CC(O)C1=CCC2OC12,0.2414
OC1CC2OC11COC21,0.2693
CN1C2C1C1C2OC1=N,0.258
CC1CC=CCC(=O)C1,0.2157
CC1(C)C(O)C2CN12,0.2975
C#CC(=O)c1c[nH]cn1,0.1859
N#CCC1C2CCCC12,0.3175
OC1(CC=O)CNC1=O,0.1966
O=C1NC(C#C)C2NC12,0.2554
C(CO)NC(=N)C=O,0.17
c1nc(no1)OCC#N,0.2529
O=C1OCCCC2NC12,0.2518
Cn1cc(nc1)COC,0.2493
CCCc1cncnc1,0.21
N=C1OC(CC1=O)C=O,0.1891
CC1OCC(C)=C1,0.2494
C1CN1C12C3C4C1N4C23,0.2666
CCC(=O)CNC=O,0.2207
CCCCCCC#C,0.3165
C(C1CN1)N1C=CN=C1,0.2527
C(C#N)OC(=O)C(=O)N,0.2033
C1CC2C1C21CN=CO1,0.2572
OC1CC2CCC12O,0.3015
NC1C(NC1C#N)C#N,0.2515
NC1=NCCC(=O)C1O,0.2157
CN1CC=CN(C1=O)C,0.2164
CC1CCC(C=O)C1C,0.2216
C#CCOC(=O)CC#N,0.2742
OC12C3CC11CCC2N31,0.3164
OC1CCC11C2CCN12,0.2954
CC1=CCC(=O)C1=NO,0.1649
O=CC1(CCC1=O)C#C,0.1911
CC1CC1(C#C)C1CO1,0.2905
N=C1CCCC(=O)CO1,0.2177
CC12CC1(CO)OCC2,0.3123
CC1(C)OC(=N)N2CC12,0.2839
N#CC1NCC2CC1N2,0.2569
CC12CC1(OC2=N)C#N,0.2565
CCC(CCO)C#N,0.3068
OCC#CC1CC1C=O,0.221
CC1OCC(O)C11CN1,0.3077
C#CC1OCC2NC12,0.283
OC12CCC(C1)OC2,0.3042
CC1C2(C)CC1(C2)C=O,0.2175
O=C1C2CCC(C2)C1=O,0.1461
NC1=C2C(O)CN2C=N1,0.2176
CC(C)(OC=N)CC=O,0.2237
CC1(OCC2OC12)C#C,0.2944
CC12C3CC(NC1=O)C23,0.259
OC1C2C3CC2C13C=O,0.2114
CC1OCC(C)=CC1=O,0.1793
C#CCc1cc([nH]n1)O,0.2538
OC(C=O)C(O)C#N,0.236
OC12C3OC1C1NC3C21,0.2611
OCC1(CC1O)N1CC1,0.2809
CC12CC1C1NC(=O)C21,0.2592
CC(C)(C)C1CC2OC12,0.3186
CC(C)NC(=O)C(C)O,0.276
OCCN1CC1C1CO1,0.317
CC1CC2CC1N2C=O,0.258
CC1CC2(C1)COC=N2,0.2647
CNC1=CC(=N)N=NO1,0.2259
CC1CC(=O)C(C)=C1,0.1969
C1CCOC(OC1)CO,0.323
OCC1C2CC1(O)C2,0.3183
CC(O)C1C2C3OC3C12,0.2871
[O-]C(=O)C1C2C[NH2+]CC12,0.2652
COC12CCC(O1)C=C2,0.2563
OC1(CC1)C1C2CC1C2,0.3094
CC1CC1C(O)C#N,0.3042
NC1=NCC2(CN2)C1=O,0.1758
CC1CC2(CC2)C1(C)C,0.3377
OCC12C3CC1CN23,0.3125
OC12CC(C1)C1CC2O1,0.3159
OC1CC=CC11CO1,0.2492
CCC1(C)CC1(C)C#N,0.3105
CC1CC(=O)C(C)C1C,0.2215
Cc1cc(ncc1C)C,0.224
CC(=O)C1CCC11CN1,0.2154
C1OC2C3C4OC3C1C24,0.3154
C#CCCN1CC(C1)O,0.2813
C1COCCC1=NO,0.2457
N=COCC1=NON=C1,0.2297
CC1=CCC(CO)CC1,0.2609
c1c([nH]c(n1)O)C#N,0.2075
CC1NC11CC(=O)C=C1,0.1858
OC1C=CC2OC(=N)C12,0.2527
OC1C2CC1N2CC=O,0.2103
CC1(CCCCCO1)C,0.3176
CC1CC1C1(C)COC1,0.3121
N=C1C=NC=NN1C=O,0.1473
C1OC2C1C2C1COC1,0.3118
CCC1COC1(C)CO,0.3172
CC1=CC2(CC2C1)C=O,0.2163
CC1(CC1)c2cn[nH]n2,0.2375
CCC1CC(O1)C#C,0.2767
C1N2C3C4=CCOC13C24,0.1763
CC1CC2(CC2)CC1C,0.3375
CCC1(C)C(O)CC1O,0.3057
C#CC1C2CCCC1O2,0.2788
CCC12CC3C1C3(C)O2,0.3034
CN1CC2OCC1C=C2,0.2138
COCC(OC)C#CC,0.2857
CC1CCN=C2OCC12,0.2701
CC(CC#N)C1CC1C,0.3178
ON=C1COCC1C=O,0.2138
OCC1CCOC1=N,0.2688
CC1(C)NC1C(F)(F)F,0.3252
CC1=C(NC(=O)C1=O)C,0.1486
C1OC2C3CCC12CO3,0.3019
CC1OC(=O)C(C)C=C1,0.2616
N=C1C=C(OC=N1)C#N,0.179
CC1(C)COC(O1)C#C,0.2921
CCc1c(con1)C#C,0.2191
CCN=CNC(=N)C#N,0.1874
CC1(CC1)OC,0.3348
O=C1C2NC1C1CC2C1,0.2375
Cc1c(oc(n1)O)NC,0.2408
CC1C(O)C2C(O)C12C,0.2885
CCC1C2C3C2N2C3C12,0.2976
O=CC1CN2C1CC2=O,0.2023
CC1=NC2C3NC2C3O1,0.2529
CCC12CC=C3CN1C23,0.1724
CC1=CCC(CC=O)C1,0.2147
CC1CCC2OC(=O)C12,0.2776
CC#CC1CCOCC1,0.3026
OCC1(O)CC2CC1C2,0.3114
O=CC12CC1C(=O)OC2,0.2272
c1cn[nH]c1C(=O)CO,0.2025
CC1(COC1)OC=N,0.2745
CC(C)CC(=O)CC#C,0.2264
CC(NC1CCC1)C#N,0.2648
CC([NH3+])C#CCC([O-])=O,0.2728
c1c(con1)NC=O,0.2182
CC(O)C1COCO1,0.3327
CN=C1NC=NC=N1,0.1679
CC1C2C3OC=NC2C13,0.2614
CCC1CC1NCC#N,0.2588
Cn1c(=O)[nH]cn1,0.2344
N=C1OCC2OC=NC12,0.2634
C1CC23CCC4C2N4C13,0.2991
CCC(C)(C#C)C(N)=O,0.273
C1C2N1CC21CN2CC12,0.2972
CC1CC=CCC(=N)O1,0.254
CC1=CC2NC2C1C=O,0.2096
OCCC1=COC(=N)N1,0.2219
CN1C2C1C1OC2C=C1,0.2398
CC1(O)COC(=O)C1O,0.2698
C1C2C=C3C=CCC3C12,0.1892
CC(C)C(C)(C)CC#N,0.3421
CC12C3CC4CC(C13)C24,0.3227
CC1OC(CO)C1(C)C,0.311
C#CCCc1ncco1,0.2449
CCNc1c[nH]nc1O,0.218
CC12C3C4C1CN4C23C,0.2958
C#CC12NC1C1CC2O1,0.2584
CC12NC1CC1COC21,0.2945
O=C1NC2C3CC2C3N1,0.2944
Cc1c(nc[nH]1)OC=O,0.2275
Cc1c(nccn1)F,0.2114
OCC1C=CCC11CO1,0.2556
CC1CC2(CC2)C11CC1,0.3286
CC1C2CC1(C=O)C2C,0.2149
CCCNc1c[nH]nc1,0.2173
OC1C2CCC12OC=N,0.2746
CC1=NC23CC(C2)C3O1,0.2593
C1OC23C4C5C4C2C5C13,0.2965
COC(C(C)O)C(C)=O,0.2217
CC1(CCC1O)N1CC1,0.297
OC(C=O)C1CCC1,0.2334
COC(C)C(O)C1CC1,0.332
CC1NC11COC(=N)C1,0.281
C#CCC=O,0.2245
O=CNC1CCOC1=O,0.2581
CCC1OC(C=C1)C#C,0.2522
NC1=NOC(=O)OC1=N,0.1868
CCC1(C)OCOC1=O,0.2736
CC1(C)OC1C1CO1,0.338
CC1CCC2(CO)OC12,0.3369
N#CC1CC2OCOC12,0.2955
CC1OC(C=O)C(=O)O1,0.2208
C[NH+](C)CC([O-])=O,0.2646
CC(=O)C1(C)NC1C#N,0.2198
CC1CCC11CC2NC12,0.3066
C1c2c(n[nH]n2)CN1,0.2272
CCCCC(=O)NC=O,0.2214
CC1OCOCCC1O,0.3328
CC1C=CC(C)C1C#N,0.2648
NC(=O)C1CC2CC2O1,0.2622
CC1C2C3C(CN13)C2=O,0.2004
C#Cc1nc(=O)[nH]nn1,0.1526
OC(C=O)C1(CC1)C#N,0.2264
OCC1OCC=C1C#C,0.2024
CC1OC(=N)C1C(C)=O,0.2289
OC1(C#N)C2COCC12,0.2697
CCC1C(C=O)C1C#C,0.2195
OC1C2COCC12C#C,0.2746
CC1CN(C=O)C1C=O,0.1997
C1C=CCOCC(=O)N1,0.2172
CC1(CO)OC1(C)C=O,0.2173
CC1C(C)=CCC11CO1,0.262
O=C1CC2C3C=CC1C23,0.2068
CC1(O)C2OCC12CO,0.2896
N#CC1C2CCC1O2,0.2844
C1NC11CCCCOC1,0.3148
CC#CCC(O)C#N,0.2689
O=C1CCC2OCC2O1,0.2734
CC#CC1(CCO1)C=O,0.2051
CC12C3C1C(C3O)C2=O,0.2416
CC1OCC2CC1C2,0.3221
CC1=NCC(C)(O1)C=O,0.2157
O1C=CC=CN=CN=C1,0.2004
COc1ccnc(n1)N,0.2093
c1cnc(cn1)N,0.1881
Cc1c(cc(o1)CO)O,0.2122
CC1CC=CC2(C)OC12,0.2422
C#CC1=NC2CC2CO1,0.2073
CC1OCC2NC2C1O,0.2995
CC1(C)C2COC1CO2,0.3243
NC1(C#N)C2OC2C1O,0.2615
CCCN1CC1C(C)O,0.2887
COC(=O)C#CC1CN1,0.2145
OC(C1CC1)C1CC1O,0.286
OCC12CC1COC=N2,0.253
CCC(CC)C1CC1,0.3523
N=C1CN=CN1,0.2275
CCC1(C)C2CC2C1=O,0.2233
CC(O)C(CCO)C#N,0.3117
COCC(C)(O)C1CO1,0.3406
C#CCCC1CO1,0.3165
CCC1CC2(CC2O)O1,0.2925
CN1C(=N)OC=C1C#C,0.1726
CC1(C)NC1C1(C)CN1,0.2992
CC1CC2OC2C1(C)C,0.3286
CN1CC1C(O)CCO,0.295
CC12CN1CC(=N)OC2,0.2602
Cn1cc(nc1N)OC,0.2206
CC#CC1(C)C2COC12,0.2765
CCC1C2CC1C(=O)C2,0.2276
OC12C3CCC1C(=O)C23,0.2332
C1C2C3OC4OC3C2C14,0.3344
CC12CC1(O)CCC=C2,0.2514
Cc1nc(no1)C=O,0.1922
CN=C1OC2COC12,0.2575
CCCCC#CC#CC,0.2272
CC(=NO)C12CC1CC2,0.239
O=C1OC2C3C4C1C2N34,0.2525
NC1=C(CCC1O)C=O,0.1819
OCC1(OC2CC12)C#C,0.2716
c1cn2c(c1N)CC2,0.2231
O=C1C2COC1C1NC21,0.2117
COC=NC1CCC1=O,0.201
CC1=CCC(=NO)CC1,0.248
CCC(CO)CNC=O,0.2825
Cn1c(ccc1OC)N,0.2327
c1c(nc[nH]1)NC=N,0.2178
COC1CC(=O)C(=O)C1,0.1462
C#CCOC(C#C)C#N,0.2533
CN=CNc1cc[nH]n1,0.2173
CCC(O)(CO)C(C)=O,0.2262
OC1CN2CC2C11CN1,0.2833
c1c(=O)onc(n1)C#N,0.1566
CC12CC3CN(C1)C23C,0.2814
CC1CN=COC1C#N,0.2645
CC1C2CCC1C(C)=C2,0.2541
CNC12CN3C1C(=O)C23,0.2285
CC1(CO)C2CCC12O,0.3015
Cc1coccc1=O,0.2016
O=COCCCC1CO1,0.2835
C1C2OCC3COC1C23,0.314
CC1CC11C2CC1OC2,0.3212
C#CC12OC3CC1NC23,0.257
CC(=O)OCCCOC,0.2759
CC(=O)Nc1cocn1,0.2182
C1CC23NC4(COC24)C13,0.2277
OCC1CC2OC(=N)C12,0.2826
CC1(C)NC1(C)CC#N,0.2784
O=COCC1OC2CC12,0.2657
CCC1(OC1C#N)C#C,0.2639
N=C1CCOCC(=O)O1,0.2417
CC(C)NC(=N)C(=O)C,0.1694
C(=O)NC(=N)NC=O,0.2105
N=C1OC(C=O)C11CN1,0.2211
CCC(O)(CC#N)C#N,0.3118
ON=C1CCC11CO1,0.2324
CC12CCOCC1O2,0.333
CC1CN=COC(C)C1,0.2593
O=CC1CC2CC3C1N23,0.21
CC(C)[NH+](C)CC([O-])=O,0.2631
N=C1C2CC3N1C23C#C,0.2601
CC1OCCC(CO)=C1,0.2599
ON=C1C2C3C1CN23,0.244
c1c(nnc(n1)C#N)O,0.1717
CCC1=CC(=N)OC=N1,0.182
CC1CC2CC1(O)C2O,0.3067
CCC(C#C)C1CC1,0.3116
N=C1CCCCC(=O)O1,0.2492
OCC1COCC(=O)O1,0.2594
CN1C2C(O)C1C21CN1,0.3014
CC1(C)OCOC1C#C,0.2798
N#CC1CC2(CC2)N1,0.252
CN1C2C3NC2(C)C13,0.2869
O=C(CCC1CO1)C#C,0.2084
N=C(NCC1CO1)C=O,0.1715
O=CC12OC1COC2=O,0.2116
O=C1C2CC2CC2OC12,0.2169
CC1C(C#N)C1(C)C#C,0.2665
CC1CCC1N(C)C=O,0.2653
COC1C2CC(O2)C1O,0.3098
CCC12OC3C1CCC23,0.3021
CC#CC1OC1(C)C,0.2728
CC1CC2(NC12)C(C)=O,0.2106
CCN1C2C3C1C2C3=O,0.224
Cc1coc2c1cco2,0.2248
NC(=O)C1NC11CCC1,0.2574
CNc1cnco1,0.2189
CC1(C)CC2(O)CC2O1,0.3089
CC(=O)C12CN1CCC2,0.2198
CC1=NC2C3CC2(C3)O1,0.2617
CCCn1ccnc1O,0.2504
C1CN1C12CC3C1OC23,0.2974
CC(C)C1(O)CC1C#N,0.2951
O=C1CC=CC2CC2O1,0.2324
O=C1C2OC2C=C1C#C,0.1683
CC(=O)C1C2C3OC3C12,0.231
CC1COCC(C1)=NO,0.2512
O=CC12C3CN1C=NC23,0.2045
[NH3+]C1CC1OCC([O-])=O,0.266
C1C2CCCC=CC12,0.2509
CC12COC1C(O)CC2,0.3041
C1OC2CC1OCCO2,0.3222
CC1CC1C1(C)CC1O,0.3186
CN1C=C([O-])C(C[NH3+])=N1,0.2206
c1cn2c(n1)CC=C2,0.2004
C#CC1=NCC2CC2O1,0.2247
CC(C)C1(CO)CC1O,0.3079
C(CNC(=O)N)C#N,0.303
CC1CN=C2OCC12,0.266
c1c(=O)cnoc1C=O,0.1556
COC1(C)CCC1CO,0.3225
CC1CC11CC2CN2C1,0.3138
N=C1NN=CN=C1C#C,0.1384
CC1CC2C(=O)CC12C,0.2193
CCC1OC1(CO)C#C,0.2823
c1cc-2nccc2[nH]c1,0.1538
c1nc(oc(=O)n1)C#N,0.1843
CC1(C)CC(=N)NC1=O,0.2489
Cc1c([nH]nn1)COC,0.2461
OC1CCC(O)C1C#C,0.2849
CCNC(=N)C(=O)NC,0.2066
CC12CC3C4OC1C4N23,0.2684
CC1C2C3NC3C12CO,0.2713
CC1CC(CC#N)C=C1,0.2627
CC1C2CC1(CO2)C#C,0.28
[NH3+]CCC1(CO1)C([O-])=O,0.2547
CC1=COC(OC=N)=N1,0.2214
OC1CC2CCCC12O,0.2953
COC12CCC1(O)C2C,0.2859
O=C1CC2CC1N1CC21,0.2191
CC1CC(=N)OC(=O)C1,0.2558
c1c(cc(nc1O)O)O,0.2259
CC1CC2(CO)OCC12,0.3051
N=COC1(CCC1)C=O,0.2119
CC1NC1C(=O)NC=O,0.2131
OC1CCC2=C1N=CO2,0.2347
OC1C2OC=NC12C#C,0.2471
OC1CC23OC4C2CC134,0.2745
CC1(C)C(O)C1(O)C#N,0.2551
CCC(C)(O)C(O)CO,0.2947
CCOCC(O)C(N)=O,0.2753
C1CC(C1)c2n[nH]nn2,0.2538
CC1CN(C=O)C(C)=C1,0.209
CC1CC11OC(C)C1=O,0.2146
CCN1CC1(CC)C#C,0.2735
CC1C2N1C(=O)C21CO1,0.2189
CC1CC2CC12CCO,0.3245
CC12CC(=O)C1CO2,0.2177
Cc1cn(cc1O)C=O,0.1832
CC1OC11C(C)NC1=O,0.2573
CC12CC1(CO)C1NC21,0.3008
CC#Cc1c(nno1)N,0.167
C1C2CCCC=CC1O2,0.2363
CC(=N[O-])C(O)C(N)=[NH2+],0.1898
OC1C2NC2CCC1=O,0.2316
CN=c1n(nco1)C,0.2085
C1N2CC3OC=NCC123,0.2634
CC1CC2(CCO2)C1O,0.3027
CC1N=C2OCC3C1C23,0.2224
CC1(C)NC(C#N)C1N,0.2655
CC12OCC3C1C2C3=O,0.2373
CC1CN1C1CCC1=O,0.19
CCN1CC1(C#N)C#N,0.2544
O=C1NC(CC#C)C=C1,0.2127
CC(O)C1=CC=C(N)N1,0.2217
C1CC2C3OC3CC2O1,0.3196
CN1C2CNCC12C#N,0.2581
CC1C2CC3C2N3C1=O,0.2373
OC1(CC#C)C2CC1O2,0.2799
CC(C#C)C1(CO1)C#N,0.2809
CC12CN3C1C2(O)C3=O,0.233
CC(C=O)C(C)(O)CO,0.2236
OC1CC=CC1OC=N,0.2533
CCC12COC1CC=C2,0.2597
COC1C(O)C1NC=O,0.2627
C1COC(=O)N1CC#N,0.2818
c1c(non1)CCC#N,0.2618
CC1CC2CC1C=C2,0.2547
N=C1NC=NC=C1C=O,0.1541
OC1CC2(O)CC3C1C23,0.3125
OC1C2CC(=O)C12C#C,0.2271
CCNc1coc(=O)o1,0.2442
N=C1C=C(OC=N1)C#C,0.1777
CC(C)CC(=O)C(C)O,0.2359
O=CC#CCCC1CO1,0.2051
Cc1conn1,0.2326
CC1CC11CC(N1)C#N,0.2512
CCC(C)CN1CC1,0.3161
CCc1c(coc1N)C,0.2312
OC12CC3N4C1C4C23O,0.2747
CC12OCC1CC2CO,0.3116
CCCC1(O)CC2NC12,0.2973
OC1C2NC2(C#C)C1=O,0.1986
COC12CC1C1(O)CC21,0.2892
C1C2C3C4CC=C2C4N13,0.172
N=C1OC2CC=CC1O2,0.2496
CCC1(OC1C)C#C,0.286
CC12CC3CC1N1C3C21,0.314
CC12C3C4C1C4(O)C23,0.2909
CCOC(=O)N,0.3235
CCC12C3C4C1N4C23,0.2777
CC(OCC=O)C=O,0.2209
CC#CC1CC1C1CO1,0.2819
C(CO)COC(=O)CN,0.2616
OC1C2CC(CO2)C1=O,0.2165
OC1C2NC2C1C#C,0.2841
CC12CC1CC2O,0.3219
Cn1c(ncn1)COC,0.257
CC(=O)C1C(O)C1C#N,0.2173
CCC1CC(O1)C=O,0.2124
CC1C2CC1C1(CO1)C2,0.3424
C1CC=CC2NC2CO1,0.2352
CC1CC1C(=O)C1CC1,0.2265
C1C2(CO1)C(=O)NC=N2,0.2193
CC12CC(CCC1)O2,0.3159
C(C(=O)C(=O)N)O,0.1792
CC1CC2OCC2C1C,0.314
O=CCC1OCC1=O,0.2084
CCOC(CC)CCO,0.3259
[NH3+]C1C(C#N)C1C([O-])=O,0.2564
COC(C)COC=NC,0.277
CN=C1NCC(=O)CO1,0.19
OCC(O)C12CN1CC2,0.2905
N=C1ON=NC(=O)C=N1,0.1556
CN(C=N)C(=O)C1CO1,0.2239
COC1C=CCC2CC12,0.2636
OCCC12CC(=O)C1N2,0.2213
O=C1CC2CC2C1=O,0.1496
OCCC1CCCC1=O,0.2192
C1CC=CC=CC1,0.1902
ON=C1CC(O)C1C=O,0.2167
CN1CC2OC3C(O2)C13,0.2706
COC1(C)C2CN2C1=N,0.2401
OCC1OCC1CC#C,0.2921
N=C1CNCCC(=O)N1,0.2076
COC1C2OC1C2=NO,0.2484
NC1=NC(CC=O)CO1,0.2161
C(C1CO1)N1C=CC=C1,0.2455
CCC12CC3C1C2C3O,0.3197
CC1C2C3CC4C(C23)C14,0.3247
CN1CC(OC1=O)C=O,0.2072
CNc1c[nH]c(n1)CO,0.2086
NC1=NNC(=N)N=C1,0.1303
CC12CCC1(O2)C(N)=O,0.2574
CC1=C(CC(O)C1)C#C,0.2063
CC12CCC1(O)CCC2,0.3263
CC12CCC1(C)C2C#C,0.2852
N=C1NC(=O)COCO1,0.2395
C1CC23CC(COC2)C13,0.3006
CC1=C(C)C2(O)CC1C2,0.2342
O=C1OCCC2OCC12,0.2591
N=C1C=NON=CC1=N,0.1843
OC12CC3C=CC1C23O,0.2264
CC1C2C3C(C2O)C13O,0.3115
OC1C2CC11CC(=O)C21,0.219
C1OC1C1CC2CC1O2,0.3331
CC1CC(C)N1CC#N,0.2623
c1c(nco1)C(=O)C=O,0.1452
O=C1NCC1C1CN1,0.2692
CCC(=O)C1OC1CO,0.2237
N=C1NC=NO1,0.2287
OC1(CC=O)CC2NC12,0.2226
CCN1CC1(C#C)C#N,0.2496
C1OC11C2NC3C2OC13,0.2851
CC1C(=O)OC11CC1,0.2813
CCCC12CC3CC1C23,0.3295
OCCCC1OC2CC12,0.3133
CC1OC2C3CC2(O)C13,0.3029
CC1=CCC2(NC12)C#C,0.239
CC1(CC#N)CC(=O)O1,0.2835
CC(CO)C1CC2CN12,0.3068
N=C1CC2CC(CO1)O2,0.2641
c1nc2[nH]c(nn2n1)N,0.2418
CC(CO)C(O)C#N,0.2899
c1c(c(no1)CO)CO,0.2436
[NH3+]CCC(O)C([O-])=O,0.2745
CC1C2C3OC(C)C1C23,0.3064
CC(=O)C(=O)NC=N,0.165
CC1(C[NH3+])NC1C([O-])=O,0.1015
O=CN1C=CCC1C#N,0.2121
O=C1C2CCC22CCN12,0.2359
CC1C2OC(=NC12)C#C,0.2055
CC1(OCCCO1)C=O,0.2056
C1=NC2C3N=CN1C23,0.2024
OCC1CC1(O)C#N,0.2805
CC1CCC11C2CCC12,0.3216
C#CCNC(=N)C(=O)N,0.2189
N#CC12CC(C1)CCN2,0.2625
Cc1nc(oc(=O)n1)C,0.2045
N=C1CN=COCCO1,0.2481
C#CC1(COC=N1)C#N,0.27
Cc1cc(co1)N2CC2,0.2227
Cc1c(nco1)N(C)C,0.2303
CCCC1OC1C(C)=O,0.2225
ON=C1C=C2CC3C1N23,0.1452
CC1C2CC2C1CC#C,0.3075
C(C=O)N(C=O)C(=N)N,0.2154
CNc1cccn1C,0.2359
CCOC(C)CC,0.3335
NC1=NCCOC1=N,0.2022
CC1CCC11CCC1C,0.3415
CC(=N)OC(=O)N1CC1,0.2554
CCCCC1(CN1)C#N,0.2953
OCC1NC2CC2C1=O,0.2035
CNc1c(cno1)C#N,0.2192
CC(O)C(C#N)C(N)=O,0.2713
CN1C2C3OC3C12C#C,0.2366
O=CC12NCC1NC2=O,0.1881
CNC1=CC(=N)NN=C1,0.1532
CC1CC(=O)COC1C,0.2105
C1C2C=CCOCCN12,0.21
CC1COC1(C)CC=O,0.2218
COC1(CC1C)C(C)=O,0.2225
CC(=O)C1OCC1=O,0.2
OC1C=C2CCC3C1C23,0.2209
CN=C1OC=C(N)N=C1,0.134
C(=O)Nc1nc([nH]n1)N,0.2231
Cc1nc([nH]n1)O,0.2697
CCC(C)C(C)(C)CO,0.3361
CC1C2C3C2(C)CC13O,0.3062
CC1C2OC3C2C1C3=O,0.2007
CC1CC(CC#C)CO1,0.2921
CC1C2C1C(O)C2C,0.3129
Cn1cnc(c1N)C#N,0.2181
CCc1c(non1)C#N,0.2332
Cc1ncc(o1)CO,0.236
COc1ncncn1,0.2228
CN=C1CCC(O1)C#N,0.264
C1CN=C(NC1=O)N,0.2336
COC12CN(C1)C21CC1,0.3253
CC1NC11COC1C#C,0.2623
C#CCC(F)(F)F,0.3148
C1C(CC1=O)C(F)(F)F,0.2246
c1c[nH]c2c1OCOC2,0.2302
CC1OC2C3CC3(O)C12,0.3061
C1C(CN1C=O)CO,0.2668
OC1=NOC(=N)OC1=O,0.1853
N=C1ON=CC(=N1)C#C,0.1469
OC12CC3C(CC13O)C2,0.3127
CN(C)c1cc(oc1)N,0.2184
CC(O)(C#C)C1CCC1,0.2971
C(C=O)N(CC=O)C=O,0.2012
CC1C(O)CC11CO1,0.3196
CNC(C)(C=O)C#CC,0.1913
COCC1CCC(=O)N1,0.2728
CC1OCC2(C)CC1O2,0.3211
COCC12CC1CC2O,0.3209
OC1CCC=C(C1)C#N,0.2248
C1CC2CCOC3C1C23,0.2936
CC1C2NC2C=C1C=O,0.1876
c1c(n(cn1)CCO)O,0.2441
CC1CCC2C1C2(C)O,0.3129
CC#CC1=CCC(=O)C1,0.2043
OC(COC=O)C1CN1,0.2744
O=C1C2CN(C2)C1C#C,0.2027
CC#CC1C(C)N1C=O,0.246
CC1(C#N)C2CC2C1O,0.3049
c1c(coc1N)N(=O)=O,0.1455
CC1C2OCOC12CO,0.3236
Cn1ccc(c1)OC=O,0.2247
CC(C)(C#C)C1(CC1)O,0.2982
C1CCC(C1)C=O,0.2259
NC(=O)C1CC1OC=O,0.2655
c1c(c(nc(=O)o1)N)F,0.1947
CC1(O)C2CC(=O)CC12,0.2239
CC1(CC(=O)O1)C1CN1,0.2586
COC(C)(C)C(O)C=O,0.2247
OC1(CC2CCC12)C#C,0.2833
CC1=C(C(=O)CC1)C#C,0.1886
c1c(c(cnc1N)N)F,0.1813
CC12NC1CC=CC2O,0.2649
CC1OCC1C1(O)CC1,0.2907
OC12COC3C(CC13)C2,0.304
COC1CCCC11CC1,0.3228
OC1C2CCOCCC12,0.3043
CC1(C=O)C2OCOC12,0.2194
N=C1CC2CC(O1)C=C2,0.2423
CCCC(C)C(C)C#N,0.3469
CC(C)Cc1c[nH]nc1,0.2578
CCOCCC1CC1C,0.339
CC1CCNC(=O)N1C,0.2835
CCC12CN3C4C(C14)C23,0.2933
OC12CC3CC1C3C=C2,0.2494
CC(C)C(=O)C,0.2308
COC1(C)C2CC1C2C,0.3389
CC1(CC1)OC2CC2,0.3298
CCC1CC(C)=C(C)C1,0.2535
CC1CC1C1CC1(C)C,0.325
COC1CN2C1CC2=O,0.2375
O=C1COC(O1)C1CC1,0.2753
FC1=CC(F)=NC(=N)O1,0.1892
CC(O)C#CC(C)O,0.2872
CCn1c(ncn1)C#N,0.2241
CC1CC2OC12C#N,0.2743
C1N=C2C3OC3C3C1N23,0.2077
CC1CC2C(O)CC=C12,0.2476
CC1CC1C1=COC=C1,0.2391
CC1OCC1CCCO,0.3165
CC1C2OCC2C11CC1,0.3126
O=CCC12CC=CC1O2,0.2185
CC1NC1CC(N)C#N,0.2772
c1c(cnc(n1)C=O)N,0.1782
N=C1OC2C3OC2C13,0.2579
CC1=C2C=CC3C(C1)C23,0.1744
CCCC(C)C(N)=O,0.2772
CC1CC1(OC=N)C=O,0.2166
COCC12CC(C1)C2,0.3412
C1C2OC3CC3OC12,0.3182
CCC1C2CC(O)CC12,0.3234
O=CC1=NC(CN1)C#N,0.1701
COC(=O)C(C)C=O,0.2199
CC(CCC=O)NC=O,0.2281
CCNc1conc1N,0.2201
OCC1CC2NC2C1=O,0.2094
COCCCC1OC1C,0.3411
CC1C(=O)C2(C)NC12C,0.2147
c1c2n(cn1)C(=O)C=C2,0.1412
COc1nc[nH]n1,0.2474
C#CC12CC1N=CO2,0.2494
CC1OC(C#C)C1C=O,0.2195
CC(C)C1(C)CC(=O)N1,0.2798
CCC1(CC(C)O1)C#C,0.2824
CCCC1OC2C(C)C12,0.3088
C1CC23NC4CC12OC34,0.2897
CC12OCC3OCC1C23,0.3163
CC12NC3CC1OC23C,0.3011
O=CC12CC3C(OC1)C23,0.2033
O=C(C1CN1)C1CCC1,0.228
CC12C(O)C1NCC2=O,0.2098
CC1C2COC(=N)C1O2,0.266
C1NC1C1=CCC2NC12,0.2358
C1C=C(CO1)C#N,0.2058
N#CCC1OC1CC#N,0.3154
CC1(O)CCC11CCO1,0.2981
OCC1=CC(=O)N=NO1,0.2014
C1NC11CC2OCOC12,0.305
CC1OC(=N)C(=O)C1O,0.1884
CC12OCC3=CCC1C23,0.1988
OC1COCC2(CC2)C1,0.312
CC12CC(C)(C#C)C1N2,0.2925
N#CC12OC1C1CNC21,0.231
CN1C2CC(=O)C(=O)C12,0.144
c1cnc(nc1)C#N,0.2016
CC1(CCC1)C(F)(F)F,0.3955
C1OC2C3CCCC1C23,0.3075
N#CC12CC1OC1CC21,0.2825
Cc1nc(n(n1)C)N,0.2515
NC1C=CCC1(O)C#N,0.2488
CCNC(=N)C(=O)C#N,0.1341
O=CC12OC3CC1NC23,0.2005
OC1CC=C2CCOC12,0.2496
CC1C(N)C(=N)OC1=O,0.2385
N=C1OC2CN3CC2C13,0.2455
OCCNC(C=O)C#N,0.204
Cc1ccc(c(n1)O)O,0.1987
COC1COC(=O)C1N,0.2498
CC12CC3C1(O)CC23O,0.3085
C[NH2+]CC(C)(C)C([O-])=O,0.1523
CC(=O)C1(CO1)C(N)=O,0.2153
NC1CC1(C#N)C#N,0.2499
CCCC1(C)CC1C#C,0.2878
N=C1OC(=O)OC2CC12,0.2756
CCC(=O)C1CO1,0.2245
CCCC(CC)(CC)O,0.3235
OCC12C=CC3CN1C23,0.2324
CCCC#N,0.355
CC1C2CC2(O)C11CC1,0.309
c1cnc(oc1=O)C#N,0.1767
COC1CC1CCO,0.3252
CCC1C=CN(C)C1=O,0.2082
C(=O)NC(=O)C(=N)N,0.1985
C1Cn2c(nc(n2)N)N1,0.2338
CC12CC3C(C13)C2CO,0.3149
Cc1cc(=O)ncn1C,0.2047
CC1(CCO1)C#CCO,0.2744
CC1CCC2(CN2)C1=O,0.2102
N=CN1C2CC2OC1=N,0.2318
CCC#CC1C2COC12,0.2731
c1c(cnnc1O)N,0.2001
CNC1(C#N)C(C)C1C,0.2565
CC1(C2(CCC2)CO1)C,0.3144
CC1CC(CC=O)CO1,0.2216
N#CC12CCN(CC1)C2,0.275
OC1CN=COC(=O)C1,0.2359
CC1C=CC(C)(O)C1C,0.2593
CC1C2C1C(=O)NC2=O,0.2299
CN1CC11CC(=O)C1O,0.2004
CC(C#N)C1CCO1,0.2954
OCC1(OC1C#C)C#C,0.2556
CC(NC=O)C1(O)CC1,0.2815
CC#CCc1[nH]ncn1,0.2702
CNC(=O)C(=O)N,0.2117
CC1=CC2CCC1CO2,0.253
CCNC(=O)NCC=O,0.2196
CC#CCC#CCC#C,0.2811
c1cc(oc1)OCC=O,0.1723
CC12C=CC3CC1C23C,0.2366
C#CCC12CCCC1N2,0.2978
CCC(C=O)C1CC1,0.2243
N=C1OC2CC3NC1C23,0.2488
CC(=O)C1(CO)CO1,0.2233
CC1CC11OC2(C)CC12,0.3031
OC1CC(C1)C1CCO1,0.318
CCC(C)C(C)C,0.3822
CC(C)(C#C)O,0.3014
C#Cc1[nH]c(c(n1)O)O,0.1732
CC(=O)C1(C)CC1O,0.2143
CCCOC(=O)C1CN1,0.2602
CCC12CC3C1CN23,0.3197
OC1COC1C#N,0.2769
CC1(C)CC=C2CCC12,0.2461
CCC#Cc1ccco1,0.1942
N=C1CC(CO1)C=O,0.226
Cn1c(ncn1)CC#C,0.2608
Cn1nc(nn1)C2CC2,0.238
CCOCC(C)OCC,0.3373
CC1=NOC([O-])=C1C[NH3+],0.2366
COC1(C)CC1C#CC,0.2808
CC1=Cc2c(con2)C1,0.2113
CN(C=N)c1cnno1,0.2002
CCCOCC(O)C=O,0.223
CC1OC1CC1OC1C,0.3422
CCCC1(CCC1)C,0.3572
CC1=CCN(CC1)C=O,0.256
COC1CCCC1(C)O,0.3199
CC1NC(C#N)C11CN1,0.2703
N=C1OC2OC1C1NC21,0.2713
OCCC1CC1CCO,0.3407
CC12CCC(O)C1CO2,0.3122
CCc1cn(cc1C)C,0.2433
CC1CC11C=CC2CC12,0.2339
C1CCC2(CC1)CCC2,0.3495
CC1=CCC=CC2NC12,0.2299
O=CC1=CC2OCC2C1,0.1859
C1C2C3OC22C=CCC132,0.2182
[O-]C(=O)C1C2NC=[NH+]C12,0.2545
CC(C#C)N1CCC1=O,0.2677
CCN1CC(C)NC1=O,0.2935
OC1CC11CC2(CO2)C1,0.3051
CC#CCC#CC=O,0.2009
CC(O)C1CC1O,0.3263
CC(C)(C(N)=[NH2+])C([O-])=O,0.2255
c1ccc2c(c1)cc[nH]2,0.1962
CC(=O)C#CCOC=O,0.2064
CCNC(=O)CC#C,0.2758
CC1COC(C#C)C1O,0.2821
c1c2c(on1)CC(=O)N2,0.1975
CC(=O)C1COC2CC12,0.218
COCC12C3C4C3C1C24,0.2955
CC12CCN1C(=O)C=C2,0.206
CCC1(C)OC2CC12,0.3174
O=CC1CC=CC11CC1,0.2101
CC1CC=C(C)C1C,0.2588
CC(O)CCC#CC=O,0.2056
CC1C2CC(=NO)C1O2,0.2543
OCCN1C2CC1C=C2,0.2255
C1CC11CN2C3CC1C23,0.3237
ON=C1CC(O)CC1O,0.2491
CC12OC1C1OCOC21,0.2999
C1COCOCC(=O)N1,0.2538
O=C1C2C3C(N13)C21CC1,0.2499
C1OC2=NCCNC12,0.2586
OCC12OC3C(C13)C2=O,0.2231
CC(=[NH2+])NC1=CN=N[N-]1,0.1456
CCCC(=O)C(=O)C=O,0.1334
OC1(COC1=N)C1CO1,0.2783
[O-]C(=O)C1CC([NH2+]1)C=O,0.2044
N=C1NC2C3OC1OC23,0.2466
OCC1=CCC2NC12,0.2486
CC1CC(=O)N(C)C1=O,0.2402
O=CCC1CO1,0.2249
Cc1cnc(cn1)CO,0.1958
CC1(C2CCC12)N1CC1,0.3097
CC#CCC(C#C)C#C,0.2754
CC12CC1(O)C(C)(O)C2,0.2816
CCCCC1CC1(C)C,0.3421
CC1CC(CO1)C#C,0.303
CN=C(NC(=O)N)OC,0.25
O=C1CC2CC2CCN1,0.2666
CCc1coc(=O)o1,0.2547
O=C1CC2OC2C(=O)N1,0.2239
CCC(O)C1C2CCC12,0.3208
Cc1cn(nc1CO)C,0.2476
COC(CO)C#CC,0.285
OC1(CC2CC1O2)C#N,0.2747
OC12C(OC1=N)C2C#C,0.25
C#CC12OC1C1OCC21,0.2507
CC1OC2CNC12C=O,0.1933
CCC1(OC1C)C1CC1,0.3411
C1CC1N2CC=CC2=O,0.2078
CC(C)CC1CC(C)C1,0.3583
CC12CC1(C)C1CN1C2,0.3078
CC12CC(O)C1C(=O)N2,0.267
Cc1cc(cnc1N)O,0.1824
c1nc(c(o1)NC=N)O,0.2213
CC#CC1(CC1)C#N,0.2652
c1cc([nH]c(=O)c1N)O,0.1648
N=C1NC23CC12OCC3,0.2528
ON=C1CC2(O)COC12,0.2351
CC1=CCc2c1coc2,0.2028
CC12CC3C4C(C14)C3O2,0.3397
OC1CC2NC2C1C#N,0.306
C#CCC12CN3C1CC23,0.2786
CC1C2C(=N)OC12C=O,0.217
CCc1cc(=O)onc1,0.1842
CC1(O)C2COC1C2O,0.2769
N#CC12CC3(CO3)C1N2,0.2814
O=C1CN2CC3C(N1)C23,0.239
N=C1CCNC(=O)CO1,0.2512
OC(C#C)C1C2CCC12,0.2821
C1C2OC1C1OC1C=C2,0.2279
COC(CC(C)=O)C#C,0.2324
N=C1COCCC(=O)N1,0.2281
OCCCC12CC1CO2,0.3072
C1CC12CN=C(O2)C=O,0.1738
CCC1CCCC1C,0.3696
N#CC1=CC2COC1C2,0.2094
CCC12CC1(C)OCC2,0.3037
O=C1OCC2COC12,0.244
CCC1CC1CO,0.3363
OCC1=NC=CC(=N)N1,0.1784
CC(=O)CCOC,0.2348
N=COC1COCCO1,0.2692
CC1C(C)C(C=O)C1C,0.2205
O=C1OCC2(CO2)C=C1,0.2106
COC(CC#N)C=O,0.2227
CC(C)(CC(=O)N)C#C,0.2732
CCC1CN(C=N)C1=O,0.2263
N=C1OCC=C1NC=O,0.2026
CCCC(=O)C#C,0.2082
Cc1cc(nc(n1)C)F,0.2261
CNC(=O)C(C)C1CO1,0.2738
CCC1C2CC2(O)C1O,0.3022
OC1CC2COC(=O)C12,0.2597
CC12OC3CC1CC3O2,0.3436
OC1C2C3CCCC2C13,0.3226
CCC1OC(C)C1OC,0.318
CCC1=CC2(O)CC1C2,0.2351
CCNc1cnc(o1)N,0.2308
OC1CC2C3C4OC13C24,0.295
NC(=O)C1OC1C1CC1,0.2592
C1C2C3C1C21OC=NC31,0.2576
CC1C2NC2C(C)C1O,0.3126
CC1(CC1C#C)OC=O,0.2557
CC(C)c1c(cn[nH]1)O,0.2315
OC12CC3CC1C1C3C21,0.312
CC1CC2CNC12C#N,0.2541
C#CC(C#N)C1CO1,0.289
CCOC(C)C1CC1O,0.2955
Cc1c([nH]cn1)C(=O)C,0.1911
CNC1=CC(=O)CC1,0.2088
O=C1C2C3COC1CN23,0.2022
Cc1c[nH]nc1OC=O,0.2414
C1C2C=CC3COCC123,0.2463
CCC1=NC2CC2O1,0.2595
N=C1OCC(=O)NC1=O,0.2102
CCC1C2CC1(O2)C#N,0.2548
CC1(CCO)NC1CO,0.2992
CC1=CCN=CNC1=O,0.2065
C1C2CC3=NNC=C3C12,0.2429
CC(=O)OCCCC#N,0.2855
O=CC12CCC1(N2)C#C,0.2074
NC1=CC(=O)ON=N1,0.1659
CCOC1(CC1)C(=O)C,0.2228
OC1C2C3OC1C23O,0.299
CC12CCC1(O)C2C=O,0.2232
CC(O)C#CC(=O)CO,0.2059
OC1CC(CCC#N)C1,0.3044
CC1CC(C=O)C1C#N,0.2188
CC1CN2C=CC(C)=C12,0.2471
CC12CCC1OC2,0.3101
C#Cc1ccc(o1)C#N,0.1751
OCC(O)(C#N)C1CN1,0.2708
OCCC1CNC1=O,0.2801
c1cnc(cn1)CC#N,0.1962
OC1CC2C3C4C2C1N34,0.3005
CC1OC1C,0.3557
C1NC11CCCCC=C1,0.2369
C1C2C3CCC=CC2C13,0.2471
CC(OC1COC1)C=O,0.2198
CC1CC(=O)C2OCC12,0.2016
CC1(C)CCC1(C)CO,0.3324
CC1C2CC1C(=N)OC2,0.2866
C1C2C3CCCCC1C23,0.3234
CC1(OC1(C)C=O)C=O,0.1987
CC1CC2(CCO)NC12,0.298
CC12CN1C(=O)C2(C)C,0.2322
N=C1OC2CNC1C=C2,0.2176
[NH3+]C1(CC1)C1=CN=N[N-]1,0.2446
CC1CC23CN(C2C)C13,0.2601
Cn1cncc1CC#C,0.246
CCC(O)CO,0.3178
CN1CC(O)(C#N)C1=N,0.2413
CC#CCC1CCC1C,0.3029
CC1CC2CCOC2O1,0.3324
O=C1CC2C(CN12)C#C,0.2355
[O-]C1=C2C[NH2+]CC2=NO1,0.1447
CC1C2C3NC3C2C1=O,0.2091
COCC(=O)C#CC=O,0.1901
N#CCC12CC(C1)OC2,0.2784
C#CC1COC2CC2O1,0.2605
CC(O)CC1=NC=NO1,0.2565
COC1(C)CCCOC1,0.3169
CC1CC2CC2(C1)C#N,0.305
OCC(=O)C(=N)N1CC1,0.1866
C(=O)c1c(c(no1)N)N,0.1683
CC1=CC2OC2(C1)C#N,0.2401
COCC(=N)OC(N)=O,0.2549
CCCC1CC1COC,0.3363
CC(NC=O)C1CCO1,0.2815
CCC(C)C(C)C=O,0.2266
CC1NC=NC1(C)C#N,0.2457
C1CC11CCC2CC2C1,0.3342
CC12CC(C3CC3)C1O2,0.3328
OC12C3C4N3CC1C24O,0.2854
OC1(CC1)C1OC2CC12,0.2995
CC1CC(C#C)C1C#N,0.2895
OC1CC2CC2CC=C1,0.2522
ON=C1C2NC2CC1O,0.2346
OCC1(COCO1)C#N,0.2885
CC1OC1C(=O)C1CN1,0.2183
CC1(CC=O)CCCO1,0.2227
COCC12CCN1C2C,0.3066
CC(C#C)C1CCCO1,0.2948
CC1(OCC=C1)C1CC1,0.249
COC1=CC=NOC1=N,0.1718
CN=C1C(=CCO1)C#C,0.1881
CNC1=NOC=CC1=N,0.1778
c1c(c([nH]n1)CCO)N,0.2194
OC1C2(O)CC(O)C12O,0.2918
C#Cc1ccc(=O)on1,0.1678
CC12C3C4C3C1(C#C)N24,0.2315
CC1(O)C2CC1(C)C2O,0.2982
CC1C2COC3C2C13O,0.2947
OC1C2NC=CC(=O)C12,0.1789
CN1CCC11CNC1=O,0.2333
OC1CC2(CC1N2)C#N,0.2652
CCC#CCC1CC1O,0.3013
NC1C2(O)CC1(C2)C#N,0.274
CC1OCCC1=O,0.2171
CC#CCC=O,0.2194
CN1CC(=NO)CC1=O,0.2355
c1c(=O)ncc(=O)on1,0.1715
COC12CC3C(C=C1)C23,0.2412
OCC(O)C(C=O)C=O,0.1968
c1nc2c(o1)C(=O)CC2,0.1931
C1C2OC22CN=COC12,0.2707
CC(C)c1ccn(n1)C,0.2575
OCC1CC1C#CC=O,0.2035
O=CC1=CC2CC1C=C2,0.1788
OC1CCC2OCC=C12,0.2379
Cc1c(non1)N(C)C,0.2034
Cc1nc[nH]c(=O)n1,0.2015
CCC(O)C1(CO1)C#N,0.2833
CC(N)C(N)(C#N)C#N,0.2567
CCOC(=N)CCC#C,0.2919
CC1(C)C2OC(=O)C12,0.2746
CCC(C)(COC)C#C,0.3121
NC1=CC(=O)N2CC2C1,0.2014
O=CCC1C2CC1O2,0.2169
CC(O)CC#CC(C)=O,0.2082
O=C1C2CC1(OC2)C#N,0.2052
CCn1cc(nc1N)O,0.2214
CC(C)(C#C)OCCO,0.2975
CCC(C)(C)C#CCO,0.277
C#CCCCC#N,0.2953
c1cn(nc1N)C2CC2,0.2271
OCC1(CO)CC2CC12,0.2957
CC1OC11C2OC1C2=O,0.2406
N=COC12CC1CC2,0.2786
CCC(C)C(=O)C(N)=N,0.1954
CC1CC=C(C)CC1=O,0.2238
C#CC12OC3CC1C2O3,0.2591
NC=[NH+]CC(=O)C([O-])=O,0.0901
ON=C1C=CC2OCC12,0.1903
Cc1ccc(c(=O)[nH]1)F,0.1774
CCC1=CCCC1OC,0.2587
OC1C2CC3N2CC13O,0.2876
CC1CC1OC(=O)C#C,0.2297
CC1=Cc2cocc2C1,0.1988
CC1C2CC2COC1=N,0.2835
OCC1OCC=C1C#N,0.1998
c1c(c(=O)[nH]nn1)N,0.1756
CC1CC2OC2C1C,0.3311
CCNc1conn1,0.1889
CCOC(=N)NC=NC,0.2386
C1CC2C3CCCC23C1,0.3365
C1CC(C1)(CO)C#N,0.3053
C1C2CC3COCC2C13,0.3353
CC(=NO)C1CC1,0.2442
CC12CC1(OCO2)C#N,0.2579
CC12OC3C4C(CC13)C24,0.3317
OC1C2COC22COC12,0.2899
COC1C(C)C1OC=N,0.2733
CC1(O)C2C3CC2C13C,0.3268
C1CC(C1)(C#N)C#N,0.314
C1COCC(=C1)CC#N,0.2575
Cc1cc(ncn1)F,0.23
CC1CN1CCC1CO1,0.3175
OC1C2C1C1(O)CC21O,0.2675
CCCc1ncno1,0.2622
CN1CC(=O)CC1C=O,0.1886
c1c([nH]cn1)CCO,0.2494
CC(O)CC1=CC=NO1,0.2445
CN=COCCCC#C,0.2731
CCC(CO)C(=O)NC,0.2765
CNc1cc(cnc1)N,0.1903
OCC12NC1C1CC21,0.2633
CC1C(O)C2C3CN3C12,0.2705
CC1CC(N)=C(C)C1=O,0.2038
C1CC=CC(=O)NC1,0.2126
CC1(C)CN2C(C#C)C12,0.259
CNC(=O)C1CC1CO,0.2713
c1nc(c(o1)C#N)C=O,0.1774
CC1=CC2CC1(C2)C#C,0.2374
CCOC(=O)C(N)C#C,0.2542
OC1C2CC(O)(C2)C1O,0.3043
Cn1cnc(=O)cc1F,0.2099
O=CNC1CCCC1=O,0.2213
OCC1OC(=O)C1O,0.2612
CN1C2(C)C3CC3C12C,0.282
COC(C)CCCCO,0.3316
O=C1CC2C3CCN1C23,0.245
CCC(C)(C)OCC=O,0.2293
OC12CCC1C(C2)C=O,0.2221
OC1C2C3CC1CCN23,0.2894
Cn1c(c(cn1)O)OC,0.2311
CCC1(C)OCC(=O)O1,0.2778
CC(C)C12CC(O)C1O2,0.3239
C1C2CC1C1CC(C2)O1,0.3153
C#Cc1[nH]c(=O)ccn1,0.1724
OCC12CC(C1)C2,0.3382
CN=C1C2(CC2)OCO1,0.2662
CC(C)c1c(con1)N,0.2173
O=C1NC2C3CC1OC23,0.2509
O=C1COC2CC12C#N,0.2154
C1CC11CC2CCC=C12,0.2365
CC1OC(C)C(=C1)C#C,0.2048
c1c(coc1NC=O)N,0.1841
CC(O)C(C)C(C)C#N,0.3087
CN=C1OC=CC=C1F,0.1661
CCCC#CC(F)(F)F,0.3023
Cc1c(nco1)CC#N,0.2396
c1c(=O)onc(n1)F,0.16
NC(=[NH2+])OCCC([O-])=O,0.285
CC1(C2CCN12)C(N)=O,0.2615
CC#CCC#CC#CC,0.2251
N=C1OC23CCC2NC13,0.2476
CCC1(C)COC(=O)O1,0.3315
C1CC11C2C3COC1C23,0.3257
CCCC1CC(=O)CO1,0.2194
CN=C(C(=O)NC=N)N,0.2001
N=COCC12CC1CO2,0.2759
C1CC1(C=O)NC(=O)N,0.2194
CC1CC(C1C)C(C)=O,0.2291
OCC(O)CCOC=O,0.275
CN=C1OC2CNC12C,0.2595
Cc1c(cn(n1)C)CO,0.252
O=C(C#N)C(=O)C1CN1,0.1429
O=CC1NC1C(=O)C#N,0.1589
CC1(C)C2CN2C1(C)C,0.302
CC1OC11COC1=N,0.272
C1CC11CCC2COC12,0.3184
CN(C)C(=O)C(=O)C=O,0.1472
CC1C2CC1(O)CC2,0.325
CC1C(O)C(=O)C1C#C,0.2145
OCC12C3CC1=CCN23,0.1641
Cc1coc(n1)CC#C,0.2392
CC1=C2C3CC3C2OC1,0.2291
N#CCN1C=NC2CC12,0.2276
CC12CC1C(=O)C21CC1,0.2297
OC1C(O)C2(CO2)C1=O,0.2014
O=C1CC2COC2CO1,0.2692
CCC(C)OCCOC,0.3311
O=CC1(C#C)C2CC1O2,0.2027
OC1C2C3OC1C(=O)C23,0.2068
CC1C=CCC(O)C1O,0.2661
NC(=O)NC1COC1=N,0.2762
N=COCC12CC(C1)C2,0.2828
COC(=O)C1CC1(C)O,0.2719
C[NH2+]CC([O-])=O,0.2691
[NH3+]C1C(O)CC1C([O-])=O,0.2688
NC1C(CC11CN1)C#N,0.2763
OC1=COC(=N)C(=N)O1,0.1704
COC1CC11CCOC1,0.3191
C1OC2OCC3OC2C13,0.3138
CC12CC(C1)OC1CC21,0.3161
c1[nH]c(=O)nc(n1)CO,0.1953
Cn1cc(c(c1)O)C#C,0.2097
CC1=NCCCCCO1,0.2578
OC1CCC2=CNC=C12,0.2388
CCC#CCCN1CC1,0.295
OCCC1CCC1CO,0.3374
C1CC(=O)NC=C1C=O,0.183
C1C2COCC3C2N13,0.3145
CC1CC11OCC=C1C,0.2279
CNC(=O)C(O)C1CO1,0.2753
CC12C3C=CC1N=CN23,0.2266
CCC12CC1(O)C(=N)N2,0.2329
c1c(n[nH]c1O)CCO,0.2565
CCC(CC#N)C1CN1,0.2827
CN(CC#N)C(=N)OC,0.2608
CC12COCC3CN1C23,0.3115
CCCC1CC2(C)OC12,0.3326
CC(=O)C(C)(C)C(=O)C,0.1973
NC(=O)C1(CC=O)CO1,0.2284
CCCc1c(cco1)O,0.22
CCOC=NCC=O,0.2204
C(COCC(=O)CO)O,0.2085
c1c(con1)NC=N,0.2115
C#CCCc1conn1,0.2237
CC1(O)CC2C3NC3C12,0.299
COC1CC(O)C(=O)C1,0.2213
CCOC(=N)CC#CC,0.2913
CCCNC(=O)COC,0.2732
COC(C#N)C(C)(C)C,0.3038
O=CN1CC2COC2C1,0.27
CC(O)C1CC(C)C=C1,0.2584
C#CC1=CC(=O)C(=O)N1,0.1363
CC#CCCC1CCO1,0.3031
CCc1[nH]ccn1,0.2496
NC1C(C#N)C1C(N)=O,0.2354
CC1C2OC3CCN1C23,0.2824
c1c2c(no1)CCCN2,0.2046
CC12N=CN3C(C13)C2O,0.2231
CC(=O)n1c(ncn1)O,0.202
CC12CC(OC1)C21CN1,0.2918
N=COC1CC2CC2C1,0.2798
CC12CC1(C)OCOC2,0.3137
C1C2CC3=C(N=NN3)C12,0.2311
CC1OCC(CO)C1O,0.2996
OC1=COC(=N)O1,0.2538
CNC(=O)C(O)C(C)O,0.2632
CC(C#N)C1(CO1)C#N,0.2991
CCC(=NO)C(=O)N,0.2139
OCC1CN1CC1CC1,0.282
CC1(CC(=O)NC=C1)C,0.2136
C1CC11CC2OC12,0.3361
N=C1CC2=C(ON=C2)O1,0.2249
c1cc(ncc1C#N)F,0.2144
OCC1CC=CC1CO,0.2613
O=CCC(NC=O)C=O,0.1989
CC1C2CC(C)=CC12O,0.2422
Cc1ccn(c1)CC#C,0.2303
CC1COCC(C)=C1,0.2598
OC1COC(C=O)C=C1,0.1964
CC1CC11OCC2NC12,0.2946
c1c(oc(=O)cn1)N,0.157
CCC1(C)CN2C(C)C12,0.2939
OC1CC2(CNC2=O)C1,0.2771
CC1(COC=N)CO1,0.2821
C1OC2C3COC1C2N3,0.2909
OCC1CC2NC12CO,0.2876
[NH3+]CC#CC([O-])=O,0.2238
CC12CC1C1=CN=CN21,0.2311
CC(=NO)COC=O,0.252
C1NC1C1=NC=NC=N1,0.2103
O=C1CC2CC12C1CO1,0.2317
C1OC1C1COCC=C1,0.2655
CC(O)C1=CCC(=O)N1,0.2133
CCC1(CC)C2COC12,0.306
CNc1cocc1CO,0.2295
CCC12CC1C1(CO1)C2,0.3378
C1OC1C1COCO1,0.3402
CN(C)C(=O)C(=O)C#N,0.1611
CC#CC1C2CC2C1O,0.2878
CC1C(CO)C1(C)C#C,0.2876
CN=c1[nH]cc(o1)OC,0.2245
CCC1CC2C3CC3C12,0.3086
CC12CC1C1NC21C#C,0.2315
CCC12CC3OCC1C23,0.3198
O=C1C2CC1C2CC#N,0.2517
N=C1OC2C3C4C1C2N34,0.2724
CC1=CC(=N)N=CN1,0.1923
CC1C2OCC3CC3C12,0.3116
CC(C)CC1CC1C#C,0.2902
OCC1OC2C3NC2C13,0.3126
CN(C=O)C1CC2NC12,0.2622
CC(C)(C#C)C(=O)C#C,0.2007
CC(=O)C#CC(C)(C)C,0.2081
CC1(O)C(O)C1(C)C#N,0.2949
CNC(=O)N1CC2CC12,0.2844
C#CCOC1C2CCC12,0.2758
OC12COC3C1C=CC23,0.2318
CC#CC1CCC(O)C1,0.3006
CC1(CCOC1)C#C,0.3035
O=CC12CC3CC1C23,0.2215
CCC1OCCC1=NO,0.2482
CC1CC=CC(=O)N1C,0.2028
CN(C)C(=O)OC=N,0.2578
CC1(OC1CO)C#N,0.2852
CC(C)CC1CC1(C)O,0.3232
CC12CC(O)C(O1)C=C2,0.2436
CC1(CC1)C(CO)C=O,0.2206
N#CC12CC1CCO2,0.2715
N#CCCC1CN=CO1,0.2731
CNC12CC1(C)OC2=N,0.2495
C#CCC#CCO,0.2778
CC1(C)C2C3CCC2C13,0.3739
CC(=O)CCC(O)C=O,0.2085
OC1COC11COC1,0.3006
CN1CCc2c1[nH]cc2,0.2196
CC1C(OC=N)C1C#N,0.2749
CN(C=O)C1C2CC1C2,0.2703
CC1OC(C)=NCC1=O,0.2012
C1C=CCC#CCC=C1,0.2435
Cc1cnc(cn1)F,0.2066
N#CC1CC23CC(C2)N13,0.2447
OC1CC2CC12C1CN1,0.3055
C#CC(C#C)(C(=O)N)N,0.2501
CC1C2C(C)C1(C)C2O,0.3164
COC1C(C)C1C1CC1,0.3134
OC1C(=N)OCOC1=N,0.2689
CC1C=CCCC1CO,0.2681
CC12CCOC3C1OC23,0.3072
CC1(O)C2CCCC12,0.3142
CC1C2C3C4OC4C2N13,0.2918
C1C2C=CC=CC=CC12,0.1666
O=C1COCC1C#C,0.207
NC12C3C1C1=NCC2N31,0.1717
C#CC1OCCO1,0.2959
C(C1CN1)C1=CON=C1,0.2415
N#CC1C2CN1CCN2,0.2382
CCC1CC1NC(C)=O,0.2704
CCC1NC(=O)NC1=O,0.2536
CNC(=O)CC(C)C#C,0.2742
COC12CC(C1)C2=NO,0.2706
CC1NC(=N)C(=O)C1O,0.1722
CC(=O)n1cccc1,0.1923
O=CC12CCC1N1CC21,0.2061
C#CCC12CCCC1O2,0.3063
CCC12OC1C(=O)C2C,0.2119
Cc1cncnc1F,0.2282
C#CCC1=CCCC1=O,0.198
c1c(cn[nH]1)CC2CC2,0.2578
O=C1C2CCC1N=CN2,0.1946
COCC1CCC=CC1,0.2675
CCCCC(O)C#C,0.2977
CC1CC2OC3C(O2)C13,0.305
CC(=O)COC1CC1O,0.2006
CC1C2NC2C1C(C)=O,0.2202
CC1(C)CC(O)C1C#C,0.2911
c1c(c(cnc1F)N)F,0.1944
N=C1NC(=O)NN=N1,0.1867
COC1C2C3CC3C12O,0.2844
CCC1CC2CC2(O)C1,0.3132
O=C1CC2CC=CCC12,0.2146
C1OC2C3C4C(O1)C2N34,0.3291
c1c(nc([nH]1)O)C=O,0.1945
CC1CC(=O)CC1=O,0.1997
C#CC(=N)NC(=O)N,0.2101
C1Cc2c(nn[nH]2)C1,0.2382
CC#CCCCC(C)C,0.3039
CNc1ccoc1N,0.2091
OC(C#C)C1CN2CC12,0.2601
C1CCC2(C1)CCOC2,0.3048
Cn1c(=O)ccnc1N,0.195
CCCC1(COC)CO1,0.3344
c1[nH]c(c(c(=O)n1)N)F,0.1837
CC1(O)CC(=O)C11CN1,0.2036
CCC1OCCN=CO1,0.2593
CC12OC1C(=N)OC2=O,0.2379
C1CC2C1C21CCC=C1,0.2455
CC1(C)CC2CC1O2,0.3276
CC1(O)CC2(CO)CC12,0.3124
OCC1OC2(CC2)C1O,0.2857
CCC1(O)CC2(CO2)C1,0.3182
Cc1cnc([nH]1)CC=O,0.1685
ON=C1C=CCC11CN1,0.1848
OCCC12CC1C1OC21,0.2897
COC1=NC(C)C(=N)N1,0.2429
CC1C2C3COC1(C)C23,0.3219
Cc1c(=O)[nH]nc(n1)N,0.149
CC(C)C1(CC#N)CN1,0.2917
C1C2OC3C4C3N1C24,0.2736
CC1CCC1(C)CC#C,0.3074
CCC1(CO1)C#C,0.2867
CC1(C)OC1C1CN1,0.3319
COCC1(O)CCC1O,0.3176
CC1C(C)C(C)(O)C1=O,0.2194
C(C#CCO)C#CCO,0.2737
CC1(CC=CCO1)C#C,0.2673
CC1(C)C2COCC1O2,0.3165
CC12COC3C4C(C14)C23,0.3242
CC(CCC=O)C#C,0.227
CCC1(C)CCN2CC12,0.3038
CC1(O)CCC(=O)NC1,0.2691
CC1C(CO)CCC1=O,0.2194
CC1(OC2CC1C2)C=O,0.2107
CCC(C)(C)C(=O)C,0.2284
CC1C2COC3C2C13C,0.3105
OC1(COCC=C1)C=O,0.2067
CC1(COCOC=N1)C,0.2597
ON=C1CC(C=C1)C#C,0.1927
CC1OC11CC=CC1=O,0.1816
CCN1N=NN(C)C1=N,0.1998
CC1(CO)CC1C#N,0.311
CC12CC3C4C3N1C24,0.2964
OC1C2CC3N2C13C#C,0.2624
CC1C(=O)CC1(C)C#N,0.2218
C1C2C1C1=CN=NN21,0.2369
CC1CC1N1N=NN=N1,0.2525
CC(=O)OC12CC1OC2,0.2466
N#CC1C2OC3CN1C23,0.2384
CC1C(O)C=CC11CO1,0.2441
O=CC1NCC(=C1)C#N,0.1759
CN1CC1CCC=O,0.207
CC(C)Cc1cnn[nH]1,0.251
COC(=O)C1(C)CCN1,0.235
O=C1CC=CC2CC2N1,0.2288
N=COCC(=O)C#C,0.1873
OCC1CC23CC(C2)C13,0.3009
C1C=C2C=CC3C2N13,0.1722
CCC12OC1(C)CC2O,0.3103
C#CCC1COC1C#C,0.2684
CC(O)CC(C)(O)CO,0.2945
CC1(CC1)C1CC1C=O,0.2274
CC1(C(=O)NC12CC2)C,0.2778
O=C1NCC1CC#N,0.2793
c1c(c2c([nH]1)nno2)N,0.1672
CC1C2C3CC1(C)CN23,0.3054
CC1C2C3C4C(N13)C24O,0.2794
CCC1=NOC=CC1=N,0.1925
CC1(C)OC2C(CO)C12,0.3101
OC1C=CC2=CCOC12,0.1967
N=C1NN=NC(=N)N1,0.1798
O=C1CCN2C3CC12C3,0.2006
FC1=CNN=CC1=N,0.1759
CCC1(CO1)C1CC1C,0.3328
OC1C2NC11CC(=O)C21,0.2038
O=CN1CCCC2CC12,0.2552
CC12CC(C)(CO)C1O2,0.3186
COC1CC2(CN2)C=C1,0.2426
OC1C2CC1C(=O)CC2,0.2253
CC1COCC(=C1)C#C,0.2115
CCC1OC2OC1C=C2,0.2413
C#CC12CC(CCC1)O2,0.268
CC1C2CN2C=CC1=O,0.1896
O=CCCC1CC(=O)N1,0.2249
CC1C(C2COC2)N1C,0.2903
CN=C1OCCNC1=N,0.1993
Cc1c([nH]nn1)N,0.2297
CC[NH2+]C1CC1C([O-])=O,0.2727
CC#CC1CC(C)C1=O,0.2088
OC1C2C3OC1COC23,0.3013
CC(O)C1NC1C#C,0.282
CC(C1CO1)C(=O)CO,0.2313
CC(=O)C(CC=O)C#C,0.217
CC1C(CC1=NO)C=O,0.2204
CC1CC2NC2C11CO1,0.3079
CC1NC1C1=NOC=C1,0.2443
O=C1CC2C3CN1C23,0.2324
CC1(OCC(=O)O1)C#N,0.2763
CC1=CC2(C)CC1C2=O,0.2404
OCC1OC(=O)C2OC12,0.2467
CC1C(C)C(=O)C=C1N,0.2063
OC1CCCC2CC12O,0.3115
C1C2CC=CC3OC3C12,0.2324
c1c(c([nH]n1)CO)C=O,0.2068
CN(C)c1c(nno1)N,0.198
OC1C=CC2C3CC1C23,0.2393
C1CC(C1)CC2COC2,0.3168
Cc1c(con1)NC=N,0.2137
N=C(C=O)N1CCC=C1,0.1434
CC12OC1C(C)(O)C=C2,0.2439
CNC1=NNN=NC1=N,0.1702
CC1(CN1)C#CCC#N,0.2664
C1Cc2c(onc2N)C1,0.2378
CC12CCC(CO1)C2,0.3141
CN=C1N=NOC(N)=N1,0.2396
OC1CC2CC1OCO2,0.3114
C#CCC1=CCC(=O)N1,0.2139
CC1(O)C2C3OC1C23O,0.2983
NC(C#N)C1(O)COC1,0.2766
CC1=NC=C2C(O)CN12,0.2429
CC1CC1CC#CC#C,0.231
NC(CC(F)(F)F)C#N,0.2888
COC(C#N)C(C)N,0.2804
CC12OC34CC=C(C13)C24,0.1919
C1C2C3C4OC4C1CN23,0.3069
CC1CCC(=O)CN1,0.1965
CC(O)C1C2CC(=O)N12,0.2355
NC(=[NH2+])N1C=CC([O-])=C1,0.1091
c1c2c([nH]c(=O)[nH]2)on1,0.1998
N#CC12CN3C1CCC23,0.2721
CC1C2C1C1(C)OC21C,0.2915
CCN(C)CC(O)C#N,0.2677
CC(=O)Nc1cnco1,0.2418
CC1(O)CNC(=O)C1O,0.2744
CN=c1c(=O)ocno1,0.1992
C#CC1OC1C1CCC1,0.2796
CN1C(=N)NN=NC1=O,0.183
OC1CC(=O)CCC=C1,0.226
C#CC1=CNCC1=NO,0.1605
CC1CCC11C2CC1O2,0.3079
N=C1OC=NN1CC#N,0.2207
OC12CN3C1C=CC3C2,0.226
C1CC2CC1CC1OC21,0.3353
CCC(C)NC(=N)C=O,0.1679
CC1C(O)C2(CN12)C=O,0.213
COC1C2CCC12CO,0.2964
OCC1CCN(C1)C=O,0.2659
CC1C2C=C(CN12)C=O,0.1645
CC1=CC(CO)OC1,0.2459
Cc1cc(oc1C#C)C,0.1914
CN1CC2(C1)OC2C#C,0.2337
CNC(=[NH2+])[C-](C#N)C#N,0.2006
CC(C)COCC(=O)N,0.2809
CC(C)C1C(C)OC1C,0.3104
CC12CC(C1N2)N1CC1,0.3223
O=C1CC2OCC12C#N,0.2169
OC(C=O)C1(CO1)C#C,0.222
CC1C2CN(CC#N)C12,0.2491
N#CC1NC2C3CC3C12,0.2583
CC12COC(=O)C1(C)O2,0.2504
NC1CC(OC1=N)C#N,0.2589
CC(C)CC1OCCO1,0.3389
c1c[nH]cc-2ncnc12,0.1816
COC1(C)C2NC1C2O,0.3034
c1c2c(on1)C=CC2,0.1879
C1C(=CNC1=O)C=O,0.1815
c1c[nH]c(c(c1=O)N)O,0.2043
CC(CC#C)CN1CC1,0.2901
O=C1OC2CC3OC3C12,0.2818
O=CC1CC=CC(=O)N1,0.2029
CC12CC3(NC1C23)C#N,0.2419
CC1CC(C1)C(=O)C#N,0.2081
CC(C)(CCOC)C#C,0.313
CCC(C#C)C#CC#N,0.2383
C#Cc1ccoc(=O)n1,0.169
COC(=NCCO)C#C,0.2122
CC12C3CC1C(C3)C2O,0.3142
CC(C)C1(CO1)C1CN1,0.3243
C1CC1(C(=O)N)N2CC2,0.2683
N=COC1CCC(=O)C1,0.2202
CC(C)C#CCCC=O,0.2189
OC1CC2C3CC3(O)C12,0.2799
C1C=C(CC1=O)CC#N,0.2256
N=C1OC2CN(C=O)C12,0.2493
CCN1C(=N)OC=C1O,0.2243
C1CC1C12C3CC1CC23,0.3129
OC1CN2C3CC1C23,0.2974
CCC(O)C(O)CC=O,0.2302
CC1N2CC3C2C13CO,0.2835
CC1C(C)C2OCCC12,0.3035
CC1COC1CC#N,0.2955
CC1C=CCC1(C)CO,0.2623
OC1C2CC3CN2C13,0.2928
C1CNc2c1[nH]c(n2)O,0.2181
C1OC2C1C1CC2C=C1,0.253
[NH3+]CCOC(=O)C([O-])=O,0.2231
CC(=O)N1CC1C#N,0.2538
OCC#CC1OCC=C1,0.251
c1cc([nH]c1N)O,0.2395
C1OC2COCC22OC12,0.3165
OC12C3C1C1OC3C2=C1,0.1882
N=C(C#N)N1CCC1=N,0.1966
C#CC1CC2CC(C1)O2,0.2878
OCC1NC1(CO)CO,0.2964
c1c(noc1N(=O)=O)O,0.1808
OC1C2C=CC(O)C12O,0.2258
OC1C2OC3C(O)C3C12,0.2893
O=C1C=CC2OC2C1=O,0.1418
OC1CCC=C(C1)C=O,0.1971
CN=CN(C=N)C=N,0.222
O=C1CN2C3C4NC13C24,0.1954
CCCCOC(=O)C#C,0.2379
OC(CC=O)C=O,0.2048
CC(O)C(O)CNC=O,0.2556
CCCOCC(C)C#N,0.3076
CCOCC1=NCCO1,0.2623
CC12COC1C1(CN1)C2,0.2973
OC1C(CC1C#N)C#C,0.2839
CC12CC3(O)CC(O1)C23,0.3085
CC(=O)C1(CO1)C(=O)C,0.2091
CC1(O)CC1(C)CC=O,0.2242
CC12C(C#C)N1CC2O,0.2638
CC(=O)c1ncon1,0.1927
CC1=NC2CC2(O1)C=O,0.217
CC1OC=NCC1=NO,0.2439
C1C2C3N1C2C31COC1,0.3097
CCc1ccncc1C,0.2283
NC(=O)C1COC(=O)C1,0.2652
O=CC#CC1OC2CC12,0.1866
CC(C)(C(C#C)C#C)O,0.2812
CC1C2C3CC2C13C#C,0.2909
CC(OC(N)=[NH2+])C([O-])=O,0.2647
NC(=O)CC1OC1CO,0.2697
COC(=O)n1nccn1,0.2375
N#CC12CC(O1)C21CC1,0.2505
CN=C1N2CC2C1(C)O,0.2399
CC12CC1(O)CC=C2,0.246
CC(O)C1=NC(O)=CN1,0.2272
C1OC11CCC=CC=C1,0.1878
c1c2c(c[nH]1)COC2,0.2439
C#CCOC(=O)C#C,0.2323
CCC(C=O)C(C)=O,0.1993
c1cc([nH]c1)COC=O,0.2228
OC1CC2(C1)NC2C#N,0.2804
c1c(nc(nc1F)F)F,0.2484
OCC12CC=CC1CO2,0.2627
OC1CC(C#C)C2OC12,0.3018
O=C1NCC1NCC#N,0.2573
CC12CC3C4C1N4C3C2,0.3091
Cc1[nH]c2c(n1)C=CC2,0.1908
OC1C2OC1C(=O)C2O,0.204
CC1=CC2CC1(O)C=C2,0.216
CC1(C)C(=O)C2CC12O,0.2255
CC1=NNC(=O)OC1=N,0.1932
CC1(CO1)C(=O)NC=O,0.2147
CCC1CCC(O1)C=O,0.2184
C1C2CC3OC1C1C2C31,0.321
C(C=O)C#CCO,0.2209
OCC12OCCC1C2O,0.2982
CCCOC(C#N)C#N,0.2762
C1CC2C3C4C3C2C4O1,0.3331
CCCC1(CC1)CCC,0.3399
CC1C2OCCCC12C,0.3175
Cc1nc(co1)NC=N,0.2114
C#CC12CC(C1)CO2,0.273
O=CCC1(CC#N)CO1,0.2237
Cc1ccnn1CC=O,0.2015
CC(=NO)C1(C)CC1O,0.2359
Cc1[nH]nc(n1)CC#C,0.2619
OCC12C(O)C1OC2=O,0.2586
c1c(c(c(=O)on1)F)F,0.1855
CC1CCCOC(C)O1,0.3301
N=C1CC(COC=O)O1,0.2784
OCC#CC1C2CC1C2,0.2693
CC12CC1C(OC2)C=O,0.2145
N=C1OC=C(C=N1)C#N,0.1642
CC1N(C)CC1(C)C#N,0.2609
NC1=C(O)C=NC(=N)O1,0.1602
N=C(CC=O)OC=O,0.2231
C1C(=O)CC1(CC=O)O,0.2147
O=CCCC1(CN1)C=O,0.218
CC1CC2(C1)COCO2,0.327
N=C1OC=C(N=C1)C#C,0.152
C#CC1COC2CC1C2,0.289
c1c(c(c2n1CC2)N)O,0.2197
CCC1C=CC2OC12,0.2442
CC1C(O)C1NC(C)=O,0.2671
CCC1=C(COC1)CC,0.244
CC1C2NC(=O)C1C2=O,0.2112
CC1CCC=CC(C)=C1,0.1942
O=C(CC1CN1)C#C,0.187
c1(=O)c(=O)[nH]nn[nH]1,0.2073
OCC1=CC2CC1C2,0.2374
CC1C2C(C)N1C2C=O,0.2049
CC12CC3OCC(O1)C23,0.3165
CC12C3C4C3C1(C)C24C,0.2902
OCC(=O)N1C2CCC12,0.2447
CCC1(CC1)C1CN1C,0.3026
C#CCOC1CCCO1,0.2956
CN(C(=N)C=O)C(=O)N,0.1658
N#CCC12CC1OC2,0.2743
NC(=O)C12CC3C(C1)N23,0.2681
CC(C)(COCC=O)O,0.2278
CC1CC2(C)CC2(C)O1,0.3023
CCOC1C2C3CC1N23,0.3152
OC1CC2OC(=N)OC12,0.3003
CC(C)C(C)OCCO,0.3268
C1CC12COC(=O)C=C2,0.2152
N=C1OC2C3C2C(=O)C13,0.2309
OCCC1C(O)C1C#C,0.2807
CC1(C)OC1C#CC#N,0.2228
OCC1C(O)C1(O)C#N,0.2625
OC1CC1(O)C#C,0.2653
C(CC#N)C=O,0.2276
N=C1CCOCCCO1,0.2723
CC1=CC2OC2(C1)C#C,0.2367
CC(C)C1C2OC2C1=O,0.2118
C#CCC12NC1CC=C2,0.2484
O=C1NC2=C(OCO2)O1,0.1947
N=COC1CNC(=O)C1,0.2621
[NH3+]C1C2CC1(N2)C([O-])=O,0.26
O=C1C=CC(=O)C11CO1,0.1471
NC(=O)OC1CC1CO,0.315
CN1C2CC(=O)C(O)C12,0.1996
C1NC1C12CC1CO2,0.3003
OC12CC(C1)(C=O)C=C2,0.2155
CC(NCC=O)C(N)=O,0.2089
CC1CCCOC1C#C,0.2894
CCC(C)C(CC)C=O,0.2262
CC(=O)N1C2C3NC3C12,0.2608
CC1CC(C)(O1)C1CN1,0.3172
CC(=O)C(=O)C(=O)NC,0.1577
CC1(CC#C)CN2CC12,0.2803
CCC(C)C1=CC=CN1,0.2429
COC(=O)c1ncon1,0.2284
C1C2C3OC(CN12)C=C3,0.2206
C1OC23C1CC21CC3O1,0.2766
CC1OCC2(CN2)C1C,0.3105
CC1(O)COCC11CN1,0.3002
[O-]C(=O)C1C[NH2+]C1,0.2745
CC1CC2C1C=CC2O,0.2517
CC(C)(C)C1COC1,0.3088
CC1CC1C(=O)C#C,0.2032
c1c(oc(nc1=O)N)N,0.2206
c1c2c(ncn1)C=CC2,0.1957
C1CC2CCC3OC23C1,0.3296
c1coc(n1)C#CC#N,0.1737
CN=CNC(=O)C1CN1,0.2301
CC12COC3(C)C1CC23,0.3229
CC#CCN1CC1(C)C,0.2674
CC12OCC3C4C3C1C24,0.2877
O=CC1CN2CC(=O)C12,0.2
C1CNC(=O)CNC1=O,0.2538
CC(O)C(=O)N1CCC1,0.264
c1c(cnc(c1O)O)O,0.1896
C1CN=C(CN1)OC=O,0.2083
CC1CC=CC1=O,0.1922
c1c(c(co1)CO)CO,0.2436
C(C(CO)(CO)C#N)O,0.2954
[O-]C(=O)CCC1C[NH2+]C1,0.2715
CCCN(C)C(=O)NC,0.2933
C1OC11CC2OCC1O2,0.3377
COC1CCC(O)C1O,0.3023
CC1(CO)CC1C1CO1,0.332
C(=O)n1c(nc(n1)N)O,0.1916
CC(C)C1OC2CC12C,0.3023
Cc1c(c(n[nH]1)N)NC,0.234
N#CC12COC1C1NC21,0.2601
CC1C2C=CC(O)C12C,0.2339
CCC(=O)C(=O)C#N,0.1492
CC1CC1C(C)(O)C#N,0.3014
c1c2c([nH]c1N)CCN2,0.207
CC1=C(OC=C1)C1CO1,0.2228
CN(C=O)C(CO)C#C,0.264
CC(C)C1(CCO1)C=O,0.2096
c1c(c(c(=O)[nH]n1)N)N,0.1676
CC1CN1C1CC1C#C,0.2503
C1c2c(oc(n2)N)CO1,0.2275
C1OC1C12CC1N1CC21,0.282
CC1CCC(=O)C1,0.2228
CC(=O)C(=O)C#CCO,0.1526
NC12C3CC(OC1=O)C23,0.2548
O=CC1C2COCC12,0.2203
CC12CC(O)(C1)C2CO,0.3194
CC#CCC12CCC1O2,0.2987
NC1C2NC1(C#N)C2O,0.2471
CC1CC2CC(O)C2C1,0.3192
CC1C(C)C1(C)C1CO1,0.3298
CCC(C#C)C1(O)CC1,0.2943
Cc1cc(n[nH]1)C(=O)C,0.2056
c1ccc(cc1)N(=O)=O,0.1926
N#CCCC1COC=N1,0.2692
CC#CCC1COC1=N,0.2692
O=CCC(C=O)C#C,0.2095
c1c(c[nH]c1N)C=O,0.1795
CC1CC(CC=C1)C#C,0.2645
CN1C2C3NC2C13C,0.2871
CC1C2OC2C2OC12C,0.3176
CC1OCCCC(C)=C1,0.2475
COC12CC1CC(C)C2,0.3252
CCC1(C)COC1(C)C,0.3111
O=C1NC2CCCC2N1,0.2969
COc1c(c([nH]n1)O)N,0.2629
OC1C=CN2C=CN=C12,0.187
CCCC(CC)C(C)C,0.369
CCCC1NC1CO,0.3178
CNC(=O)OC(=N)C#N,0.2122
CC1CC2C(C)C(=O)C12,0.2139
CNC(=O)N1CC1C=O,0.2074
CN1C=CC(=N)NC1=O,0.1965
C1OC2C1CC21COC1,0.301
O=CC12NC1CC2C#C,0.2167
CCC(=O)CC(C)(C)O,0.2272
CN1C(CC1=O)C#N,0.2715
OC1=CN=C(N1)OC=N,0.207
COC1CCC=CCC1,0.2597
O=CN1CCC1C1CN1,0.2608
COCC1CN1C,0.3053
CCn1cc(oc1=O)C,0.2334
COCC(O)C1(C)CC1,0.3236
CC1NC11C=CC2NC12,0.2361
Cc1cccccc1=O,0.1557
O=C1CC=CC2CCN12,0.2402
CC1C2C3CN3C(=O)N12,0.2356
CC(C)(C(=O)CC=O)O,0.215
CC1C2OC1(C)CC2C,0.3285
CC12OC(C=C1)C2C#N,0.233
CC12N=COC3CC1C23,0.2541
CC1COC(CO)CO1,0.3172
C1C2CC1C1OCOC21,0.3512
CC(=O)c1ncc(o1)N,0.1667
CN1C2C3C(O)C2C13C,0.2836
COc1nccc(=O)o1,0.1957
c1c(onn1)C(=O)CO,0.1891
COc1c(cc[nH]1)C=O,0.1912
N=C(OC=O)C=O,0.1802
CCOC1C=CCC1=O,0.2141
CC1C2N1CC21CN1,0.2928
CN1C2C1C1CC2C1=O,0.2368
CC12CC(O1)C(=O)OC2,0.248
Cc1c(nco1)NC,0.2023
CC12C=CC3(C)C1CN23,0.2064
CC1CC(O)C1CCO,0.319
CC1(N)C[NH2+]C1C([O-])=O,0.2611
C#CCCC1=CCOC1,0.2445
OC12C3NC1CC(=O)C23,0.2161
Cc1cc(=O)[nH]c(=O)o1,0.2239
CC1OCC(=C1)C1CO1,0.2336
CC(CCO)OCC#N,0.2741
c1c(=O)c(noc1N)O,0.1941
NC12C3CC1(NC23)C#N,0.2465
C1CN2C3C4NC3C24C1,0.2817
c1c(c([nH]n1)O)N2CC2,0.2435
N=C1C=CNC(C=O)=N1,0.1312
CC1CN1C(C)=O,0.2556
CCCc1nc([nH]n1)C,0.2613
OC1CCC(O)C2CC12,0.3244
C#Cc1cc(oc1)N,0.1948
CC1CC11C(C)CC1=O,0.2178
CCC(N)(C#N)C(C)N,0.2653
CC#CC1(CC=O)CN1,0.2145
C1C(=CC(=O)CO1)C=O,0.1418
CC12OC3C1OC23,0.2982
CC1=CC2OC2C1O,0.2386
CCC1OCCCC1=O,0.2098
C1N=C2OC3C1C23,0.1616
OCCC1(CC#N)CO1,0.2925
CC1C(C)C1(O)C=O,0.2163
CC1C=C(C)C(O)C1C,0.2603
CCOC(=N)C(C)CC,0.2931
CCCc1c(nno1)O,0.2014
CC(C)C1CCC1,0.3685
CCOC1COC1=NC,0.2634
CC1NC11C2NC1C2O,0.3041
CCN1CC1C(=O)C=O,0.1374
OCC1(NC1C=O)C=O,0.2037
C1CC12CNC(=O)CN2,0.2587
CC(C=O)C1OCC=C1,0.2099
CCCCOC(C)C#C,0.2928
OCCC(=O)C(O)C#N,0.2289
CN(C)c1ccccn1,0.187
Cn1cnc(c1C#N)N,0.1914
CC#Cc1cnnn1C,0.2088
O=CC1OC2CCC2=C1,0.1971
CC1OC1CCCCO,0.3372
CC(O)C1COC1C=O,0.2161
N#CC1NCCC2OC12,0.2724
CC1CC(=O)CC(C)=C1,0.2245
OCC1(O)CC(O)C1O,0.2984
NC1(CC1)C(O)C#N,0.2674
CC1C2CC2CC2CC12,0.3343
FC1=COC(=N)C=C1,0.1588
c1c(c(on1)CCO)N,0.2066
CC1=CC(=O)NC(=N)C1,0.2041
CC#CC(=O)C(=O)C#C,0.1522
NC1=C(O)OC=NC1=N,0.1644
N=COCC1(CN1)C#N,0.2749
C(C#CC=O)C(=O)C#N,0.1748
CCC#CCC1CCC1,0.2976
O=C1OC2CC(C2)C1=O,0.1818
C#CC1CC(CC#N)N1,0.2625
CN=C1OC2CC1C2C,0.2765
N=C1OCC=CC=C1,0.1727
CC#CC(=O)N(C)C=N,0.2054
CCOC(=O)NC,0.3158
CCC1(O)C2NC2C1=O,0.2118
c1cnc([nH]1)CC(=O)N,0.2242
c1c[nH]c2c1cncn2,0.1933
CC1=CC2(C)OCC2C1,0.2506
C(C(=O)C(=N)N)O,0.1973
CCOCCCC(=O)N,0.2795
CC(O)CCN1CC1C,0.2948
C1CC1(CO)C#CC=O,0.2039
O=CC12CC1C1(CC1)O2,0.2117
CCC1NC1C(O)C#N,0.2759
COC1CC=CC1(C)O,0.2646
C1CC11C2CN3C2CC13,0.3113
C(CC#N)CC(=O)C#N,0.2124
N#CC12C3CC1=CCN23,0.167
CN1C(=O)NN=NC1=N,0.1839
Cc1ncc(nn1)C=O,0.1473
CCOC12CC3OC1C23,0.2951
Cc1c(c(nn1C)N)O,0.2263
c1cnnc(n1)CCO,0.1634
COC12C(O)C1OC2=N,0.2491
CC1=C(N)C=COC1=N,0.1663
CC(NC=O)C(C)C#N,0.2769
CC1NC11C2CCC1O2,0.3136
COc1ncno1,0.2578
C1CC2CC1COC=N2,0.2633
CCC1CC2C(C=O)C12,0.2179
CC1CCN=C(C)OC1,0.2551
N=C1CCN2CC(C2)O1,0.2349
CC([NH3+])C(=O)[N-]CC#N,0.2729
OC1C2CC3CC2C13,0.3327
C#CCOCCOC=O,0.282
CCNc1cc[nH]c1,0.2277
CC1CCC1(O)CO,0.3081
C1CC#CCN=COC1,0.2401
C1CCC2(CC1)CCO2,0.312
CC12CC1C1CCC=C21,0.2401
CC1(C)C(NC1=O)C=O,0.2106
CC(=O)C1COC1=N,0.2307
CC12COC1C(N2)C#C,0.2658
Cc1c[nH]c(c1C)C#C,0.1996
CC#CCC(C)C=O,0.2208
CCC(C)C(O)C1CN1,0.3171
CC12C3OC(C1=O)C23O,0.2227
c1[nH]c2c(n1)CC=C2,0.1842
C1C2CCC3CC3CC12,0.3369
C1CC11CC2C3OC3C12,0.3201
CC1C2CC2CC2OC12,0.3374
CC12OC3C1C2CC3O,0.2948
NC1C2C3C1N=CN23,0.2175
OC12C3C1C1(C#C)C2N31,0.2311
CN=C1OC=C(C)N=C1,0.1569
CC1OC1(C#N)C1CO1,0.2825
CCC(=O)C(O)CCO,0.2311
O=CCC1C2C3CC2C13,0.2276
c1cnc([nH]1)C(=O)N,0.2127
c1coc(=O)c(c1O)N,0.1611
NC1(CCC11CC1)C#N,0.2914
CC12CN1CCC2O,0.2939
c1cc([nH]c1)O,0.2449
OC12COC1CC(=O)C2,0.2221
c1cnc(c(c1N)N)F,0.2111
C1CC12C(=O)CC(=O)N2,0.2104
CC1(N=CN2CC12)C#C,0.2431
CC1N2CC1(O)C(O)C2,0.2788
CC(C)C(C)C1OC1C,0.3397
CN=COC1C(C)C1O,0.2591
OC12CC1C1CC2CO1,0.3235
COCC12CC1OC2C,0.3081
CC1NC1(C#N)C1CO1,0.2848
CC1OC11CC(O)C1O,0.2985
OCC1OC11CCOC1,0.3176
OCC(O)CC1(O)CC1,0.3031
C1C(CN1C=O)(CO)O,0.2667
N=C1NC=NC1CC#C,0.2257
CC12CC1C1(C)CC21C,0.2836
c1c(cnc(c1F)N)O,0.1808
COC1OC(C)CC1O,0.3408
OC1C2CC1(O)C21CN1,0.3027
COC1CC2(C1)CC2,0.3267
C#CC1CC11C2CC1O2,0.2757
CC(CO)CC(O)CO,0.3161
CC1C2C1C1(C)C(O)C21,0.273
CCC(O)CC(O)C#C,0.2949
C1C=CC23C4OC2C4N13,0.2134
CCCC(C)(CC)OC,0.3192
COC12CC1CC=C2,0.2474
CN(C=N)c1cnco1,0.2093
[NH3+]C1COC1C([O-])=O,0.2612
CC1CCC=C(C)CO1,0.2496
C1CC1(CNC=O)C=O,0.2225
CC1CC2=C(N)C=CN12,0.2211
CC1C2C(C)N1C2C#N,0.2566
C1C2C3OCCN=C3N12,0.2253
O=CC1CC11C2CC1C2,0.2296
CCC1CC1(O)CO,0.3027
CC1(CCC([O-])=O)C[NH2+]1,0.2734
COC(C#N)C1CO1,0.2948
CC1CC(=O)C2C(O)C12,0.2252
Cn1cc(ncc1=O)O,0.1433
Cc1cccc(c1F)O,0.2217
CC1OC2CC2(C)C1=O,0.2182
OC1CC2(CC1C2)C=O,0.2206
NC12C3OC1C(O)C23O,0.259
C1OC2CNC3C1C3O2,0.2646
CC1(O)CC1CC1CC1,0.3215
CC1C(C)C11COC1=O,0.2762
COC1CC2OC2C1C,0.3214
CN(CCOC=O)C=O,0.2559
CC1(O)C=CC(=O)C1=O,0.1385
N=C1NN=C(NC=O)O1,0.191
C1C(=CC(=O)OC=N1)N,0.2018
OCCC1CC(CO)C1,0.3379
NC1=NC=COC1=N,0.1647
CC1OC(=N)CC2NC12,0.2817
CC1CCOCCOC1,0.3198
Cc1cc(n2c1CC2)O,0.2318
Cc1c2c(n[nH]1)NCC2,0.2193
OC1CC2CC12OC=O,0.2721
Cc1ccc(nc1)C,0.2218
CC(CO)CCCC=O,0.2288
OC1(CCC1C#C)C=O,0.2077
CC1NC(=O)C1(O)C=O,0.2111
O=C1NC2C(O1)C2C#C,0.2754
COc1ncnnn1,0.1657
CC#CC1OC1C,0.2743
OC1C2C1C1=CN=NN21,0.239
COC1CC(C)=CCO1,0.262
CN1CC2C(OC=O)C12,0.2151
CC12CC3=CCC1C23O,0.1718
CC(O)CCCC1CO1,0.3314
C1C2CC11CCOC1O2,0.3315
N=C1OC2CC3C2CC13,0.2785
N=CN1C(=O)COC1=O,0.2363
CC(=O)C1CC1CC=O,0.2186
CCC(O)C(C)C,0.3336
N#CCCC1CC=CC1,0.2654
CC1COCC1C1CO1,0.3225
COCC1CC2(CC2)O1,0.301
C#CC1NCC2CC1O2,0.2585
CC1OC1(C)CC(N)=O,0.269
NC(=O)C[NH2+]CC([O-])=O,0.2548
CCC1NC1COC,0.3244
C#CC12OC3CC1OC23,0.2602
O=CC1CN=C(N1)C=O,0.1706
NC1(C#C)C2OC(=N)C12,0.2312
C#CC1NC1(C#N)C#N,0.2454
Cc1cc(c([nH]1)O)C#N,0.2166
OC1C2NC(=O)NC12,0.2861
CC1OC1CCC=O,0.229
CC12CC3(O)C1C3(O)C2,0.2816
CCN(CC(C)O)C=O,0.2695
CC1(C)NCC1(O)C#N,0.2517
C1CC2COCOC2C1,0.3379
NC1=CN=CN=CC1=N,0.1321
C1OC2C3CCCC2C13,0.3054
OC1CC2(O)C3OC1C23,0.2893
CC12OCC1C2N1CC1,0.2835
COC12CC1CC21CN1,0.3085
Cc1c(cno1)C=O,0.2063
O=C1NC2C3OC3C2N1,0.2984
CCc1c([nH]cn1)O,0.24
CC12CC3CC1C23O,0.3025
CC(=O)C1(C)C2COC12,0.2196
CCN(C)C(C)(C)C#N,0.2617
OC12CC1C1OC21C#C,0.2408
N#CCC1COC11CC1,0.2697
OC12CC1C(CC2)C#N,0.3045
OC1C2COC(=O)NC12,0.274
CC1(CCC1O)C1CO1,0.3298
Cn1cncc1O,0.2454
CC1CC2OC1C2C#C,0.2971
OC1CNC(=O)CC1O,0.2669
CCC(=NO)C1CC1O,0.2449
CC1N2CC3CC2C13O,0.2888
CC12C=CC3CC1C2O3,0.2369
CC(C#N)C(O)C1CC1,0.3199
CC1=CC2CC2(O)C1=O,0.1878
CC(=O)Nc1c[nH]nn1,0.2255
COC=NC(C=O)C#C,0.2104
O=C1OC2CC2C2NC12,0.2504
OC1C2NC2CC11CO1,0.3
ON=C1C2CC1(O)C=C2,0.2388
OC12CC(C1)(C=C2)C#C,0.239
C1CC2(COC2)C=C1,0.2589
CC(O)C12OC1C1CC21,0.2822
CC1(O)CC2NC12CO,0.2876
C(C1CO1)C1COCO1,0.3417
C#CC1(COC1)C=O,0.2187
c1c(cnc(c1O)F)O,0.1986
CC1OC(=N)COC1=N,0.2725
OCC1OC1(CO)C=O,0.2192
CC1OCC1C1CN1C,0.3071
CCC12CCN1C2C=O,0.2054
N#CC1(C#N)C2CC1O2,0.262
CC(=O)N(C=NC)C=O,0.2221
CCC#CC1C(O)C1O,0.2665
CC1C(O)C1(C)C,0.3106
CC12CC(C)(C1)C21CO1,0.3429
COC1C2COC12C#N,0.2401
CC1(CN1)C1CCCO1,0.3128
OCCC1=CC2CC2C1,0.243
CC1(N)CCC1(N)C#N,0.2635
CC1=CC2OC2CC1,0.2372
O=CC12CC(C1)CC2,0.224
CC#CC1(CN1C)C#N,0.2469
CC1N(C)C1(C=O)C=O,0.1917
N=C1NC(=O)C2OC12,0.2281
C#Cc1c(oc(=O)o1)N,0.1964
O1C2C1C1C3C4C3C1C24,0.3199
CC1CC(CC#N)N1C,0.2606
CC1(O)C2CC(C)(C)C12,0.3178
C1C2CC3OCOCC123,0.3455
COC12CC(C1)C2O,0.3287
C1C2COCCOCC12,0.3114
CC1NC(C#N)C1C,0.2688
C1CC1CCCC#N,0.3239
C#CC1=CC2CC2C1,0.1996
CCC(C)(CC)C1CC1,0.3466
C(CO)C(=O)CNC=O,0.2184
CC1CC(C)C(O)C1,0.3268
CC(=O)C12OC1C1CC21,0.2097
Cc1c[nH]c(=O)c(=O)o1,0.1748
O=C1CC2(CO2)CC=C1,0.1881
OC(C#C)C12CCC1N2,0.2987
c1c(c(c([nH]1)O)C=O)O,0.1627
c1cnc(nc1)C(=O)N,0.186
CC(C)C1(O)CC2NC12,0.2943
C1CC23C4C5C4N2C5C13,0.2992
C1CN(C1=O)C(=O)C#N,0.2049
N=C1COCC(N1)C=O,0.1897
C#CC1C=CC2CC1C2,0.2507
OC1=COC(=N)C=C1,0.1547
OCC1CC2OCC12,0.312
CC1CC1C1CC1C,0.3292
OC1CC(O)C2CC12,0.3187
OCC12CC1C(C2)C#N,0.3051
NC(=O)C1NCC1=O,0.1974
C1Oc2c(onc2O1)N,0.2233
CC1CC=C2C(O)CC12,0.2424
OCC#CC1CNC1=O,0.2603
CN1C2C(=O)C1C21CO1,0.2342
CC(C)(C=O)C(F)(F)F,0.2281
OC1CC23COCC12N3,0.2939
O=C1CC(C=C1)C#C,0.1914
NC1C2OCC2C1C#N,0.2614
COC1C2CC1OCC2,0.3151
CN=C1CC(CO1)C#C,0.2711
CC(=O)NC(=N)OC,0.2489
NC1=CC(=O)NC1CO,0.2161
OC12C3C4CC1CC2C34,0.2978
CC1C2CCC12NC=O,0.2655
CC(C)C1COCC1=O,0.2148
COCCC1CC(C)C1,0.336
CCCNC(=O)C#C,0.2312
CC(C#N)N(C=O)C=O,0.215
CC1(CCC1C#C)C#C,0.2792
CC(=O)CC1OCC=C1,0.2244
COC1C2C(C)C2C1O,0.307
OCC1NC11CC2NC12,0.3029
O=C1CC2OC3C2NC13,0.2059
CCC1(CO)NC1C,0.3031
CCCC12C3C4C3N1C24,0.2808
CC#CC(=O)CCOC,0.2064
O=C(C#N)C1NC1C#C,0.1812
C1OC2CC3OC3C=C12,0.2369
O=CC1CC2COC2=N1,0.2179
NC(CO)C1(CN1)C#N,0.2748
c1cnc-2cncoc12,0.1566
C[NH2+]C[C-]1OC(=O)C=C1,0.1584
COCC1CN(C1)C=O,0.2669
C1N=CNC=NCC#C1,0.1969
CC1CC2=C(C1)C=CO2,0.2301
c1coc(cc1=O)O,0.2016
CC1C(O)C(N)=CC1=O,0.2033
CC1CC(O)(C=O)C1=O,0.197
CN=C1COC(C)O1,0.2789
OCC(O)C1=NC=NO1,0.2274
N#CCN1C2C3NC2C13,0.257
CC(O)CC(C=O)C=O,0.2101
NC(=O)C(O)C(=O)CO,0.205
OC(COC=N)C#C,0.2724
CC(C)(CC#C)CO,0.3088
CC1CC(=O)NC=C1C,0.2096
CCC1CCCCC1=O,0.2233
CCOC(CN)C#N,0.2698
CCC(=O)C1(CN1)C#N,0.2339
N#CC12CCC(N1)C=C2,0.2511
COC(C)CC1(C)CO1,0.3288
OC12CC(C1)C(=C2)C#C,0.1912
O=C1C2CC3C4C2C1N34,0.2088
c1cnoc(=O)c1CO,0.1848
CC([NH3+])C1=NNC=C1[O-],0.2239
OCC1CC=C2CCC12,0.246
CCC(N)(C#N)C(C)C,0.2877
COc1cc[nH]c1CO,0.2204
O=C(C#N)C1OC1C#N,0.1987
c1c2n(cn1)CCC2=O,0.1974
CC1OC(CC1=O)C=O,0.2051
C1C2N3C1C21OCCC31,0.3057
CC1C2COC2CC1O,0.3232
CC12CC1C1CC1C2,0.3208
COC1CC(=O)CC1O,0.2225
CC(C)(C=O)C#C,0.2213
OC1C2COC1C1NC21,0.3127
N=COC1CCOC1=N,0.2615
CC(CC=O)N(C)C=O,0.2139
O=C1CC(CN1)C1CO1,0.274
O=C(C#C)N1C2CCC12,0.2044
O=C1OC2(CC12)C#N,0.2616
CC1OCC1(O)C#N,0.2726
OCC(O)C1(CC1)C=O,0.215
OCC12NC1CC21CN1,0.2906
OCC1CC2OC12C=O,0.2153
CC(O)(CO)C#C,0.2879
c1c2c([nH]n1)C(=O)NC2,0.2286
CC1=NC(=N)C=CC=N1,0.1599
CC#CC(O)(CO)C=O,0.2112
CC1=CC(=O)C(=N)NC1,0.1589
OC12CC3C4C(OC14)C23,0.3047
OCC1NC(C#N)C1O,0.2576
COC1(C)CC1CC=O,0.2253
OCCCC1(CO1)C#N,0.2769
CCC1C2OC2(C)C1C,0.3277
CC12OC1C1(CC21)C#C,0.2503
CC(O)CC(C=O)C#N,0.2303
CC1=CC(O)C2(CO2)C1,0.2616
Cc1c(ocn1)C(=O)N,0.213
COCC1C(C)C1C#C,0.2879
O=CC1CC2CC12C#N,0.217
CC12OC1C1CC2CO1,0.3237
CC#CC1CC2OC12C,0.2856
OCC1CC(C1)=NO,0.2487
CC12NC1C1CCC1=C2,0.238
CC#CC(C=O)N1CC1,0.2119
OC1=C(F)C(=O)N=NO1,0.1682
N#CCC1=CCN2CC12,0.2235
CCC(CO)OC(C)=O,0.275
CC1=NCC2NC2CO1,0.2596
OC(CC1CO1)C=O,0.2299
CC12CCCC1C(=O)N2,0.2768
CC1C(O)CC=C1C#C,0.2081
CC12CC1(C#N)C(O)C2,0.2792
c1c(oc(n1)N)C2CC2,0.2224
CC12CC(=O)C1(C)CO2,0.2165
CC12CC1NCC(=O)O2,0.2465
CC(C)CC(=O)C#N,0.2101
OC12CC1OCC2C#C,0.2744
C#CCC1(CC1)CC=O,0.2234
C1C2N1C13CC21CCC3,0.2681
CC1=CC2NC2C11CN1,0.2335
c1cn(c(n1)CO)C=O,0.1935
CC12CCC3C(N13)C2=O,0.2241
CC1COCC(C)=C1C,0.2524
COC(=O)CC1CC1O,0.2382
OC1COC11COC1=O,0.2477
CC1(CO)CC11COC1,0.3048
N#CC1CC(N1)C1CC1,0.2696
c1c(nco1)NCC=O,0.1778
c1c(cncn1)CO,0.2101
CC1CC(C)(CC#N)O1,0.2883
OCC1(CC1C#C)C#C,0.262
CC(C)(C)n1ncnn1,0.2665
COCC1(CO1)COC,0.3232
CC1C2C3CC3C(C)C12,0.3078
CCCC1CNC1C#N,0.2652
ON=C1CC(C=C1)C#N,0.1911
CC1CC=CCN=CO1,0.2326
c1nnn(n1)CCC#N,0.2615
NC1(C#N)C2NC1C=C2,0.2188
COC1C2C3C2C1C3C,0.3263
CC1OC(CC#C)C1C,0.2971
O=C1CC(O1)C1CO1,0.2864
CN1CC23CC(O2)C13,0.2705
CC1C2C=CCC12C#C,0.2406
COC(C)(C)C1CC1C,0.3211
CCC1CCC1(O)CO,0.308
CC(C)CN=C(C#N)N,0.2165
COC1=NC(=O)N=NO1,0.2643
OC1C2NC(C=O)C12O,0.2153
C1C2C=CC3CC=C1C23,0.2343
CC1CC1C(=NO)C#C,0.199
CC1N=COC2CCC12,0.2746
NC(C#N)C(O)CCO,0.2795
C(C(=O)CO)C(=O)CO,0.2171
CCCC1C(C#N)N1C,0.2599
CC1C2C3C=CC1C23O,0.2361
COc1cncnc1,0.2074
CC1COC(C1)OC=O,0.2783
N=COC1COC1C=O,0.2131
C1C2C3CC4OC2C13O4,0.3215
C(C=O)N=CNCC#N,0.2156
ON=C1CC2COC2C1,0.2504
NC(=O)COCC1CN1,0.2688
O=C1OCC2NC12C#C,0.2392
C#Cc1c(=O)[nH]ncn1,0.1519
CC1CC(CCCO)C1,0.3425
FC1=CC(=O)NC(=N)N1,0.2118
CC1C(O)CC(C)=C1C,0.2529
O=C1CC23CCC2(C1)O3,0.2288
c1c[nH]cc1NCC#N,0.217
C1OC2CC11NC1C=C2,0.2261
CC12CN3CC3C1C2O,0.2829
OC1C2(CC2)CC11CO1,0.2992
CC(=O)CNC1COC1,0.204
C(=O)(N)NC(=O)N,0.2695
CC(C)OC=NCCO,0.2599
NC(=O)CC1OC1C=O,0.2172
CC1OC1C1COC1=O,0.276
C#CC1C2CCC12,0.2931
OC1CN(C1)C1COC1,0.2966
N=C1OCC1C1CCC1,0.2887
C1OC1C1C2C3OC2C13,0.3125
CC1NCCC=CC1=O,0.1779
CC1C2C3CC(=O)C3N12,0.1933
C#CC1CC2CC=CC12,0.2575
O=CC1OC(=O)CC=C1,0.2083
O=CC1C2CC(=O)C1N2,0.195
FC1=NOC(=N)C(=O)O1,0.194
OCC1(CC1O)OC=N,0.2761
CCOC(C)C1CCO1,0.3228
C#CC1C2C3C2C2C3C12,0.2813
OCC(CC1CC1)C#N,0.3055
CC(CO)OC1CC1C,0.3131
COC1C2OC1C2CO,0.2989
CC(=O)CN1CC1CO,0.1912
OC1CC2CC2C1C#C,0.3051
CC1(C)C(C=O)C2CN12,0.2086
c1cnn(c1)CC=O,0.2087
CCn1ccncc1=O,0.169
CCC1CC2C(CO)C12,0.3227
CC1C2CC3OC3(C)C12,0.3356
OC1C2OCC3OC3C12,0.299
C1CC(O1)C1C2CC1O2,0.306
CC1CC=CC1C#N,0.2628
NC(COC=N)C#N,0.2734
CC1=CC(=O)OCCC1,0.2194
C#CC1(C#N)C2CC1C2,0.2807
CC(O)(CO)CC1CC1,0.3231
CC1C(C)C1(O)C1CO1,0.3075
CCC1(CC1O)C#N,0.31
CN(C)C1(C)CC1C#N,0.2415
C1C=CC=CC(=O)O1,0.1818
CC12NC1C1(CC1)C=C2,0.2391
CC1(CC1)C#CCC=O,0.2103
CC(C)C(O)C#N,0.3105
CCc1cc(co1)OC,0.2283
OC1CC23CC(C2)C13O,0.2713
N=C1OC2(CC2)C11CN1,0.2604
C(=O)c1c(c(n[nH]1)N)N,0.1547
c1c2c([nH]n1)COC2,0.2469
C1CC(C1)CNC(=O)N,0.3007
O=COC1C2NC1C=C2,0.2244
CCC1(C#N)C(O)C1O,0.275
O=C1NCC(O1)C1CC1,0.313
CC(CO)COCC=O,0.2293
C#Cc1cc([nH]c1)O,0.2077
O=C1CCC2CCC2C1,0.2238
CC1C2OC3C1C2C3=O,0.2102
CC(C)C(=O)NCC=O,0.2195
CC1C2CC2C1(O)C#N,0.2898
CC(CO)(CO)N1CC1,0.3085
CN1C2CCC(O)CC12,0.2863
CCc1ccn(c1)C=O,0.1916
CC1C2CC=CCC12,0.2689
c1[nH]nc(n1)CC=O,0.224
CC1C2C3C=CC1C23,0.235
CC12CC3C(C1)OC23,0.3214
CC1CC(C)=CC1=O,0.1932
CC1CN(C=O)C(=N)O1,0.242
CN1C2C3C4N3C2C14C,0.2915
CN1CC1CC(=O)C=O,0.131
Cc1c(c[nH]c1O)OC,0.231
CC1OC2(C)C3OC1C23,0.2874
COC1CC1OCCO,0.3122
CC(CCO)C(=O)C#N,0.1929
O=C1N=NON=NC1=O,0.1732
CC1CC(O)C11CN1,0.3074
CC(O)C1C(C)C2CN12,0.2983
CCC12CC(C1)C2=O,0.2505
C1COC2(COC2)C=C1,0.2569
C1CC2(CC2)OCOC1,0.3276
CC12OC3C4C(OC13)C24,0.3376
CNC(=O)C(O)C#C,0.2699
CC1CC1(O)C1(C)CN1,0.2934
CC1(O)C2C3CC3C12,0.2779
CC1C2N=COC2C1=O,0.2019
CC12C3C4C5C1C(C23)N45,0.2864
CC12CC(O)C(=O)C1N2,0.2025
C1C(CO1)CNC(=O)N,0.2934
CC1OCC2(CC2)C1=O,0.2168
CC(C)N1CC1CCO,0.2966
C#CC12COC1C1CC21,0.2726
COC(=O)CC(F)(F)F,0.287
CNC(=O)C1=CCOC1,0.2112
O=C(C#C)C1CN2CC12,0.1769
c1c(nno1)C=O,0.2017
O=C1NC2COC12,0.2481
Cn1cncc1OC=O,0.217
CCN=COC(C)CO,0.2734
CC1CC=CC1(C)C#C,0.2602
OC1(COC1=N)C1CN1,0.2566
C#CCCC#C,0.3006
OCCC12COC1C2O,0.2911
c1c(c2c([nH]1)OCO2)O,0.2181
CCC1OC1COC,0.3383
C#CCC1(CCO1)C#C,0.2731
CC1C(NC1C#N)C#N,0.2608
CC1C2CC3(CC3)OC12,0.3016
CC1N=C2OC3C2C13O,0.1698
O=CC1C=CCN2CC12,0.2077
CNC(=NC)C(=O)C=O,0.1508
CC1(O)C=CC2CC1C2,0.2506
CC1(CC(O)C=O)CO1,0.2286
C1N2C3C4C5CC13C2C45,0.3003
CC1C2OC1C21CCO1,0.3117
CCC(C)C1=CC=CO1,0.2364
CC1(O)C2NC(=O)OC12,0.2931
CCOC1=NOC(=N)O1,0.267
CC1(CN1)C(O)CC=O,0.2318
CC1(C)C(O)C11CCO1,0.2832
CC1CC(=NO)C(C)=C1,0.1944
CN(C)C(=O)OCC#N,0.2609
CC1C2OC(=N)C12C#N,0.2743
NC(=O)C1CC1CC#N,0.2724
CC1(CC1NC=O)C#C,0.2567
CCNC(=O)CN1CC1,0.2752
O=C1CC2(CC12)C1CC1,0.2328
O=CC1NC=NC1C=O,0.194
N=C1COCCO1,0.2732
CC(=O)C1NCC1O,0.2203
C(C#N)N(C=N)C=N,0.2269
N#CC1C2OCC=CC12,0.2467
c1c(nc(o1)N)C(=N)N,0.201
CC1C2CC3C4C3C2C14,0.3234
CC(=O)N1CC(N)C1=O,0.2072
CC1(CCNC1=O)C=O,0.2121
CN(CCC#N)C1CC1,0.2527
C1C2NC3=COC=C3C12,0.2185
CCN(C)C1(CC1)C#N,0.2681
CCC1=CC(NC1)C#N,0.2374
OC1CC2OC3(CC3)C12,0.2959
OC12CC1OC=NCC2,0.2596
CC(=N)N(C=N)C(=O)N,0.2323
CC1OC1CC1CCC1,0.3494
CCC1OC1C(=O)C#C,0.1974
CCC1(CO1)C(C)O,0.3236
C#CC1OC2C3CC3C12,0.2633
OC12CC1(CC2)C=O,0.2047
CC1C(C)C1C#CCO,0.2679
CC1C(=O)COC1(C)C,0.2189
CC1(O)CCCCOC1,0.3173
O=CC1OCC(=C1)C#C,0.1848
O=CC1C2OCC3C2N13,0.2099
COC(=O)C(C)C(C)=O,0.222
OC1=NC(OC=N)=NN1,0.2416
OC1CC2(C1)CCOC2,0.3109
CN=C1NC(F)=CC=N1,0.1611
C1COCCN1CC=O,0.2036
CC12CC(O1)C2(O)C#C,0.2632
CC(=O)NC1C2CC1C2,0.2745
O=COC1CC(=O)C=C1,0.1902
Cc1noc(=NC)o1,0.2356
[NH3+]CC1=NOC(O)=C1[O-],0.2045
CC12CN3C1C(C=O)C23,0.2044
CCC1=CCOC1C,0.2484
CC1=CCCCC1O,0.2599
CC12C3CN1C2(C3)C#N,0.273
N#CC1CN2C3CC1C23,0.2863
CC12CC3C1CC3(C)O2,0.3301
C1OC2C1NC1COC21,0.2771
c1c(=O)c(c[nH]c1N)F,0.202
C(C#N)c1c([nH]nn1)N,0.2283
CCc1c[nH]c(=O)n1C,0.2261
CCOCC1CC1C#N,0.2897
C(CO)NC(C=O)C=O,0.1765
CC1OC1C1=CC=CO1,0.2222
CC1C(C)C11CN2CC12,0.2998
COCCC1CC2OC12,0.3371
CCN=CN(C)C=O,0.2364
CC1C(O)C(C)C1C#N,0.3003
COCC1CN1CC=O,0.2188
CCc1cnoc(=O)n1,0.1713
O=C1C2C3CN2CC1C3,0.1957
C(COCCO)C(=O)N,0.2796
CN=C1CC(C)(O1)C#C,0.2668
OCC1CC11C2CC1C2,0.3295
OC12CC1CN1CC1C2,0.2983
COC1CC2(CC12)C#N,0.2822
NC1(CO)COC1=O,0.245
OC(C=O)C1=CNC=C1,0.1835
CC(O)C1(C)NC1C=O,0.2198
CC1OC(=O)OC1(C)C,0.3308
NCC(N)(C#C)C#N,0.2624
Cc1nc(no1)N(=O)=O,0.2033
CC1=NC(C)(CO)CO1,0.2639
CC12CC(C)(O)C1C2O,0.2912
Cc1coc2n1ncn2,0.2367
CN1C2COC2C1=O,0.2496
c1c2c(on1)OCCO2,0.2145
C1C2CN=C3CN=C1N23,0.2289
OC1CC2CC1C1CC21,0.3287
CC12OC3(COC13)C=C2,0.2257
OC12CN3C4CC3C1C24,0.3062
CC1CC(CC2CC2)O1,0.3301
CC1=NOC(O)=CC1=N,0.1839
N=C1N=NON=C1C#C,0.1731
CC1COC2C(CO)C12,0.3092
O=CN1CC2CC12C#N,0.2431
c1[nH]c2c(n1)nn[nH]2,0.2188
CC12C(O)CC1OC2=N,0.2844
OC1=CC=NC(=N)C=N1,0.1586
CC12CNCC1(O2)C#N,0.241
Cc1c(c[nH]c1O)C#C,0.2038
CC12COC(CO)C1O2,0.3353
C#CC(C#C)OCC=O,0.2294
CC1OC(C)C1(O)CO,0.2932
CN=C1OC=C(O)C=C1,0.1525
Cc1cc2cnoc2[nH]1,0.2116
C(COC(=O)C#N)C=O,0.1976
OCCC1NC(=O)C1O,0.271
NC1=CC([O-])=CNC1=[NH2+],0.1382
CCC1CC11COC=N1,0.2498
CC(=O)C1CCC1C#N,0.2281
N=C1NC(=NC=N1)C#N,0.1511
N#CC12CC(O1)C1NC21,0.2465
CCC(OCC#N)C#N,0.304
CC1CC2NC2C1(C)O,0.3086
COC1C(O)C(C)C1O,0.296
O=C1OCCC2COC12,0.2485
OC12CC=CC3OC1C23,0.2195
CC(O)(C[NH3+])CC([O-])=O,0.2761
CC1OC1C1=NC=NO1,0.2406
COC1C(C)OC1(C)C,0.3173
c1nn2c(o1)nnn2,0.2426
CC1CC2CC12OC=N,0.2758
OC(C#N)C(O)C1CN1,0.285
Cc1c(cno1)N2CC2,0.2312
CC1(CC2(CN2)C1)C=O,0.2268
CN=C1OC2CC1C=C2,0.2265
CC1CC(C=C1)C(C)=O,0.214
OC1C2C3CC1C23,0.3235
C1C=CC(=O)C12COC2,0.1901
C1C2C3NC3C3(CN3)C12,0.2895
OC12C3OCC(C13)C2=O,0.2296
Cc1c(nn[nH]1)C(C)C,0.2433
c1c(onn1)C(=N)N,0.1919
C(C1CN1)C1=NON=N1,0.1849
CC(=O)n1c(cnn1)N,0.1736
O=CC1CN=C(O1)C=O,0.1847
C#CCn1ncnn1,0.2596
COCC12OC3C1OC23,0.2969
CCCC1CCC11CO1,0.3286
CCC1C2C3C=CC1N23,0.2124
CCC1(OCCO1)CC,0.3276
CC1CCOC(=N)C1O,0.2747
ON=C1C2OC1C2O,0.2519
c1cncc(c1F)C#N,0.2166
O=CC12NC1C1CC2O1,0.2176
CCOC12C3C4C3C1C24,0.2993
c1c2n(c(=O)[nH]1)CCO2,0.2463
CN1CC1C1CC1,0.3122
CN(C)CC(=O)C=O,0.1349
FC(F)(F)C1CC(=N)O1,0.2945
CCC(CC)C1CC1O,0.3332
CC(O)(C1CN1)C(N)=O,0.2566
Cn1nc(nn1)C#N,0.2439
CC(=O)NC(=O)NC=O,0.2184
CC12CC1C(C=O)=CN2,0.1761
Cc1cc(c(cn1)C)O,0.236
CC1=CC(O)C2CCC12,0.2492
N=C1CCCNC(=O)N1,0.2509
CC(=O)Oc1cn[nH]n1,0.242
CC(C#N)C(C)(N)C#N,0.2892
N=C1OCC=CC1C#C,0.2477
CCNc1nnn(n1)C,0.2061
CC12CC3(OC1C23)C=O,0.1979
C1OC2C1C1C3OC1C23,0.3015
OC1CCCC1NC=O,0.2806
CC1CC2N=COC2O1,0.2756
OC1CC2(CO2)C=C1,0.2507
CCC1(CCC=C1)OC,0.2586
CC1CC(N)=CC(=N)O1,0.2023
CC1OC2CC=CC12O,0.2478
CC(C)OCC#N,0.2923
CC1C(C#N)C1C(C)=O,0.2233
NC1C2C(=N)OC12C#N,0.2293
CCOCc1ccn[nH]1,0.2587
C1CC1(C(=O)CC#N)O,0.2267
CCN(C(=O)C)C(=O)C,0.2172
CC12C3CC1OC=NC23,0.2512
CC1C2CCCC(O)C12,0.3224
CC1CC2CN2C1=O,0.2392
CC(C1CN1)C(C)=O,0.2216
C#CC12CC1C1(CC1)C2,0.2685
CCC1C(O)C1C1CO1,0.3056
OCC12CCN1C2C#N,0.2643
c1cc-2cncoc2c1,0.1361
CC1CCCCOC1=N,0.2848
Cc1cc(oc1)C2CC2,0.2258
NC(=O)C1OCCC1O,0.2599
Cc1coc(n1)N(=O)=O,0.176
COC1C(O)C1(O)CO,0.2871
CC1N=C(C)OC2CC12,0.2702
ON=C1CC2NC2C=C1,0.1867
CCCC(N)(CN)C#N,0.2691
C#CCCC1OC1C#N,0.2626
c1c2c(n[nH]1)onn2,0.1968
C(C(CO)CO)C(=O)N,0.2785
COCC1(NC1C)C=O,0.2176
O=C1NC2C3OC2C3O1,0.2986
c1ncnc(n1)N(=O)=O,0.1941
CCCC1C2CC1(C)C2,0.3733
CCOCC1(CC)CO1,0.3355
CCC12CC(O)(C1)C2,0.3373
c1c(cnc(c1O)O)N,0.1839
CN1CC11COCC1O,0.3204
CCC1CCC(=O)N1,0.2734
CC#CC1C=CC2OC12,0.2364
COCC1(C)CC1C,0.3339
CC1CCCCN1C=O,0.2683
CC#CC1OCC(C)=C1,0.254
CC1C(O)C1(N)C#N,0.2691
CCC1=CCCC=CC1,0.2477
O=C1OC2OC1C1OC21,0.2617
N=COCC(=O)OC=N,0.2333
N#CC12CC(C1)OC2,0.2809
OC1C2OCC1(O)C2O,0.2777
CC(=NO)C1C(O)C1O,0.2114
CC12CC3C4C1C2(C)N34,0.297
C1CC23C4COC2C4N13,0.2827
OC1C(O)C1NC=O,0.2481
CC1CC2CCC(O2)O1,0.3277
CC1CC2(C1)OC2C=O,0.2173
CC(=O)C1CCC=CC1,0.2297
N=C1CC2=C(N1)N=CN2,0.1989
O=C1OC2OC1C1NC21,0.2588
Cn1c(nc(n1)O)N,0.2425
C1C2CC1COCCC2,0.3143
COC1(C)CC=CC1C,0.2638
Cc1cc(cnc1O)O,0.1894
CCn1ccc(c1)CO,0.2419
c1c2n(cn1)C(=O)CO2,0.1767
C#Cc1cc[nH]c1O,0.2169
Cc1cc2c(o1)C=CC2,0.1741
OCC1C2CC3C2CC13,0.34
CCC(=O)OC1CC1,0.2835
CC(C)C1CC1C(C)C,0.3454
c1c2c([nH]n1)NC(=O)C2,0.2122
OC1C=CC2CN2C1=O,0.2408
OCC1(OC1C=O)C#N,0.2133
CC1(CO)NC1C1CC1,0.2871
CC1OC2=NCC(=O)C12,0.207
CCCC1(CCCC1)O,0.3283
OCC12CN1CC2C#N,0.2805
CCC1CC(C)(C1)C=O,0.2279
CC(C)(C)NC(=O)CO,0.275
CC(CO)OCC(C)=O,0.2141
CC1COC(=O)C1C,0.2771
C(CC(=O)N)C#CC=O,0.2026
CC1(CN1)C1NC1C=O,0.2182
c1c[nH]c(cc1=O)F,0.2052
C1CN(CCOC1)C=O,0.2666
CCC1C2CN1C2C#N,0.2558
O=C1C=CC2OC12,0.1729
CCCC(O)(CC)CO,0.3157
C1CC(C1)OCCO,0.3364
CC12NC1C1C2OC1=N,0.2655
NC1=CC(=NO)C2CC12,0.1823
CC1=CC(C)(O)C(=O)C1,0.2174
CC1(CCOC1=N)C=O,0.2264
CC12COC3CCN1C23,0.3194
CC(=NO)C#CC#C,0.1754
COC(C)CC(C)O,0.3179
O=C1CC2CCCC1O2,0.2131
CCOCCNC(=O)C,0.2784
CC(C)C12CN1CC2O,0.2923
CC(C#C)C1(CO1)C=O,0.2152
C#CC1CC2(CCC2)O1,0.2716
OC1C2OC11CCCC21,0.31
Cc1c(=O)c(con1)N,0.162
CCC(C#N)(C#N)N,0.2779
CC12CC3C4OC4C1C23,0.3121
OC12CN3C(C=C1)C23,0.2236
C1OC23C4CC2N(C4)C13,0.2703
CC(C)C1OCC1C#N,0.2838
CC1=CC(=O)NCCN1,0.2029
COC(=O)C#CCC=O,0.2183
CC12C3CC(C13)C2C=O,0.214
CC1=CCC2NC12C=O,0.2037
OCC1(COC=O)CO1,0.2634
CC(C#C)C1CN1C=O,0.2542
Cn1c(=O)[nH]nnc1=O,0.1839
O=C1CC2(CN2)C2CC12,0.2216
CNC(=O)C(=O)C1CO1,0.1696
CC1(O)C(N)C1C#N,0.269
C1CC12CC3(CC3)OC2,0.3172
COC1CC2(CC2O)C1,0.3151
C1CC23CCC12C1NC31,0.2869
CC(C)C12OCC1C2C,0.3012
Cn1cc(c(=O)cn1)O,0.1749
CC1C(C=O)C1(O)C=O,0.1943
CC1CN(C=O)C(=N)N1,0.2351
c1c(oc(=O)cn1)C#N,0.1594
CC1CC(N)C(N1)C#N,0.2737
C1C2C3C=CC4C1C4C23,0.2371
C1Cc2c(nno2)NC1,0.1873
CNC(C#N)C1CC1O,0.2569
CCC1(CC(=N)O1)C#C,0.2788
CC(C=O)C(=O)NC=N,0.1914
O=CC12CC1COC2,0.2269
CCC(=O)NC1CC1C,0.2697
OC12CN3C1C3(C2)C#N,0.2755
Cc1cc(c([nH]1)N)C=O,0.1794
CC1CC(C#N)C(C)=C1,0.2583
N=COC12CC1OC2,0.2582
Cc1c(nno1)NC=O,0.2039
NC(CNC(N)=O)C#N,0.2708
COCC1(OC1C)C#N,0.2808
CC1(CCC1=O)C1CC1,0.2164
CC12CCC1COC2=O,0.2712
CCC1(COC1)C1CO1,0.3237
O=C(CC1NC1)N1CC1,0.2498
OC1(CC1)C1CCC1=O,0.2188
c1(=O)nnonn1,0.1485
CC12COC1(C)C1NC21,0.309
CC(C)C(C)C(O)C=O,0.2316
C1CN1c2c([nH]nn2)N,0.2209
COC=Nc1ccno1,0.1857
CCC12CC1(CO2)C#C,0.2602
CC#CC1CC1CC=O,0.2152
CCC1(CO1)C(=O)C#C,0.1963
N=C1CC2(O1)C1CC2O1,0.2743
CC1CC2C3CC12C=C3,0.2284
C1C2OC1C1NC1C=C2,0.2327
CC(C)(C)C1CCO1,0.3177
CC(=O)C(O)CCO,0.239
CC1CCC(C)=C1C,0.2534
Cn1ccc(c1)C#C,0.2185
NC(=O)CC1CC1C=O,0.2288
O=C1NC2C3C2C2C3N12,0.2704
N#CC1CCC1N1CC1,0.2753
CC(N)C(C#N)C(N)=O,0.2721
O=C1CC2CCOC12,0.1957
C(C1CO1)C1=CON=N1,0.2297
N=C1NN=NC(=N1)C#N,0.1477
CC1CCC(C1)C(N)=O,0.2773
c1cn2c(cn1)ncn2,0.1923
CC1(CC1)CC=O,0.2244
CCC(CC1CO1)C#C,0.3042
CC1C=CC2N3CC12C3,0.2177
CCOC(=N)OCC,0.3172
CC12NC1C(C#N)C2N,0.2691
CC1=CNC(=O)NCC1,0.2247
CN1C2C(O)CC2C1=O,0.2697
CC1C2NC=NC12C#C,0.2442
CC(C)C#CC#CC#N,0.1934
CC1=CC2(CC2)OCC1,0.2413
CC(=O)OC1CCC1,0.2832
CC(=O)C#CC(=O)NC,0.1983
CCC1COC(C)C1,0.3202
CC1C(CO)C1C#N,0.2958
CC1C2CC1OC(C)O2,0.3318
COC(=O)CC#CC#C,0.2308
Cc1c(nn[nH]1)N,0.2164
NC1=NOC(=O)C(=N)O1,0.1876
CCC1CN2N=CC=C12,0.2656
CCC1=CCC(=O)C1C,0.2225
C1C2C3C4C=CCC24N13,0.2367
CC12CC3OC1C(O)C23,0.2956
OC1CC2C1OC2=N,0.282
CC(C)C1OC(C)C1O,0.2996
C1C2OC3OC2C=CC13,0.2348
OC1C2CCCCOC12,0.3044
CC(C=O)C1NCC1=O,0.2079
N=CN1C(CC1=O)C#N,0.231
CC1C2OC3CC1OC23,0.322
CC(=O)c1c(nn[nH]1)N,0.1645
OC12CC1C1COC21,0.305
C1CC23CC(COC12)O3,0.3009
OC1=COC(=O)NC1=N,0.2015
OC1CC(=O)CC=C1,0.2267
CC12CN1C(=O)C=C2N,0.2046
O=C1C2COC1C1CC21,0.2069
CC1(C)CCOC1CO,0.3182
C1CC2C3C4C3C2C4C1,0.3313
O=C1CN=C2OCC2N1,0.2468
OCC(C#C)C(O)C#C,0.2761
C1CC23OC4C(NC24)C13,0.2848
CC12NC1C(=N)OC2=O,0.2366
N=C1OCC1C1CO1,0.2869
OC1C2CCC12C#N,0.2839
CC(C)C(=N)N(C)C=O,0.2394
CC1C2OC11COCC21,0.3103
C1CC=C(C1)C2CCC2,0.2522
CC1(O)CC2OC12C#N,0.268
c1c[nH]nc1OC=O,0.249
CC(=O)C#CC1CC1O,0.201
CC12C=CC3C1COC23,0.2322
N#CC1CC2C3OC3C12,0.2977
OC12CC(CC1=O)C=C2,0.2073
CC(C(N)C#N)C1CC1,0.2802
CC(=O)CCC1CCO1,0.2351
OCC1C2CC2C11CO1,0.3141
C1CN1C12CC3C(C1)C23,0.3098
CNC(=O)C1COC1=O,0.2533
CC(C#C)C1OCC1=O,0.2195
COC1CN=CNC1=O,0.2226
c1coc(=O)c(c1F)F,0.1822
C#CC1C=CCC11CN1,0.2542
N=C1COCCCO1,0.2767
Cc1cn2c(n1)CCC2,0.2466
CNc1cncnc1,0.1862
NC(=O)COC(=N)C#N,0.2082
OC(CC1CCC1)C#C,0.295
c1cn(c(=O)[nH]1)CCO,0.2264
O=CCC(CC#N)C#C,0.223
NC1C2CC1(O2)C#N,0.2444
CN=C1ON=NC(O)=N1,0.15
CC1(CC1)n2cncn2,0.2689
Cc1cc(c(cn1)F)O,0.2298
CC(C)C1OCCC1C,0.3166
CN1CC2(CC#N)CC12,0.249
CC12CCC1(O)C(=N)O2,0.2786
C1CC1(C#CCC=O)O,0.2092
CC1(COC(=N)N1)C#N,0.2606
CCC1(C)CN1CC#C,0.2642
CC1=C(COC1)CCO,0.2458
CCC1CC1C=O,0.2286
CCC1COC(=N)CN1,0.2498
CC1CCC(C)N=CO1,0.257
CCC(=O)CCOC=O,0.2343
CC(=O)C1OCC2OC12,0.2279
C1OC2=NCC3NC3C12,0.2615
O=CC(CC1CC1)C#N,0.2269
C1CC2(C1)CCCO2,0.315
OCC1C2OC(=N)OC12,0.3005
CCN(CCO)C(=O)C,0.256
C1CC11OC2CC1C=C2,0.2307
CCCC=O,0.2292
N#CC1OCC2CC1O2,0.276
C1C2CC3CC4CC1C234,0.1856
CCC12CCC1(O2)C#C,0.2592
CC1CC2(NC12C)C#N,0.2565
CC12NC1CC(=O)C2=O,0.149
C1OC1C1CC11CCC1,0.3328
C#CCC12C3C4C1N4C23,0.2615
CN=C1OCC11NC1C,0.2627
CC1=NCCOCCO1,0.2582
CCC1NC1C1(O)CC1,0.2932
N1C2C3NC2C13,0.2876
C#CCCC#CCO,0.2759
Cc1c2n(nn1)C=CC2,0.2042
CC1(C)CC2COC12,0.3165
C(c1c(nc([nH]1)O)N)O,0.2166
COC1C2CC(O)C12O,0.2997
O=CC12CC3N=CN1C23,0.2076
CC1(O)C(CO)OC1=O,0.2606
CC12C3COCC1CN23,0.3095
CC12OC3C1C2C31CC1,0.3093
CC1C(O)C(C)C1C#C,0.3041
CC1CCC1NCC#N,0.263
COCCC1COC1=N,0.2765
C1C2C3CC1OC=NC23,0.2507
O=CC1CC2CC2C1,0.2288
Cc1c([nH]c(c1N)O)C,0.2321
Cc1c(=O)oncn1,0.1643
CC1C2CC3C4C3N2C14,0.2997
CNC(=O)C(CO)C#N,0.2759
CCC1C2CC(C=O)C12,0.2204
C#CC1OC11CC2NC12,0.2576
OC12CCC3OC1C2O3,0.2921
O=C1CC2N1CC21CN1,0.2382
C1CN1CC(=O)CCO,0.2283
CCNC1(CC1O)C#N,0.258
CC1C2CC1(O)C(C)=C2,0.2389
NC1C(OC1=O)C1CO1,0.249
CC12OC1C(=O)C21CC1,0.2126
CC1CC1N1C=CN=N1,0.2548
OC1C2C3C4CN(C13)C24,0.2927
c1[nH]c2c(n1)OCC2,0.2141
c1c[nH]nc1C#CCO,0.2199
CCCC(=NO)CC=O,0.213
CCC(CO)C(=O)C#C,0.2037
CC12C3N=CN1C(=O)C23,0.2085
CC1OCCC2CC1O2,0.3193
CC12C3CC(C)(C13)C2=O,0.2431
COC12C(O)C1CC2C,0.3125
OCC1(CCC1)OC=N,0.2742
CC1CCC(C)=CC=C1,0.1864
N=C(CCC#C)OC=O,0.2366
C1C2CC3(CCCC3)C12,0.3268
CC(C)(C#C)N(C)C=O,0.2694
OC1CN2N=CN=C2C1,0.2682
Cn1c2nnnn2cn1,0.2156
CCC1=NCC(=O)N1,0.2353
C(C#N)C(=NCC#N)N,0.26
FC1=CC(=N)OC(F)=N1,0.1912
OCC(=O)C12CN(C1)C2,0.199
CN1C2C3C(O)C2C13,0.2859
O=CC1OCCC2CC12,0.2214
C(#N)c1c([nH]c(n1)N)O,0.2103
CC12OC3C4CC3C1C24,0.3308
CC1C2C3N2CC13O,0.2881
CC,0.4426
C1C(=O)C(C(=O)CN1)O,0.1969
O=C(C#N)C1CCC=C1,0.176
CC1C(O)C2CN12,0.2923
CC(C)(C)c1n[nH]nn1,0.2609
OC1CCCCOC1=N,0.2695
CC1C2CC1C(=N)O2,0.2855
NC1=CC(=N)OC=C1F,0.1654
N=COC12CC1NC2=N,0.2495
NC(=O)C12CC(N1)C2O,0.2596
CCCC1=CNC(=N)O1,0.2214
CNc1cc(on1)CO,0.2185
CC12CC3C4C1N2C34C,0.2973
c1[nH]c2c(n1)[nH]nn2,0.212
CC(C)OC(=O)C1CO1,0.2624
CC1C2OCC1(O)CO2,0.301
CN=C1C=C(C(=O)N1)N,0.1657
CCC1(C)CC1CO,0.3346
CC1C23CCC12CCC3,0.3024
C1COc2c1oc(n2)O,0.2171
OC1CC(C=O)C11CO1,0.2219
CCC(C)(CC)CC#N,0.3427
OCC12NC1C1(O)CC21,0.2655
Cc1c(cc([nH]1)NC)O,0.2187
OC1COCC11CO1,0.2952
CC1C(C)(O)C1(O)CO,0.2831
CC1(O)CC2=CCCC12,0.246
C1CC1C12CC1CCC2,0.3264
CN1C2C3CC3C2C1=O,0.2638
CC1(COC1=N)C=O,0.2228
CC1(CO)C2CN2C1=O,0.2296
CC(C#C)C1=COC=C1,0.2424
NC(=O)C(O)C(O)CO,0.2825
CC1(O)CC(O)(C1)C=O,0.2327
CC1(CO)OC1CC#N,0.3011
CCC1(C#N)C2CCN12,0.2761
C#CC1(CCC1)C#C,0.2852
CC(O)C1OC2CC12O,0.2955
OC1CN2C=NC(O)=C12,0.2278
CCOC(=NC)C(=O)N,0.2071
CC1C2OC1C21CN1C,0.3102
CC(C=O)N1CC(=O)C1,0.2112
OC12CCC1C1(CC1)C2,0.3158
Cc1ccc(cc1)O,0.2131
CC(C#N)C1CC(=N)O1,0.2933
CC1(CCC(=O)O1)C#C,0.2764
CC1CN(C=O)C2CC12,0.2588
CC(C)CC1OCC1C,0.3206
ON=C1CC2NC12C#C,0.2289
O=C1OC2C3CC2C1N3,0.2434
CCN=C1C=CCCO1,0.207
c1c(c(no1)CO)C#N,0.2334
CCC(C)(C)OCC,0.3242
OCC12COC1COC2,0.309
Cc1[nH]c(=O)[nH]n1,0.2422
CC1CC(C2CC2)C1C,0.3406
N=C1NC2=C(O1)N=NN2,0.2018
CC(OC(=O)C#N)C=O,0.2024
CC12C3C4CC1=CC4N23,0.1195
CC1C2C(=O)CC12O,0.2286
CCOC(C)(C)C1CO1,0.3302
CC1CC11C=CCC1O,0.2465
CC12CC(C1)C2CC=O,0.2272
CC1OC2C3N4CC13C24,0.3031
O=CC1NCC(=O)C=C1,0.1724
C1C(CC12COC2)O,0.308
CCC(C)C1(CC)CC1,0.3457
CCC#CC1(C)CN1,0.2702
c1cc2n(c1)CC(=O)O2,0.1895
CNC(=O)C(CO)C#C,0.2734
C1CC23CC(C4OC24)N13,0.2877
CC1CN=C(O1)C1CN1,0.2567
CC1(CO)CCNC1=O,0.2724
OCC1OC1CCC#C,0.3144
CC(=O)NC1(CC1)C#N,0.2651
CC12CCC1C2(C)C#C,0.2901
O=CC1CCCOC1,0.218
O=C1CC2(CC1C2)C#C,0.2286
O=CC1(C#N)C2CC1N2,0.1958
OC1C(OC=N)C1C#N,0.2652
N=C(C=O)N1CCC1,0.1712
OC1CC2C1CC21CO1,0.322
Cc1cc(co1)C(=O)N,0.2099
CNC1CC1(C#C)C#N,0.2403
CCCOC1CC1OC,0.3178
CC1C2CC=CCC12O,0.2669
CC1OC1(C)C1CN1C,0.3078
CCOCC12CC1OC2,0.3091
COC1CC(N)(C1)C#N,0.2838
COCC(CC#N)C=O,0.2264
CC1OC2=CNC=C2O1,0.2354
CCCC1OC1C1CO1,0.3399
OC12CC3C(C13)C(=O)C2,0.2205
CC12CC1OCCC2=O,0.224
CC1C2C(O)C2CC1O,0.2717
COC(C)C1COC1=N,0.2866
CC(C=O)C1CCCC1,0.2264
CC(C)C(C)CC1CC1,0.3536
N#CC12CC1N1CCC21,0.2468
OCC(=O)NC1CC1O,0.2662
C1C2C3N1C21CCC=C31,0.2391
c1cnc([nH]c1=O)CO,0.1977
O=CCC12CCC1CC2,0.2205
CC1C2CCNC12C#N,0.2542
CC1(C)CC1C1CC1,0.3298
CCC12CN3C1C(C)C23,0.3004
CN=C1OC2C3CN1C23,0.2668
C1CN(CC1=O)C=O,0.215
OC1CCC(C1)C#N,0.3209
CCC1COC1C(N)=O,0.2628
CC1(O)CCCOC1,0.3213
CCC12CN1C1CC21C,0.2911
CCC1(CC1)C1(C)CO1,0.3487
NC1=CN2CC(O)C2=C1,0.2107
CC1C(O)C1CCO,0.2966
CCC1C2CC1(C)C2,0.3771
CC(C=O)C(=O)C#C,0.1817
OC1C(=O)CC11CC1,0.215
CC1OCCC2C1N2C,0.2997
NC(=O)C(O)CC1CN1,0.2755
CC12CN3CC3C1(C)O2,0.3125
OCC1=CC2OC2C1,0.2413
CCC#CC(C)OC=O,0.2691
CCC1C2OC2C1=O,0.2116
C1CC1COCC#N,0.2916
CC12OC1CNC2C=O,0.2057
CC(=O)c1ccc(o1)N,0.1685
OC(C=O)C1CN=CO1,0.2111
O=C1CC2CC(C2)CO1,0.2678
CNC1(CCC1O)C#N,0.2558
CCC(O)C1=CNC=C1,0.2491
O=CC12CC3C(CC13)C2,0.2228
c1cc(c(cc1N)O)F,0.2019
CCC1COC=NC1,0.2724
c1cn(cn1)C(=O)C=O,0.1391
OCCC1OC2C(O)C12,0.2995
CC12C3CC1(C)CN23,0.3098
CCC1CC2C(O)C12O,0.3105
OC1C2C3OC4C1N2C34,0.2561
CC1CC=CCC1C#C,0.2669
OC1CC2CC12,0.3269
C1OC23CC4C5C2C5C134,0.2804
CC12NCC1OC2=N,0.2592
OCC1CC1(O)C1CO1,0.3098
CC12CN3C(C=C1)C23,0.2295
N=C1ON=C(C=O)C=C1,0.1571
C1CC11C2OC3C2OC13,0.3001
CC1C(O)C(=O)C2CN12,0.206
CC(=NCC#C)OC,0.2689
C1C=CN(C1=O)C=O,0.207
CCNc1cn[nH]c1O,0.2503
OCCC1COC(=O)O1,0.3185
CC1OCC(=O)NC1=O,0.2312
CC1(CO)CCC(=O)N1,0.2726
c1c(cncc1O)O,0.2049
OC(CNC=O)C1CC1,0.2823
OCC1OCCC1=NO,0.2427
N=C1N=CN=NC=N1,0.119
CC1=CCOC2CC2C1,0.2549
CC1CCC2COC12,0.3198
CCC1(CC(=O)C1)OC,0.2213
OC1C2CC3(C2)OCC13,0.3114
OC12CC1CC=C2C=O,0.169
CC1(O)CC(C1)OC=N,0.2806
C1C=C(NC1=O)CO,0.2118
CC(C)C1COC(=N)O1,0.3089
CC1C2C(C)C1C2C#C,0.2987
CC1(C)OCC(O1)C#C,0.2845
OC12C3CC1C=CC23,0.2386
OC1CC=C2C3NC3C12,0.2359
CC(CC1CCO1)=NO,0.2516
O=CCN1C2C3CC1C23,0.2009
CC12OC3(C)C1NC23,0.3033
OC(C#N)C(=O)OC=N,0.2462
COC1C(O)C1C#C,0.2695
c1nc2c(o1)NCCC2,0.2159
CCN(C=NC)C(=O)C,0.2284
c1c2c(cncn2)on1,0.1883
CC1CC(O)C(=O)CN1,0.1966
OCC12OC3C1C(=O)C23,0.2289
N=C1OCCCCC1=O,0.1918
C#CCOC1CCOC1,0.2769
COC1C2CCCCC12,0.3112
CC12NC1C1NC21,0.2714
COC1C(O)C1C#N,0.2799
O=C1CC2NC2C2CC12,0.2217
CC1(C#N)C2OC2C1N,0.277
Cc1c([nH]cn1)CCO,0.2445
C1OC2C3C4C=CC13C24,0.218
CC(CO)C1NCC1=O,0.216
C#CCc1cc[nH]c1N,0.2363
CCC1(CC)CCC1O,0.3271
OC(CC=O)C1CC1,0.229
CCCC12OC3CC1C23,0.3126
CCc1cccc(c1)O,0.2184
C1CC1C12CC3OC1C23,0.3084
CCC1(CO)OC1C#C,0.2722
O=C1OCC2COCC12,0.2735
O=CNCC1C2CC1C2,0.2828
C1CC=CNC(=O)NC1,0.2229
NC=[NH+]C1=NNC=C1[O-],0.0949
CN1CC2C(OC=N)C12,0.2258
NC(=O)C12CC3C(C1)C23,0.2636
C1C2C1C13CC21CCO3,0.2678
c1c(=O)c(c(on1)O)N,0.1511
CC1(C)CC1C=O,0.2275
c1ccn2c(c1)cnn2,0.1755
CC1CC2C3C2N2C3C12,0.2821
COC(=O)C1COC=N1,0.2489
OCC1(CN2CC12)C#N,0.2715
NC(N)=[NH+]C1=N[N-]N=N1,0.198
OC12CC1C1CCC2C1,0.3305
CC(C)C12CC(O)(C1)C2,0.3345
OC1C2CN2C1C1CC1,0.2938
CC1(CCCC1O)C#C,0.3123
CCC1OC1(C)C1CN1,0.3278
OC(COC=O)C1CC1,0.2852
OC12C3CN(CC1=O)C23,0.1968
CN=C1COC(=N)CO1,0.2579
CN1CCN2C3CC2C13,0.2926
CC12OC1CC2(N)C#N,0.2712
c1c(cn2c1CC=C2)O,0.1803
CC1=CC(=N)OCC1O,0.2106
N#CC1=CCC2CC2C1,0.2233
CCc1nc(c(o1)N)N,0.2074
CC1CC(O)CC(=O)O1,0.269
OC1CC23CC4C2OC134,0.254
NC1CN(C(N)=O)C1=O,0.2241
C(#N)C(=N)NC(=N)C#N,0.1918
CC(CC(C)=O)C#C,0.2301
OC1C=C(C#C)C2OC12,0.1969
CCOC1CC1C=O,0.2243
CC1=CC2COC2C1O,0.2571
Cc1coc2c1COC2,0.2321
C1CC2C3OC3C3C1N23,0.2839
OC1C23CCC12OCO3,0.2863
c1c(nc[nH]1)C2CC2,0.2397
CC1(C2(N1)CN(C2)C)C,0.2826
C1CC1OC1CN=CO1,0.2778
N#CC1C2COC=NC12,0.2508
CC(C)COCC1CO1,0.3396
O=C1CCC=CC2CN12,0.2476
CC1(CC1)c2cc[nH]c2,0.2492
O=C(CC1CN1)C1CO1,0.2068
OC1CCCC2CC1O2,0.3179
Cc1cnn(c1)C(=O)N,0.2278
CNCC(C)(NC)C#N,0.2628
CC#CCC(=O)C1CO1,0.2063
NC12C3NC3C1NC2=O,0.2454
OC12C3CC4C(OC14)C23,0.3065
OC1CC2CC2(C1)C=O,0.226
COC1C2CC(C)C12,0.3173
CC12CC1C1CC1CC2,0.3142
CC(=O)C1CC(C1)C=O,0.2219
C1C2OC3C4OC2C1C34,0.2863
OC1CC11CNC1C#N,0.2594
CC(C#N)C1=CC=CN1,0.2362
CC1C2CC(O)C12CO,0.306
CC1(CO)CC(O1)C=O,0.2122
CC12OC1CCC2(C)O,0.3191
CCCNC(C=O)C#N,0.2038
CC#CC1OC(C)C1O,0.2735
CCOc1cocn1,0.2191
CC1CC2(CO2)C=C1,0.2505
COCC1OC(C)C1C,0.3152
c1cc(nc(=O)nc1)O,0.1655
c1nc2n(n1)cno2,0.2344
CC#CC1OCC1=O,0.2086
NC1=NOC(=N)N=C1F,0.156
C(CO)c1nc(no1)N,0.2317
CC1OC2CC=CC12,0.2596
CC(=O)C1C2CC3C2N13,0.2206
CC(C)C12CC3C1CC23,0.3649
CC1COC2=CNN=C12,0.2241
C1CC1(C(=O)N)OC=O,0.2633
N=C1CC2CN2CCO1,0.2537
COC=Nc1ccoc1,0.2054
O=C1CC2C1C1CN21,0.2014
CC12OC(=O)C3C1NC23,0.2389
CC(C)CC(C#C)C#C,0.2943
CN1CC1C1NC1C#N,0.2342
C#CC1NC1C1CC1,0.279
NC12C3OC1C(=O)OC23,0.2368
N=COC(=O)C1CCO1,0.2218
COC1OC=NCC1C,0.2744
C1C=CC2C3N=COC123,0.2279
COC1C2NC1C2O,0.3043
CC(=O)C1CCC1(C)O,0.2262
CCCCN(C)CC#N,0.2584
c1coc2n1c(nn2)N,0.2081
C(=Nc1c(nno1)N)N,0.1537
ON=C1C2OC1C2C#N,0.2506
O=CC(=O)C1NC1C#N,0.1514
N#CC12CC1CC21CN1,0.2576
N=COCC1=COC=C1,0.243
CC1(NCC1C#N)C#C,0.2542
O=C1C2CN3C2CC13,0.207
CNC(=O)c1cnoc1,0.2239
OCC1C(O)CNC1=O,0.2712
C1OC2COCC3C1C23,0.3031
OCC1(CNC=N1)C#N,0.2437
CCC1C(O)CC=C1C,0.259
C1OC11CC2CC(C1)O2,0.3275
CC1C(=O)C2OC12C,0.2119
CC1(CCC(N)=O)CO1,0.278
CC1C(CO)CC11CO1,0.3259
C12C3C1C1C3C3C2N13,0.2859
CC1(CN1)C(=O)CC=O,0.208
CC12CC3C(O)C(C1)N23,0.2804
C1CC11C2CC1N=CO2,0.2625
COC12CC1C1(CC1)C2,0.3361
COC(CO)C(C)O,0.3034
c1c2c(ocn2)on1,0.2243
C1OC2C3CCC12O3,0.2752
c1c[nH]nc1C(=O)C=O,0.1494
OCC12CC1C(=O)O2,0.2789
[NH3+]CC1=CN=C([O-])O1,0.1755
C1C2OC3C1C21COC31,0.3063
CC(C)C(C)OCC=O,0.2283
Cc1ncc(=NC)on1,0.1606
COC1COC2C(C)C12,0.3101
CC(C)(C#N)NC=O,0.274
CC12C3C4C1CCC2N34,0.3037
CC1CCN2N=CN=C12,0.2664
CC1(CO)CCCO1,0.3193
CC#CC1(CC1C)C#C,0.2608
CC(C)(O)C12CN1CC2,0.3147
CCC(O)C#CCC=O,0.2203
CC1C2(C)C3N2CC13C,0.3104
OCC1C(=N)OC11CC1,0.2743
CC12NC1C(C)(O)C=C2,0.2384
CC(C#N)C1CC(O)C1,0.3043
CCC1=CCCC(=O)C1,0.2232
NC(=O)C1CCC1=O,0.2093
CC1C2(C)COC12CO,0.2928
CCCC1C2CC2C1=O,0.2253
N=C1OC2CC1C(=O)C2,0.2167
CC1CC2OC2C1CO,0.3195
c1cn(c(n1)C#N)C=O,0.1831
C#CC12C3CC1CC23,0.2607
O=CC1CCCC1C#C,0.2225
CCN1CC(=CC1=O)N,0.2151
COCC(O)C(=N)OC,0.2475
N=C1COC(=O)OCO1,0.2728
CC1=CCOC2COC12,0.2558
CC1(O)C(C=O)C1C=O,0.1935
CC12OC3(C)CC1C2O3,0.3229
CC1CN1C1CNC1=O,0.2452
CC1C2C3C4C3C1(C)N24,0.3019
COC1(CO)CNC1=N,0.2538
CC1=NCC(O1)C#N,0.2671
CC1C2NC2C1(O)CO,0.3118
C1C=Cn2c1noc2=O,0.207
OC1C(O)C11C2CC1C2,0.2756
CC(C)C1CCC(=N)O1,0.2831
O=CC1CC2(CC12)C#C,0.2071
OCC(CO)C(O)C#N,0.2798
CC(CO)(C=O)C(N)=O,0.2087
CC1OCCCO1,0.3497
c1c(n[nH]n1)OC=O,0.2439
CC1C2N=C3OCC3C12,0.2441
Cc1c(cc[nH]1)N,0.2267
CC(C)C1CC2C(O)C12,0.3191
CC1C2COC=NC12C,0.2529
CCC(O)C1NC1CO,0.3136
c1cncnc1N,0.218
CC1(OC1C#N)C1CC1,0.289
C1CC11C2C3CN1C23,0.3091
OC1CC1(C=O)N1CC1,0.2151
CCC12CC1C(O2)C#C,0.2625
OCC1C2C3OCC1C23,0.2954
NC(=O)C(=N)N1CC1,0.2128
N=C1OCCNCC1=O,0.1809
CC1C2C1C1(O)C(O)C21,0.2762
CCC12CC1CN2C=O,0.2568
CC1CN1C1=NON=N1,0.195
CC12CC(C1)OC(=O)O2,0.3216
CC#Cc1ncn(n1)C,0.2202
CC1(C)C2COCCN12,0.3003
C1OC1C1CC=CCO1,0.2681
Cc1cc(cn1C)O,0.226
CC12C(CC1=O)C2C#N,0.2277
COC1C2CCN2C1=N,0.2312
O=C1CC2(CC2N1)C#C,0.2645
c1cc(c(cc1F)N)F,0.2064
CC12OC=NC1C2CO,0.2521
CCc1c(con1)C=O,0.2004
CN=C1CN=CN1,0.2206
CC(=O)C(O)COC=O,0.2267
CC(C1CCO1)N1CC1,0.3174
OC1C2OC1C=C2,0.2448
CNC(=O)C(N)C(N)=O,0.2372
OC1CC2CN2C1,0.2923
CC(=O)C1CC(N1)C=O,0.2098
CCCCC1(C)CCO1,0.3191
CC1(C(=O)C=CCO1)C,0.1768
OCC(O)C(CO)C=O,0.2249
OC1C(O)C1(O)CC#C,0.2901
OC1CC2NC2C1,0.315
OC1C2NC3CC3OC12,0.2798
FC(F)(F)C1CC1C#C,0.2945
[O-]C(=O)CC[NH2+]C1CC1,0.2769
CC12CC3CC(C1)C3C2,0.349
CC12CCC1(C)N=CO2,0.2638
C(C1CC1)C12CC(C1)O2,0.3246
N=C1CCC(=O)C(=O)N1,0.1757
N=C1NC(NC=O)=CO1,0.1705
CC1CCC(=N)OCO1,0.2853
CC1NC1C(=O)C#N,0.1897
CN(CCOC=N)C=O,0.2678
[NH3+]C1(C2CC1C2)C([O-])=O,0.2587
C1CCC(=O)CC1,0.2238
c1cc(c(=O)[nH]c1)C=O,0.159
O=C1CC2(CC2)C2OC12,0.2114
CC1NC(=O)CNC1=O,0.2645
CC#CCC1CC1C#N,0.2768
CC1OCC(C)(C)O1,0.3257
CCC12NC(C1O)C2=O,0.232
CC1NC(=O)CC1=NO,0.2368
[NH3+]C1=CC(=O)NC(=O)[CH-]1,0.1453
C#CC(C#C)C1COC1,0.2752
CCn1cccc1NC,0.2292
Cc1nc(=O)cc(o1)F,0.2115
c1(c([nH]c(=O)o1)O)N,0.2456
CC(C)n1ncc(n1)O,0.2314
C1c2c(nno2)OCO1,0.1992
CC12COC(=N)CC1N2,0.2732
c1cc(ncc1N)C#N,0.1866
CC#Cc1ccoc1N,0.2031
OCC(=O)C(O)C=O,0.2017
CC12CC(O1)C(C=O)=C2,0.1803
OCC1NC1(C#C)C#C,0.2499
CC(O)C1=C(C)ON=C1,0.24
CC1OCC1C#CCO,0.2731
COC1C2NC2CC1=O,0.2039
CC1C=CC2CC2C1C,0.2479
CC1CN2CC2C1C=O,0.2129
CC1CCC(CO1)C=O,0.2181
OC1C=CCC1C1CO1,0.2643
COC1(CO)CC2NC12,0.3091
COC1CC2NC12,0.3075
CC(CC([O-])=O)[NH+](C)C,0.1596
CNc1c(onn1)CO,0.1766
CC1NCC(=O)C2OC12,0.1965
OC1C(CNC1=O)C=O,0.222
CC#CC1(CN1)C=O,0.2159
O=C1CC2N1CC21CO1,0.2394
CC#CC1CC1C#CC,0.2629
N#CC12NC1C1CCC21,0.2538
c1c(c(c[nH]1)O)O,0.2395
CC(O)C12CC3CC1N23,0.3198
CNC(=O)c1cc[nH]c1,0.223
C(CC(=O)C(=N)N)C#N,0.1921
CCCCOC=NCC,0.2738
C1C=CC(=CC(=O)O1)N,0.169
COCCCC(C)C=O,0.2269
CN1CC1CCNC=O,0.2574
N#CC12CCCCC1O2,0.2963
CC1OC2CN3C2CC13,0.2983
CC1CC2(CN2C)C1O,0.286
OC1C2C3C2N2C3CC12,0.2829
C1CC1C2(COC2)C=O,0.2182
CC1(C)CC1COC=O,0.2837
CCC1C2CC2C1C=O,0.2183
CC1C(C)C23CN(C2)C13,0.2616
CC1C2C=CC3NC3C12,0.2395
CC1C2CCC(=O)C1O2,0.2078
Cn1nc(c(=O)nn1)N,0.1754
C1C2(CCO2)C11CCO1,0.2651
CC1=CCC2CC2OC1,0.2531
O=COC1C2C3CN3C12,0.2363
CCCc1c(non1)N,0.2198
CC1CC2C1=CNC2=O,0.2013
CC1(CC2OC12)C#N,0.3024
CC1(N)C(O)C1C#N,0.2816
C1C2OC1C1C3CC1C23,0.3056
N=C1OC2CC3(CN3)C12,0.2742
O=C1CCC23CC12CO3,0.2167
N=C1CC2C(O1)C2C#C,0.2635
OC1C2CC2C2OC12,0.3166
C1CC1CC(C#N)C#N,0.2962
OCCC1CC2OCC12,0.3138
COc1nccc(n1)O,0.2205
C1CC1C(=O)CO,0.2352
OC12C3CC=C1COC23,0.1985
CCN1CCC(=O)C1,0.1933
CC12CC1OC2CC#C,0.2823
CCC1(CO)NC1C#N,0.285
CNc1cncn1C=O,0.1811
NC(=O)C12CC1N=CO2,0.2503
COC12C(C)C1OC2=O,0.2535
OCC1C2OCC=CC12,0.2403
CC1C2CC11NC(=O)C21,0.2496
c1c(c(on1)C#N)C=O,0.1793
OCC1(CCC=O)CO1,0.2292
CC1=C(O)C=CC(=N)O1,0.1497
CCN=C1NN=CC=N1,0.1386
O=C1CNC1CCC#C,0.2168
CC12NC1C=CC2CO,0.2383
O=C1CC=CCC11CO1,0.2176
Cc1cc(c[nH]1)NC=O,0.2098
C1CC1N2C=CCC2=O,0.2024
C1CC11C2C3C2C2C3N12,0.3001
CCC1=CCOCOC1,0.2507
CC#CCOCCC=O,0.2238
N=C1OC2C3COC3C12,0.2752
CC(OC=N)C(N)C#N,0.2823
NC12CCC1(NC2)C#N,0.2501
NC1=C(OC=N)OC=N1,0.21
CN(C)C(C#N)C(N)=O,0.2574
CC1C2CC3C(C)C1C23,0.3309
CC1=CCC2CC(C2)C1,0.2642
OC1CC=CC=CC1O,0.1893
OC1C2C1C(=O)CC2=O,0.2132
CCC#CC(C)(O)C=O,0.2127
CC(C)C(C)(O)C1CC1,0.3301
C1OC1C12NC1CC=C2,0.2414
OC1CC(C#N)C2CC12,0.3083
CC1COC2=C1OC=N2,0.2041
OC12CC1(O)C1CC2O1,0.2918
COC1(C)CC(O)C1O,0.3149
C#CCc1c[nH]c(=O)[nH]1,0.2233
C1C=CCOC(=N1)C#N,0.219
CCCCC#CC(=O)N,0.2341
CC12CC1N=COCC2,0.2497
CC12NCC1(C#N)C2N,0.2458
CCCCC#CC,0.3042
c1c[nH]cc1CN2CC2,0.2465
CC1(COCOC1)O,0.3268
C#CC(=O)CNC(=O)N,0.1848
c1c([nH]c(n1)O)N2CC2,0.2384
CC1(O)C2C(=O)CC12O,0.2293
CC1=CC2NC2CC1=O,0.1896
CC1C(C#N)C1(O)C=O,0.2142
CC1(C)C(O)CCC1=O,0.2205
CC12CC3N1C3(CO)C2,0.3289
C1C2C3OC4C=CC13C24,0.2366
OC12C3C4C1C2(C#C)N34,0.2312
CC12CC1(CC2=O)C=O,0.2004
C#Cc1ccnc(=O)[nH]1,0.1579
OC12CC(C1)NC2C#N,0.2672
CNC1CNC(=N)C1=O,0.1727
CC12CC3C1OC23C#C,0.2477
CC1C2OC(C=C2)C1C,0.2537
C1NC1C12CC1CCO2,0.3014
CN1N=COC1=N,0.2152
N#CC1C2OC3CC2C13,0.2882
CC1CC11CCCC1,0.3429
c1(nc(on1)N)C(=N)N,0.2063
CC1CN2CC3OC1C23,0.2794
CCOC(C=O)C(C)=O,0.1986
CC1=CC(=O)C(C1)C=O,0.192
CC12CC3(C=O)C(O1)C23,0.2182
C1OC1C1CCCC1,0.3432
CC1C=CC=CC2NC12,0.184
Cc1c(ncc(=O)[nH]1)C,0.1627
CCNC(=N)C(F)(F)F,0.2486
CC1(OC=N)C(O)C1O,0.2646
CC12OC(CC=C1)C=C2,0.2302
OCC1COC2(CC2)C1,0.307
O=C1CCC2OC2C1,0.2277
CC12CC1(C=O)N=CN2,0.2075
O=CN1CC=CC2CC12,0.2458
CCOC(=O)CC#N,0.2868
OCC1C2C3C2C2C3C12,0.2977
C1C=CCN1C(=O)C#N,0.2109
CC12CC1(C=O)C(=O)O2,0.2184
CC#CC(=O)CC#N,0.211
CC1=CC2(O)CC2(O)C1,0.2403
CC#CCN1CC(C1)O,0.2689
OCC1CC2OCOC12,0.3257
NC1C2C3OC1(C#N)C23,0.2388
NC(C#N)C1(N)COC1,0.2761
CCCc1c[nH]c(=O)o1,0.2387
NC1=CC(=O)C2(CN2)C1,0.2083
CC1=CC(=CN1)C1CO1,0.2361
C1C2(CN1C(=O)N)CO2,0.29
C1C(C(=O)N1)(C=O)C=O,0.2094
NC1=CC(=O)CC2NC12,0.1925
CN(C)C1CC1C#N,0.2443
CN1CC1(CC=O)C=O,0.2082
NC(=O)C1CC(=O)N1,0.2609
CNC(C)(C=O)C(N)=O,0.1926
CC12CC(OC=N1)C2=O,0.1975
CC1C(C)C1(C)CC#C,0.3063
CC1C2C(O)C1N2C=O,0.2489
OCC12CN1CC21CN1,0.2943
CC12OCOCC1C2O,0.3066
OCC1CN2CC12CO,0.3037
Cc1c(cc[nH]1)N(C)C,0.2414
OCC12CC1CCOC2,0.3218
OC1CCC2=NNN=C12,0.2438
CCc1cccnc1N,0.2004
CCNCC(F)(F)F,0.3081
CCn1c(c(cn1)C)O,0.2479
CC1(C)CCC2CC12O,0.3188
c1ccncc(=NO)c1,0.1427
CC(=NO)CCC1CC1,0.255
CCC12CC(C1)C21CC1,0.3556
C#CC1C2CC1COC2,0.3032
C1CC=CC#CC=CC1,0.1699
CC(=O)CN=CNC=O,0.2188
CC12OC3C4CN(C14)C23,0.2932
CC12CC1CC2(N)C#N,0.2797
CCC1(C)C2OCC12O,0.2826
C1CN=C2NC=NC2C1,0.223
CC1C(O)C(O)C1CO,0.288
CC1(O)CCNC(=O)C1,0.2666
C#CCC1(CCC1)O,0.2934
CC1CCC(C)(O1)C#C,0.2972
COc1cc(c[nH]1)N,0.234
C1CC2OCC1C=C2,0.2488
N#CC1NC2COCC12,0.2674
CC1(NC1C=O)C1CN1,0.218
CC(C)CNC(=O)CO,0.2747
C1CC1CC2=CCOC2,0.2465
CC(=O)C1(CN1)C(N)=O,0.2235
O=C1CC=CC2CN2C1,0.2054
Cc1cncnc1N,0.2176
Cn1ccc2c1NCC2,0.2216
OCC1C=CNC1=O,0.2144
CN1C(=N)C(O)CC1=O,0.2484
CC12C3OC1C(=N)OC23,0.2404
c1c(ocn1)C=O,0.1937
CC1(CCCO1)C(N)=O,0.2639
O=C1CC2C3CC1C23,0.2244
CCC12CCC1C2C,0.3244
Cc1ccc(c(c1)F)C,0.2281
OC1CC2CC12C#C,0.2718
CC1N2C3CC3C2C1=O,0.2024
CC(=O)NCC#CC=O,0.1939
CCCC(O)(CC)C#C,0.2989
CC1(CC1C#C)C1CO1,0.2859
C(C1CN1)C1=NCCO1,0.2652
COC1C2NC1C1NC21,0.3005
OC12CC3CC1C23C=O,0.2068
CCC(CCO)C=O,0.2266
C1C(CC1=O)O,0.2214
CCOC1C(C)C1C#C,0.2762
C1CNc2c1c(n[nH]2)N,0.2386
C1NC1C1=CC=CO1,0.226
CCOC(CC)CC#C,0.2897
COC1CC2(O)CC12C,0.3193
CCC(O)C#CC1CO1,0.2683
CC1C2CC1(C)C(=O)C2,0.2268
CCC(CO)C(O)CO,0.3183
C1C2C1C1C3C4C2C4C13,0.2879
CC(O)C1COC=N1,0.2665
COCC#CC(O)C#N,0.2573
c1c(n2c(o1)nnn2)N,0.2109
COC(=O)N1CCC=C1,0.2204
Cc1c(oc(c1N)N)C,0.2156
C1C2CC3=C(OC=C3)C12,0.2237
C#CCCC12CC1CC2,0.3043
OCC(=O)C1CC2OC12,0.2302
CC1=CC(CC1)C(N)=O,0.2444
CC1C2OC1C1(O)CC21,0.3169
OC1COCOCC1=O,0.2045
C#CC1(NCC=C1)C#N,0.2351
CC(C)(COC1CC1)O,0.3362
CC1COCC1(O)C#C,0.2752
CCc1c(n[nH]n1)CO,0.251
OC1C=CC2NC12C#N,0.2344
CC(OC=O)C(O)CO,0.2809
CC1=CC2C3N4CC13C24,0.2248
C1CC1C(F)(F)F,0.3997
CC12CCC=C1C1OC21,0.2306
OC1C2C3C2(O)CC13O,0.3133
CC1(CO)COC(=O)O1,0.3186
NCC(=O)OC(=N)C#C,0.2011
CC1OC(CO)C2NC12,0.3036
CC12C3OC1C(=O)C23C,0.2242
CC1(CO)COC(=N)C1,0.2857
C1CC1c2nnon2,0.2191
OC12CN(C1)C(C2)C=O,0.2092
Cc1c(ncc(=O)o1)N,0.1368
CCn1c(nc(n1)O)N,0.2406
CC#CC12CC(C1)CO2,0.2719
N=COCC1C2CC1O2,0.2627
OCC1=CN=COC1=N,0.1827
CCOc1c(cco1)C,0.2295
CN1C2CN3CC1C23C,0.2666
CC12OC1C=CC1NC21,0.2374
C#CCC12CC1N1CC21,0.267
C#CC(=O)C1(CC1)CO,0.1992
O=C1CC2=CCCC2N1,0.243
Cc1coc(c1CO)C,0.2284
CC1(CN1)C1(O)CC1,0.307
N#CCC1CC2OC2C1,0.3098
CCC(OC)C1CC1O,0.3155
OCCC1(CN1)C=O,0.2228
C1C2OC3OC=NC2C13,0.2558
N=C1OC2C=CCC2=C1,0.2138
Cc1c(con1)CC#N,0.2528
CC1=C2CC3C2C3C1=O,0.1546
CC(O)CC1(CO)CO1,0.3148
OC1(C=O)C=CC2CC12,0.1953
CC12NC1C1OC21C,0.2779
CC1C2[NH2+]C(C12)C([O-])=O,0.2651
N=CN1C(C=O)C1C=O,0.2031
CC12CC1C1(C)CN1C2,0.299
c1c[nH]c(=O)cc1N,0.1858
C1CC23CCCC12CO3,0.309
CC1(CCOCC1)C#C,0.2975
OCC1CN=C(CO)O1,0.2725
C#Cc1c[nH]cnc1=O,0.182
CC(CC=O)CC(C)=O,0.2216
O=C1CN2CC2C1C#N,0.2018
C1CC2C3C4C(C3O1)N24,0.3239
c1[nH]nc(n1)N2CC2,0.2329
COC(=N)NC(=N)C#C,0.203
OC12CN(C1)CCOC2,0.2726
CC(C)C1CCOC=N1,0.2695
CC1OC2CC1CC2O,0.3145
CC1(COC=N1)C(N)=O,0.2497
FC1=NC(=N)N=CN1,0.2021
CCCC#CC(N)C#N,0.2742
c1c(con1)C=O,0.2013
c1c2c([nH]c1N)CCC2,0.2278
CC12NC1C(=O)C2CO,0.212
COCC12CC1CC2C,0.3286
CC1(CC1)C1(O)CC1O,0.3073
C1CN1C1C2CCC1O2,0.3246
O=C1OC2CC3CC12O3,0.2553
CC1(CC#N)CCC=C1,0.2632
c1c2c(no1)NC=NC2,0.2123
CCCC12CC1C(=O)N2,0.2547
CCC#CC(=O)OC,0.2342
CC#CC#CC(=O)NC,0.196
CC1=C(N)NN=NC1=N,0.1614
CCC(CC1CC1)OC,0.3247
CC(=O)C1CCOCO1,0.2298
CC1=CCc2c1[nH]nc2,0.1946
CC1(CO)C(O)C2CN12,0.3008
C1C2CC1C1=NC=NN21,0.2503
C1C2OC3=CNN=C3C12,0.2263
CC(O)C(O)C(C)(C)C,0.311
ON=C1CCC=CC1O,0.2437
OCC12C3CC1OCC23,0.3095
CC1=NCC(O1)C1CO1,0.2725
NC1CCCOC1=O,0.2494
COC(C)=N,0.2948
C(C#N)NC(=N)C(=O)N,0.222
C1C2NC3=C(OC=N3)C12,0.1942
C1CC12CC=CCOC2,0.2635
CCC(=O)C(O)C#N,0.2377
CC(C)(C)OC(=N)C#C,0.2359
CC1C2CCC2C11CO1,0.32
c1nc2c(o1)c(no2)N,0.2063
c1([nH]c2nnnn2n1)N,0.2442
CC(C=O)C1(CC1)C#C,0.2174
OC1C2OC=NC2C1=O,0.193
CC#CCC1OC1C#N,0.2513
CCC1(C)CCC(C)C1,0.3696
Cc1c2c([nH]n1)CCN2,0.2203
CNC1=NCCOC1=O,0.1887
N#CC12CC1NC=N2,0.2476
Cn1cncc1OC,0.2432
c1c(c(n[nH]1)O)N2CC2,0.2338
OC12CC(=O)C3CC1C23,0.2205
CC(=O)N(C)CCC#N,0.2682
CCC1=CC=NNC1=N,0.1603
CC1CC=C(C)C1(C)O,0.2613
CC1(O)CC2OC2C1,0.3335
CC(O)C1C(C)N1C=O,0.2632
CNC(=O)NC1COC1,0.3022
CC(C)C1CC1(C)C=O,0.2271
OC1C2NC1C2(O)C=O,0.1932
CCc1c(=O)ccon1,0.1866
CCCC1CC1(O)CO,0.3025
OC1CCC1(C#N)C#N,0.2831
CCC1OCC1COC,0.3253
CC1C2OC(C=O)C12C,0.2162
CCN1CC1C(C)=O,0.2028
OC(C#N)C1(O)CC1,0.2992
CC1(C)C2C(=O)OC12C,0.2714
OCC1CC(CC=O)C1,0.2272
O=CN1CC11C2CC1O2,0.2514
CC1CCC=C1C#N,0.2197
CCC(C)OC(=O)NC,0.3164
CC#CC1(CO)NC1C,0.2803
C1C(C(=O)O1)(C#N)C#N,0.2708
CC1(C)C2OC2C1O,0.3236
CC1CC(=O)NCCO1,0.2668
CNC1(CO)CC1C#N,0.2647
CC12CC3N1C2C3=NO,0.2392
COC=NCCC=O,0.2239
CC1C2N3CC1(C)C23C,0.3057
CC(O)C1OCC1(C)C,0.3047
COCc1cnc([nH]1)O,0.2414
CC(C=O)C1=CN=NN1,0.1995
CCC#CC(O)CC#N,0.2844
CCOCC1CC(=O)C1,0.2227
C1CC2(C1)CC(C2)C#N,0.3218
CC12COC3CN1C23,0.312
N=C1NC2C1OCC2=O,0.193
CNc1c(=O)[nH]ccn1,0.1687
CC(C1CC1)C(=O)C#C,0.1999
CC1CC11C2NC1C2=O,0.2501
N=C1NC(=O)C(O1)C=O,0.2147
O=CC1CC2(CO2)C=C1,0.2085
OC1CC=CCC1=O,0.2278
CC12OC1C1CC21O,0.2905
CCCCCCC=O,0.229
CC12CC(C1)CC(O)C2,0.3293
CC#CC1(C)CC(=N)O1,0.2789
CC1NC11COCC=C1,0.2358
CCC(OC=N)C(N)=O,0.2472
CC1(CC([O-])=O)CC1[NH3+],0.261
OC12CC1C(=O)C21CO1,0.2165
CC1(C=O)C2C3CC3N12,0.2028
N#CCC1CC11CCO1,0.275
CC1=CCC(CO)C1=O,0.1962
CNc1cc(on1)NC,0.2294
N=C1OCOC1CC=O,0.2276
CC1CC(O1)C(=O)C#C,0.1892
OCC1COC11CCC1,0.3036
OC12COC1CC21CN1,0.2915
COC1C2NC(C#N)C12,0.2499
c1c(n(nn1)C=O)N,0.1832
OC(CC#N)C1CC1O,0.2638
CC1OC(=O)C1(N)C#N,0.2384
CC1COCC(C)C1C,0.3121
C1CC1C2OCCO2,0.3388
CC(C#C)C1COC1=N,0.2823
CC(C)(CO)CO,0.3272
CCC1CNC1(C)C#N,0.2727
C1CC2C3OC4C1C4C23,0.3046
CC12OC3C1OC2C3O,0.2857
CC1C(C(O)C#C)N1C,0.248
NC1C2CN2C1C#N,0.2515
CC1C2COC12C(N)=O,0.2561
C1OC2C=CC3OCC123,0.2398
OCC12NC1CC2C=O,0.202
COC1=COC(=N)C=N1,0.1345
CC1=NC2C(O1)C2C=O,0.2196
c1cocc1C2(CC2)O,0.2384
C1C2CCCCCC1O2,0.3107
C1CC11CC2C3CC1C23,0.3367
Cc1[nH]c(cn1)CC#C,0.2416
OC1C2C3C2C2C3OC12,0.297
CC(O)C1(C)CC(C)O1,0.3293
CC#CC1=CCN2CC12,0.1946
CCN=c1occ(o1)O,0.2501
CC12CC(=O)C3C(O1)C23,0.2236
CCC(=NO)CC#CC,0.2534
NC(=O)C1CC=CC1=O,0.1896
OC1C2(O)CC1(C2)C=O,0.2203
CC(C)C#CCCCO,0.2999
CCC(=O)C1CC1CO,0.2297
C#CCCc1cocn1,0.2449
CCC1C2N1CC2(C)C,0.297
OC1(CC1C#N)C1CO1,0.2962
CC1(C)N2CC(=O)C12C,0.2152
CCCC#CC#CC=O,0.1764
NC(C#N)C1=CNC=C1,0.247
O=C1CC2(CC3NC23)N1,0.2789
CC1NC11CCC2OC12,0.3206
CC(CO)C(C)CC=O,0.2286
CC1=C([O-])OC=C1C[NH3+],0.0972
COC(=NCCO)CO,0.2449
C(=O)n1nc(c(n1)N)N,0.1816
CN1CC1C(O)C1CO1,0.3052
CC(CC#N)(C=O)C#C,0.2206
C1N=C2OCOC3C1C23,0.2361
OCCN1N=COC1=N,0.2193
[O-]C(=O)CC12CC1C[NH2+]2,0.272
C#Cc1ccnc(c1)N,0.1774
CC(C)COCCCO,0.3281
CC1COC2=C1N=NO2,0.1685
C1CC1C1C=CC2CC12,0.2465
CC12CCC(C1)CCO2,0.3124
O=C1C2CC1CCC2,0.222
OC12C3N4CC1C4C23O,0.2741
CCC12OCC1(O)C2C,0.2844
c1c(oc(=O)c(n1)F)O,0.162
OCC12CC(O)CC1N2,0.2992
CC1=CCCOCCC1,0.2496
C1CC2OC3C1C23,0.3122
CC#Cc1ccc([nH]1)C,0.1943
CC1COC2=CC=CN12,0.2323
C1C2CCOCC12,0.3301
CC1(CC1)C1CNC1=O,0.282
CC1=CC2(O)CC(C2)C1,0.246
N#CC12NC1CN1CC21,0.2465
OCC12COCCC1N2,0.3237
N=C1CC(=O)C2(CC2)O1,0.2183
COC(=O)CC#N,0.2877
CCC1=CCCCCC1,0.2503
CCC12CC(C1)C2C,0.3708
c1c(c(no1)O)C(=O)N,0.2105
CC1C(=O)C2CC12C=O,0.1996
CC1=CCC(=O)OCC1,0.24
c1c[nH]c(c1OC=O)N,0.205
C1CN1C1CC11CCC1,0.3087
CC1CC1(O)CNC=O,0.2464
OCC1=CC2C3CC1N23,0.2182
C(CO)C(C=O)C=O,0.1983
CN(C)C(C#N)C1CO1,0.2634
CCOCC1(O)CC1C,0.321
N=C1C2OC2C2CN12,0.2331
NC=[NH+]CCCC([O-])=O,0.042
CC(O)C(=O)C1(O)CC1,0.2267
OC1C2CC2COC1=N,0.2783
CNC(=O)C1CC(=O)O1,0.2561
Cn1c(c([nH]c1=O)N)N,0.2297
CC1(CO)CCC11CN1,0.3071
CCC1C(=O)CC1(C)O,0.2182
O=CC(=O)C1OCC=C1,0.1355
CC12CC1(O)C1CC2C1,0.3172
COCCc1ccon1,0.2491
C1C(=O)CC12COC=N2,0.2154
C1NC1C1=CN=CC=N1,0.1962
OCC1CCCCC1=O,0.2194
CC12CC1C(O)C2=NO,0.2412
CCC1(O)COC1=O,0.2611
CC1=CC2OC(C1)C=C2,0.2275
CCC1=C(O)OC(=N)O1,0.2426
COC1C2OCC(C)C12,0.2954
CC(O)CC12CC1OC2,0.2858
CC(C)(C=O)OC1CC1,0.2241
C1C2CCC3CC12C=C3,0.2257
OC1CC1C1OCCO1,0.309
CC(CCC#N)NC=O,0.2803
NC1=CNC(=O)C(=N)N1,0.1668
CC(OC=N)C(C)C#N,0.2851
C#CC1COC=N1,0.2711
O=C1OCC2=CCOC12,0.2258
CC(=O)C(O)(CO)C#N,0.2265
NC(=O)C1C2CC(O)C12,0.2577
CNc1c(cco1)OC,0.2103
OC1CC2CC2C2NC12,0.3028
OC1(C#C)C2OC(=N)C12,0.2387
CC1OC(N)=NC1C#C,0.2707
CCOC(=O)C1CN1,0.2599
CCNC(=O)C1OC1C,0.2609
CCC1=NC=NNC1=N,0.1624
C1C2C3NC3C3(CO3)C12,0.2924
CCN=C(C=O)N,0.1841
OC1C2CC2C2CC1O2,0.2994
CNC(=O)CC#CC#N,0.2116
OCC12CC3NC3C1N2,0.3004
C#CC(=O)CN1CC1,0.1882
CCC1C(CC1=O)C=O,0.2209
C#CC12NC3COC1C23,0.236
CC1CCCC(=O)CC1,0.2222
Cc1ccc(nc1O)O,0.2033
OCC1CC11CCOC1,0.3212
CC1(C)CC11CC2OC12,0.3269
CC#CC(C)C(O)C=O,0.2021
CCC(=O)N1CCCC1,0.2686
Cc1c(nc(o1)CO)O,0.2145
CC1C2CC2N1CC=O,0.1951
OCCOC1C2CCC12,0.318
CC1C2CC2(O)C1C#N,0.2835
CC(C)C1C2OC(=N)C12,0.2771
C1OC2C3C4C3C(=C1)C24,0.2064
COC1C2C(O)C2C1O,0.3151
O=CC12CCC3C1CC23,0.2192
C1CC(=O)C=CNC1,0.1854
OC12CC1C(C2)C=O,0.2238
CCC1(CC1)C1OC1C,0.3437
CC1C(C)C2(C)CC12C,0.3114
CN(CC1CC1)C=O,0.2725
Cc1c(nn[nH]1)C#N,0.2411
N=C1OC2C(C3CN3)C12,0.2517
CC1CC2(CC2C=O)C1,0.2277
C1COCC(CO1)C#N,0.3027
OC1CC2C3CC2C1C3,0.3402
COCC1(CC=O)CN1,0.2285
O=C1CC2(CCO2)CO1,0.2684
CC(C)C1(OCCO1)C,0.3261
CN=C1OC2C3NC3C12,0.267
C1CCC=C(CC1)CO,0.2534
CC1(CC2NC2C1)C#N,0.2905
CCC(CC)C(F)(F)F,0.4128
CC1(CC(C1)(C)C#N)C,0.333
OC12CCC(OC1)OC2,0.3123
O=C1C2CC11OCC1N2,0.1941
CC1CCC2OC12CO,0.3272
C1C2C3C4CC(CC34)N12,0.3025
OC1C2(O)CC1(O)CC2,0.3111
CC1OC(=N)C(=C1)C#N,0.1946
CC(C#CC#C)C1CN1,0.2252
C#CC1C2C3OCC3N12,0.2561
c1cnoc1N=CN,0.1852
CCC1OC=NC1C=O,0.2119
CC1C2(O)COCC12O,0.2946
CC1CC2OCC2(C)O1,0.3237
C1C(OCO1)(CO)CO,0.3242
CCC12CCC1(C)C2C,0.3131
OCCC1OCC1=O,0.226
CNc1cn(cn1)C=O,0.1575
c1nc([nH]n1)CC2CC2,0.2679
CCCCC(O)C(N)=O,0.278
ON=C1CNCC2NC12,0.2249
CC1OC(CC=C1)C#N,0.2649
NC1C(=O)OCC11CN1,0.2498
CC1C(O)CC(O)C1O,0.3022
CC1C2C(CO)N2C1C,0.2992
CC1CC=CCC1C=O,0.2158
C#CC1OC2COC12,0.2618
CNC1=C(NC)N=NO1,0.1668
CCN1C2C3C(O)C2C13,0.2848
N=C1NC2(CC2O1)C#N,0.2523
C(C1CO1)N1N=CN=N1,0.2579
CC(O)CCC=O,0.23
OCCC1C2CCN12,0.3024
CCN(C(=O)C)C(=O)N,0.2551
CC1COC1C1CO1,0.3187
CCC1(O)CC1CC#N,0.305
CC12C3C4C(CC14)N23,0.3073
OCC1=CNN=NC1=N,0.1698
c1cnccc1C2CC2,0.2297
CC1CC(C)(C1)C1CC1,0.3457
CCCN=C(C#N)NC,0.2026
C1C2C3C4OC=NC13C24,0.2523
CC(C1CC1)(C2CC2)O,0.34
CNc1cnc(cn1)O,0.1609
C1C2COC3COCC123,0.3217
OC1C(CC=O)CC1=O,0.2196
CC1CNC1(C)C#N,0.2735
N=COCC#CC=O,0.2035
CC1N2CC1(O)C2CO,0.311
N=C1OC2C3OC3C2O1,0.2977
OC1CC2(O)CCOC12,0.2987
CC[NH2+]CC(=O)C([O-])=O,0.1718
NC(=[NH+]CC([O-])=O)C#C,0.2081
CC1CC1C1OC1C=O,0.2158
N#CC1C2NC2C11CO1,0.2793
C1CC(C1)CCO,0.3423
CC(O)CC1C(C)N1C,0.2732
Cc1ccc(o1)C(=O)N,0.2006
CC(O)C(C)C1CC1O,0.3184
CC12CC1C1NC21CO,0.2551
CC(=O)CCOCCO,0.2349
CC1(O)CC2NC2C=C1,0.2398
NC1=NC(CC1=O)C#C,0.1826
CC12CC1N1CC1C2O,0.2834
CCC(C)(C)C1OC1C,0.3284
CC12COC1CO2,0.3044
CC(=O)C1CC2C(O)C12,0.2108
CCC(C)(C)C(O)C#C,0.2939
COC(=O)C1OC1CO,0.2589
CCC12COC1CN2C,0.2754
Cc1c(nc(o1)O)N,0.2235
CCC1(C)OC(=N)C1C,0.2878
CCC12COC1C(=O)C2,0.1991
CC12CN1C1COCC21,0.309
c1c2c([nH]n1)CN=C2N,0.2257
c1c2c(on1)OC=NC2,0.2136
CC1CNC(NC=O)=N1,0.2012
CCC1C2C3C2C2C3C12,0.3048
N=C1N=CN=NN1C=O,0.1503
OC12CC3OC1C2C3=O,0.2049
CCC1=CC(OC1)C#N,0.2532
CC1(C)C2OCCC12C,0.3095
CC(O)C1CC2C(C)C12,0.3125
CC1C(C)C1C1COC1,0.3149
C1CC23OC2CC2C1C32,0.3382
CC1C2OCOC2C1=O,0.1947
CCC1(C)CC2(C)NC12,0.3005
CC12CCN1C(=O)OC2,0.2893
N=C1ON=CC(C=O)=N1,0.1356
C1NC1C12CN1CC=C2,0.23
CC1OCC1(C)N1CC1,0.31
COC1CC=CC11CC1,0.2459
O=CC1(CC2CC12)C#N,0.2151
CCC(C)N=C(N)C#N,0.2215
O=C1CC2C1N2CC#N,0.2102
N=COC1CN=CO1,0.2777
CN=C1NC2CC12C#N,0.2471
CC(O)C(=O)COC=N,0.2182
c1c(c([nH]n1)OC=O)O,0.2081
OC1CNCC(O)C1=O,0.1966
CCCC1(CC)CC1C,0.3345
OCC#CC(O)CC#C,0.2774
CC#CCCCCC#N,0.2859
CC1CC(O)C2(C)OC12,0.3295
CC(C#C)C12CC1CC2,0.3014
C1C2C3OC4C1C2C34,0.2957
CNCC(C#N)C(N)=O,0.2443
C1C(CO1)CCC=O,0.2264
Cc1ccnc(c1)C#C,0.2007
CC1C2CC1(C)N1CC21,0.3138
N=C1OC2(CNC12)C=O,0.1966
NC(=O)C1OCC11CC1,0.2636
COCC1C2CC1C2,0.3402
NC1C(CO)NC1C#N,0.2594
C1CC2CCCCC1O2,0.3091
CC1COC(=N)C1=O,0.1879
C(C(=O)C#N)N=C(N)N,0.1527
CCC12CC1C(O)C=C2,0.2392
CC1(CC1O)C#CC=O,0.2031
OC12CC1OC2CC=O,0.218
CC1(CC1)C2CC2,0.3309
CC(C)c1cocn1,0.2465
CC(=O)CC1(CC1)C#C,0.2233
O=C1CC=CCC1C#N,0.2188
CN=C1NC(=N)NN=N1,0.1691
CC1C2C3C1C(C)(C)N23,0.3197
CC12CC(O1)C1NC21,0.3044
C#CCC1NC1C1CO1,0.2989
CC1C2CCC12CC=O,0.2186
OCC1NC1C(F)(F)F,0.3198
C#CC12CCC1OC=N2,0.2629
CC12OC(=N)C1CC2O,0.2853
OC12CC1NC2CC#N,0.2656
C1CCOC(OC1)C#N,0.2984
CN1C2C1C(C)(O)C2=O,0.1988
O=C1CC2C3CN2C1C3,0.2234
N#CC1(CO1)C1CCO1,0.2656
c1coc(=O)c(n1)C=O,0.1411
CC(=O)CCCC1CC1,0.2342
CNC(=O)N1CCCC1,0.2923
N#CC12CC=CC1CN2,0.2416
CC1(O)C2(C)COC12C,0.2804
COCC1C=CCC1=O,0.2232
CCC(CC(C)C)OC,0.3191
O=C1C2CNC3CN2C13,0.2084
c1c(c2c(o1)CC=C2)N,0.1867
c1c(nc([nH]1)N)N(=O)=O,0.1672
CC12CC1N=CN2C=O,0.2127
COC12CC1(C)NC2=O,0.2401
COC1(C#C)C2CCC12,0.2753
CCC12CC3C(O)C1N23,0.3061
CC1(C)C2CC11OCC21,0.3014
CC1C(=O)C(C)C11CC1,0.2179
c1cn[nH]c1OCCO,0.2515
CCC12CCC1CC2=O,0.2156
O=C1COC11C2CCC12,0.2123
OC1CC2OC2C11CC1,0.3408
CCOC1(CO)CC1C,0.31
CC(=O)C(C)(C(=O)C)O,0.1945
Cc1ncnc(n1)C#N,0.1962
c1c(c(c[nH]1)N(=O)=O)N,0.143
C#CC1(CO1)C#C,0.2583
N=C1OCCC2OCC12,0.2686
[O-]C(=O)C1CC[NH2+]1,0.2639
OCC(CO)C(O)C=O,0.2074
C1C(CN1CC#N)O,0.2649
O=C1COCCN2CC12,0.1972
COC1(COC1)CC=O,0.2221
C(C#CC(F)(F)F)O,0.2757
O=COC1CC2OC2C1,0.2789
CC1=CC=C(C=CC1)C,0.1817
OCC(O)CCCC#N,0.3031
CCC1OC2C(C)CC12,0.3142
CC(O)CC1CC(O)C1,0.3203
CC1N=C(N)OC11CC1,0.2756
CC1CC(=CCO1)C#C,0.2121
CC(=O)N(C)C1CC1,0.2665
CNc1cc(c(o1)O)N,0.2108
CC(=O)C#CCN(C)C,0.1781
CC12C3C=C4CC1C4C23,0.1731
CC(C)C1C2C3CC2C13,0.3643
CC12NC1C1NC2C1=O,0.2304
COCC1C2CC=CC12,0.2475
OC12CCC3C=CC1C23,0.2314
CC1C2OC3(C)CC3C12,0.3095
CN1C2CC3OC3C12,0.2803
N#CC12CC3OC3C1N2,0.2771
CCC(C)(C)C(C)C#N,0.3449
O=C1CN2CC1OCC2,0.1748
Cc1ccc(c(c1)N)F,0.2062
CC1COCCC(C)=C1,0.2512
CCOCC1(O)CC1O,0.3152
OC1CNC2=NOC=C12,0.2203
CCC1=CC(=N)NN=N1,0.1655
CC1(O)CC2OC2C1=O,0.2057
O=C1C=C(C#N)C2CC12,0.1659
O=COC1CC(=O)CO1,0.2223
CC1C2COC3CC3C12,0.3123
C1C=C(CNC1=O)C=O,0.1855
O=C1C2NC3CN1C23,0.2173
O=C1CC2OCCNC12,0.1976
OCC(O)(C#N)C1CC1,0.3044
OCC#CC1OC1C#C,0.2515
O=C1CNCC2CN2C1,0.1945
CN=COC(C=O)C#N,0.2144
CC1NC11CC2OC12C,0.307
CC1N=C(N)C2OC12C,0.2457
CN=C1CCCO1,0.2752
[O-]N=C(C#N)C1CC[NH2+]1,0.1276
O=C1NCCC1C1CO1,0.271
CCC1C(C)C1C(N)=O,0.2701
CC1=NC(CO)CO1,0.2637
O=C1C2CC2C2CC1O2,0.2049
CC1NC1CC(O)C=O,0.211
CC(C)C1C2CC1(C)O2,0.3063
O=C1OC2CC12CC#C,0.2663
OCC12CN3CC1CC23,0.2855
CN=c1n(c(co1)O)C,0.2202
CC1(C)CC2C1CC2=O,0.2193
CC12CCC(C1)C(=O)C2,0.2229
C1C=C(NC(=O)O1)C=O,0.1679
Cc1c(nn[nH]1)CCO,0.2411
CC1C(C)C1(O)C1CN1,0.2822
O=CC12OC3=NCC1C23,0.1609
CCN=C1C=CNN=C1,0.1684
CC1(CC1)C2OCCO2,0.339
CCNc1conc1O,0.2141
OCC12CN3C4C3C1C24,0.287
CC#CC1(O)CC=CC1,0.2678
Cc1c(ncoc1=O)O,0.1879
NC1=C(N)C(=N)NN=N1,0.1487
CC1CC2(CC2)C1C,0.3433
O=C1CC2CC12,0.2329
OCC(O)CCOC=N,0.2824
CCC12OC1CC1OC21,0.3185
N=COC(C=O)C#N,0.2289
CC(=O)C1(CN1)C=O,0.2204
OC12CCC(OC1)C=C2,0.2475
OCC12CC1(CO)OC2,0.2918
c1c2c([nH]n1)C=CC2=O,0.1426
O=C1C2C3C1NC23C#C,0.218
N=C1OC2CN3C2C13,0.2556
NC(C#N)C12CCC1O2,0.2838
Cn1cc(c(n1)N)C=O,0.1854
CCC(O)(C#C)C1CO1,0.2899
CCCC(C)(C)C#N,0.3538
c1c(c(c2n1CC2)O)O,0.2232
Cc1cc(=O)c(no1)C,0.1856
CC12OC(C=C1)C2C#C,0.2325
CC1CC(C)(O1)C#N,0.2883
CCCOC1CC1C,0.3328
CN1CC1C(C)(O)C#C,0.2514
CCC(O)C1OCC1=O,0.2191
COCCC(O)CCO,0.3178
CCN(C)c1cn[nH]n1,0.2042
c1c(cnc(c1O)F)N,0.1911
O=C1CC2CC12C#N,0.232
CC(C)(CC1CO1)C=O,0.2291
c1cnccc1OC=O,0.2304
C1CC12CCNC(=O)O2,0.3102
OC12CC1C(=O)N1CC21,0.2307
COC(C)C1=CNN=C1,0.2614
CC(=O)c1ccoc1,0.2031
C#CC(C1CC1)C2CC2,0.3094
CC1COC2CC2C1C,0.3155
CC(=O)CCCCOC,0.2346
COC(C)CC(C)=O,0.2349
NC(=O)N1C=CNC1=N,0.2102
CCC(=O)C(OC)C#N,0.2241
CC(C=O)N1C=CN=N1,0.2154
CC(=O)C(C)(CO)C=O,0.198
CCc1nc(=O)onn1,0.159
CCCC1(CO1)C=O,0.2206
O=CC1(CCC#C)CO1,0.2176
CC(C=O)C1C2COC12,0.2267
CC1CN1CC1(C)CN1,0.3148
NC(CC1CC1)C#N,0.2947
CCN1C(CO)C1CO,0.2782
CC1CCC(O1)C#N,0.2957
CC1CC(C1)C(C)(C)O,0.3233
COCC1=CCOCC1,0.2616
C1N2C3C4OC=NC13C24,0.2344
C(CC#N)C#CCCO,0.2861
CC12CC1C1(CO1)C2=O,0.2144
COC1=NON=CC1=N,0.1789
OCCC1C2CC=CC12,0.2457
CN(CCCO)CC=O,0.2018
O=CC1CC2OC12C#N,0.2145
CCC1CN2C=CN=C12,0.2559
O=C1CCC2C3OC1C23,0.2111
c1nc(n(n1)C=O)C#N,0.2044
CCN=c1[nH]cno1,0.2202
OC12CCC1C1CC1C2,0.33
CCc1c(non1)C=O,0.1879
CC1(C)C2OCOC12,0.3376
CC1C2OCC1C(C)=C2,0.2485
OCC12CC3C(CN13)C2,0.2936
CN1C=CCCCC1=O,0.2168
O=C1CNC1CC1CO1,0.2186
O=CC1CC(=O)C2CC12,0.2105
C1CN=C2CN=CN2C1,0.2129
CC1CC2CC2OC1=N,0.2804
OC1(CC1OC=O)C=O,0.2146
CC(O)C1(C)CC1CO,0.3209
CN1C(C=O)C1(C)C#C,0.1907
C1COC(=O)C=C1CO,0.218
CC1COC2(C)CC2C1,0.3013
c1(c(n[nH]n1)N)N,0.214
c1c(c(no1)CCO)N,0.2157
CC(C)(C1=NCCO1)O,0.2717
N#CC1CN2CCC12,0.2516
CC12OC(CO)C1C2O,0.3021
CC#CC1(CCO1)C#C,0.2522
CC1C[NH2+]CC1C([O-])=O,0.2749
CC(O)C(=O)N(C)C=N,0.2326
CC1CCC(=O)O1,0.2791
C(CN(C=O)C=O)CO,0.2157
OC1C2C(=O)CCC12O,0.2248
CC1CC2CC(=O)NC12,0.2762
CCC1C2CC3C2C13O,0.3127
OC1(C#C)C2OCOC12,0.2523
Cc1c(c(no1)N)C#C,0.2146
c1c(c(c[nH]1)OC=O)O,0.2062
CC(O)C1(CO1)C(N)=O,0.2636
O=CC1CC=C(C1)C#C,0.2077
O=CC(C#C)N1CC1,0.2122
COCC12CCC1N2,0.3362
CCC1OC(C=O)C1O,0.2084
NC1(CC2(CN2)C1)C#N,0.277
CC(O)C(C)C#CCO,0.2759
Cc1cc2n(n1)C=CC2,0.1989
CCC12CCC1CCO2,0.318
OCC#CC1OCC1O,0.2688
C1C2C3C4C5C4C(C13)C25,0.3393
CC(CO)CO,0.3342
CNc1ccnc(n1)F,0.2098
CC12CN(C1)C2C#C,0.2557
CC12OCC3OC1C23,0.2915
CC(C)(C)C(=O)CC#C,0.2279
CC12OCCC1C1NC21,0.2953
COCC#CC1CC1O,0.2673
CNC(=O)N1CC1,0.2821
OC(C#C)C1CC(=O)N1,0.2667
Cc1ccnc(c1N)F,0.2002
NC(=O)C12OC1CC2O,0.2478
CC1(CCO1)C(O)CO,0.3153
CC1N2C3CC2C13C#C,0.2717
N=C1OCCCOC1=N,0.2484
COCCc1ncon1,0.2338
CCCCCCC,0.3902
CC(O)C1=C(C)OC=N1,0.2373
COC1CN2C=NC=C12,0.2545
OCC1CC2(NC12)C#C,0.2509
CC12CC1(C#N)C1CN21,0.2665
N=C1CCCCOCO1,0.2832
CC1(C=O)C2OC1C2=O,0.2124
CC(OCC#N)C1CO1,0.2806
C1C2(CN1C=O)CO2,0.2649
CC1CN2CC2C1CO,0.2946
N=C1OCCCNC1=O,0.2209
CC12CCC11COC1C2,0.3074
C1C2OC3CCCOC123,0.2941
Cn1c(n[nH]c1=O)CO,0.2256
ON=C1CC2OC12C=O,0.2109
O=C1CC2C3CCC12O3,0.2248
CCC(CO)CCC#C,0.3159
C1C2OC34CN(C3)C4C12,0.2968
COC1COCC1C#C,0.2994
C1CC1(CNC=O)C#N,0.2774
CN1CCC2NC2C1=O,0.2471
CN1C2CC(C#N)C12C,0.2723
CCCC1CN1C1CC1,0.2975
CC12OC(C=C1)C21CC1,0.2295
COC12CC(C1)C1NC21,0.3104
COCCC1C(C)C1O,0.3142
CC1(C)C2NC2C11CO1,0.3053
CCC1CCC1CC,0.3631
CC1=CC2(CC2)CC1=O,0.1959
CC(O)C1CC(C1)C=O,0.2235
CCC(=O)C1(CO1)C#N,0.2247
CC1=NC(C#C)C(=O)N1,0.2278
CC1=C(C(=O)OC1)C#N,0.2108
OCC1(COC=N)CN1,0.2717
CC(=NC)N(C=O)C=O,0.2133
CC1CC2(C)CN3C1C23,0.3029
O=COC1CC2CC1O2,0.2653
OCC1C2C=CC1C2O,0.2416
CC(CC(O)CO)C#C,0.3034
OCC12OC1CC2=O,0.2147
CC12C3CC1OC2C3,0.3121
CC1OCC(O)C2NC12,0.2993
NC(C#C)C(=O)OC=N,0.2263
Cn1cc(cn1)OC=O,0.2399
OC1CC(CC#C)C1O,0.2991
CC(C)(CC1CCC1)O,0.3182
CN(CC#N)C(=O)CO,0.2659
O=C(C#C)C12CCC1O2,0.1953
C1C2C=CC3OCCC123,0.2458
c1nc(on1)C#CCO,0.2078
Cc1cnccc1C#N,0.2012
N=C1C=NNN=C1C#C,0.16
CC(C#C)C(C=O)C#C,0.2149
C1N2CCC3CC12CO3,0.3125
N#CC1(CO1)C1CCC1,0.3013
CC1=CC(CO)OCC1,0.2575
CN1CC11COC1C#C,0.2594
CCC(=O)OCC1CO1,0.286
CC(OC=N)C1OC1C,0.2823
NC1CC(C#N)C1C#N,0.2656
CC1(C)CCC1O,0.3296
OC(COCC#C)C=O,0.228
CC#CC1OC(=N)C=C1,0.2187
CCC1CC2COC1O2,0.3333
NC(=O)C(O)C(=O)C#C,0.19
c1c(c(=O)nc[nH]1)N,0.1879
ON=C1C2C3OC1C23O,0.2444
CC12CC1C(CCO)O2,0.3107
C1C2CCCCC12,0.3426
CC#Cc1cocc1C,0.2137
O=C1CCC2CCC12,0.216
COC1CC1NC(C)=O,0.2616
OC(C#C)C1NC1C#C,0.276
C1C2=NCC(=O)N2C=N1,0.2141
CC1CC=CC(=O)C=C1,0.1787
C1OC1C12CCC1CO2,0.3034
C(C#N)C(C=O)(C=O)O,0.1907
CC12NC1C(C=O)C2O,0.2012
CC1(O)C(O)C=CC1O,0.244
CC1C(=O)NC=C1CO,0.2088
CC(O)C1(C)OC1C#C,0.2792
CN(C=O)C(=O)C#C,0.2004
CCC12CC(C1)C=C2C,0.2367
CC12OC=NC3C1OC23,0.2414
Cc1c([nH]c(n1)C)C=O,0.1853
CCC1OC(C)C1C,0.32
C1C2C=CC3OCOC123,0.2322
OC(CNC1CC1)C#N,0.2679
OCC1NC(=O)NC=C1,0.2219
OC(C1CO1)C1CCO1,0.3126
CC12OC1C1C(CO)C21,0.2853
C(=N)Nc1nc([nH]n1)N,0.2225
C#CC12CC3=CCN1C23,0.1656
c1c2n(nn1)CCO2,0.2391
OC12CC(C1)COCC2,0.3242
C1CC11CC2CC2C1,0.3496
O=C1NCC2CC=CN12,0.2268
N#CC1CC2CCOC12,0.2908
OCCC12CC1C(=O)N2,0.2549
c1cc([nH]c1)CC=O,0.1775
O=CC12CC(C1)(C2)C=O,0.2039
O=CCC12C3C4C(C13)N24,0.2015
COCC(=O)C(O)C#N,0.2281
NC(=O)N1N=NNC1=N,0.1926
CN1C2CC1(C)C21CO1,0.3052
CC1(CO1)C1C2CC1O2,0.3165
CC12CN1CC(=C2)C#N,0.1907
CC12CC=CC11CC2O1,0.2265
C1C2CCC3N=COC123,0.2583
CCN1C2CNC(=O)C12,0.2515
OC1C2C3C4C3N2C14,0.2817
CC12C=CC3N1CC23O,0.2182
Cc1c(nc([nH]1)O)C#N,0.2122
CC1C2C3N1C2C31CC1,0.3102
CC1C2OC1C2(O)C=O,0.2056
CCC(C)(C#N)C(N)=O,0.2775
CN(C)C(=N)C(=O)C=O,0.1234
OCC1(CC1)C(O)C=O,0.211
N#CC1=CC2CN3C2C13,0.1981
CCC1=CC(C)CCC1,0.2563
COC(=O)C(O)C(C)C,0.267
c1[nH]nc(n1)CCC=O,0.2273
O=C1NC2CC3C2C13,0.2578
CCC(C)C(=O)NC=O,0.2176
O=CNCC1CC1C#N,0.2781
OC1C2C3C1CN23,0.3007
CCC1(CC#C)OC1C,0.3026
COC12CC1C(C)C=C2,0.2447
OC12CN3CC4C(C14)C23,0.2827
CC(CO)C1COCO1,0.3292
CC1NC1(C)C(=O)CO,0.2132
CC(=O)C1OC1C1CO1,0.2193
CN(C=NCCO)C=O,0.2295
OCC1CC2NC2C1,0.3119
CC1(C=O)C2COC12,0.2224
OC1COC2CC2OC1,0.318
N=C1OC2C3NC3CC12,0.2794
COC1CC11CC2NC12,0.3017
CC(O)C(O)CCCO,0.3188
c1c(cncn1)F,0.2069
Cc1cc([nH]c1CO)N,0.2188
CN=c1[nH]c(co1)C#C,0.1714
CC1C=CCCC=C1,0.2568
COCC(C)CC(N)=O,0.2789
OCCC1C2C=CCN12,0.2249
N=C1OC=C(CC#C)O1,0.238
C1C2CCC11CC=CC21,0.2585
CC1CC2(C#C)C1N2C,0.2711
CN1C2C3C2C1C3C=O,0.2056
COC1(CC1)CC#N,0.2989
CC1OC2=NCCC12O,0.246
CCC12CC(O)C1(C)O2,0.3108
CN1C(CO)C1C1CO1,0.293
CC(C#N)C(CO)CO,0.3023
CN1C2C3OC3C(O)C12,0.2687
Cn1c(c(nn1)O)N,0.2185
CC(C1CC1)N1CC1,0.3146
NC1=CN2CCC2=C1O,0.2103
CC(C=O)C1CN1C=O,0.2064
CC12CC1C(C2)OC=O,0.2752
N#CC12NC1CC1OC21,0.2668
NC(=O)C1CC(C1)C=O,0.2257
c1c(c(cnc1O)N)O,0.1885
NC(C#N)C1CCC1,0.2815
CCc1c[nH]c(n1)CO,0.2437
CN(CC(=O)C#N)C=O,0.1626
COC1CCCCOC1,0.3183
CC1CCC(C)(N1)C#N,0.2837
CC(C)C1=CCOC1=N,0.2185
Cc1c(oc(n1)N)CO,0.2272
C1C(=C(C(=O)N1)N)C=O,0.1713
OC(CC(O)C#N)C#N,0.2948
C1NC1C1C2C3CC3N12,0.2676
c1cnc(=O)[nH]c1CO,0.1799
CC12OC(=N)C1N1CC21,0.2515
CCCC1COC1C=O,0.2142
CC1CCC=C1CC=O,0.2085
CC1(CO)CC2CCC12,0.3315
C#CC1(COC1)O,0.2733
OC1C2C3C1C(O)CN23,0.2927
CCC12NC1CC21CO1,0.3052
OC1CC23CC4N2CC134,0.2486
OC1(C#C)C2C3OC3C12,0.2602
CC12COC1=NCCC2,0.2687
CC1C2C3C4C=CC13C24,0.2217
OCC1C2CC3OC1C23,0.2973
CC([NH2+]CCN)C([O-])=O,0.2649
ON=C1C2C3OCC1C23,0.2422
c1nc(nnn1)NC=O,0.1639
CC1OC1(C)C(N)C#N,0.2779
OC1CC2(C1)OCC=C2,0.2456
COC12CC1CC2CO,0.3063
CC(C)C1C2C3CN3C12,0.2847
OC1C2NC2(C=O)C1=O,0.1849
O=CC1CCCC(=O)N1,0.2006
C1COc2c1[nH]nn2,0.2104
O=C1NC2CC1NC2=O,0.2319
CC1C(C)C2=CCOC12,0.2365
C1NC11COCC=CC1,0.2484
CCC(O)CC#C,0.3039
CN1C(CC11CC1)C#N,0.2413
Cc1ccc(c(c1)O)C,0.2185
COC12CC3CC1C23C,0.3313
Cc1nc(co1)OC,0.2166
C#CC1C2CN=COC12,0.2671
C1C(CO1)COC=O,0.2624
CC1CC2CC1OC2C,0.3191
c1c(cn[nH]1)CC(=O)N,0.2392
CNC(C)(C#N)C1CO1,0.2797
c1c(onn1)C(F)(F)F,0.2369
CC(=O)N1CC1CO,0.2549
Cn1ccc2c1[nH]cn2,0.2208
CC(C)C1=CC2CC1O2,0.2333
N=C1OC2CC1C1CC21,0.2859
CCC(O)CC1CCC1,0.3257
CCC(C)OC1CC1O,0.2981
C1C=CNC(=O)NC=N1,0.2167
c1c2cn[nH]c2[nH]n1,0.2321
CN=C(OC=O)C(C)O,0.2318
C#CC12CC3C(CC1)C23,0.298
c1c(nn(n1)C(=O)N)O,0.2118
CC(O)C1(O)CC=CC1,0.2662
COC12CC3C(C1)C23O,0.2991
NC1=CC(=N)C(F)=CN1,0.1869
c1nnnn1C(=O)C=O,0.164
CC1(C)C2NC2C1(C)O,0.3005
O=C1OC2CCC12C#N,0.2712
CC1OC1CC#C,0.3105
CC1NC1(C=O)C#N,0.223
CC1(O)CC(=O)C1O,0.2186
C1C2N=C3OCC3C12,0.2462
CCC(C)C1(CC1)C#C,0.2945
CC1(N=CNC1=N)C#N,0.2272
C1C=CC(=O)NC(=O)O1,0.2022
CC(C)C12CC1C(=O)N2,0.2548
CC1C2CCC1CC2,0.3588
CCCC(=O)C,0.2345
CC12CN1C1C3OC1C23,0.3001
CNc1cncc(n1)N,0.1776
CC(=O)Oc1[nH]ccn1,0.2004
CC1C2CC(CO)=CC12,0.2422
CC12NC1C1(C)OCC21,0.2972
CC1(CO1)C#C,0.2879
CCC1CC(CO)C1O,0.3146
CC12CC(O)CC1C2O,0.276
CCc1cn(cn1)C=O,0.1915
CCC(C)CC(F)(F)F,0.3997
C1OC2CCCN=C2O1,0.2652
OC1COC(=N)C1,0.286
CCC1OC(=N)C=C1,0.2109
c1[nH]c2nnc(n2n1)N,0.1953
c1c(nc[nH]1)CCO,0.2512
COCC12CC3CC1N23,0.3272
CC1OCC(C)(O)C1C,0.2953
CC[NH+](CC)CC([O-])=O,0.2633
CC1(CN1C2COC2)C,0.3027
NC(=O)C(=N)OCC#C,0.2178
CC1NC(=O)OC1CO,0.3136
CCC(=O)C1CC1C#N,0.2282
O=C1NCC1CC#C,0.2769
CC12OC3CC1C23O,0.2949
CC1CNC(=N1)C1CO1,0.2311
C1C2CCC3OCC3N12,0.2978
O=C(OCC1CO1)C#N,0.2206
CC1C2CC(C#C)C12O,0.2882
CCNc1cc[nH]n1,0.2247
CC1CC(O)CC2CC12,0.329
OC1CC11COC=N1,0.25
NC1=C(NN=N1)OC=N,0.213
CCN1CC2(C)OCC12,0.2862
c1c[nH]nc1C2CC2,0.254
CC1(CN2CC12)OC=O,0.251
c1cncc(=O)c(=O)[nH]1,0.1467
CC12CC(CO1)COC2,0.3169
COC1OC(C)CC1C,0.3386
CC#CC(C#N)N(C)C,0.2475
CC12CC1(C#N)C(=O)O2,0.2677
C#CC12CC3CC1N2C3,0.2772
CC1C(O)C1C1CCC1,0.3087
C1CC2=CC3OC3C12,0.2364
CC(O)C1CC1(C)O,0.3204
C1CC(C1)(C(=O)CO)O,0.2343
CCC(O)C1C2CCN12,0.3025
CCN(CC(C)C)C=O,0.2694
CC(N1CC1)C(=O)CO,0.2272
Cc1nc(on1)N(=O)=O,0.1963
OCC1C2CC2C2CC12,0.3191
C#CCC(CC#N)C#N,0.2874
CCC(CO)C1CC1O,0.3286
CC1=CC(=O)NCC1,0.2094
CC(C)C1=CCOCC1,0.2605
CC1C(CC(N)=O)N1C,0.2607
COC(CC#C)C1CN1,0.2931
CC1(CO1)C1CC1C#C,0.2895
Cc1c(c(=O)[nH]cn1)N,0.1744
c1c-2ncnc2non1,0.1699
O=CCC1NC11CCC1,0.2188
CC1CC=CCC1CO,0.2676
c1c[nH]c(c1N)OC=O,0.1891
CC1CC2C=CC1C2O,0.2583
CC1OC1CC=O,0.2251
CC12C(CC1O)C2C#C,0.2902
CC1(CNC1=O)C1CN1,0.2719
NC1=C([O-])C(C[NH3+])=CO1,0.2017
Cn1c2c(nn1)non2,0.1839
CC1(O)CC1CO,0.3217
Cc1c(c(c([nH]1)O)O)O,0.213
OCC1COCC1C#C,0.2994
OCC12COC1C=CC2,0.252
CCCC(C#N)C1CO1,0.3114
C(C1COCO1)N1CC1,0.3284
CC1C2C3OC(C23)C1C,0.2992
CC(C)(C)CCN1CC1,0.3037
CC1=CC(=O)COC1,0.1804
CC1C2OC2C11CCO1,0.307
CC1C2CC3OC3C12O,0.3241
CC1OC(C=O)C11CN1,0.216
OC1CC2CN2C1C#C,0.2803
CCCn1cn[nH]c1=O,0.2383
CC1=CNC(=N)N1C=O,0.1797
NC(C#CC#N)C(N)=O,0.2044
CC1(O)CC2(CC2O)C1,0.315
OC12CC3C1CC=CC23,0.2434
O=C1C2CC3(CNC13)N2,0.2015
CNc1[nH]c(c(n1)O)O,0.2163
OC(C#C)C1CCOC1,0.2765
OC1(CC=O)COC1=O,0.2081
CCC12CC1(C)CC2=O,0.2316
CC1=CC2(CC1N2)C#N,0.2398
O=CC1C2OCCOC12,0.2223
OCC1(O)CC2CC2C1,0.3232
c1c(cnc(c1N)N)F,0.188
C1CC23OCC2OCC13,0.3134
CC1(O)C2OC(=N)C12,0.2663
N#CC1CC2C=CCN12,0.2428
C(C=O)N=COCC=O,0.2034
CC1=CC(O)C2CC12,0.2405
CC1C2COC1CO2,0.3283
COC1(CO)CCC1O,0.3036
CC1OC1(C)C1CO1,0.3326
NC1=NC(=N)N=C(F)O1,0.2272
NC1=NC2CCOC2O1,0.2826
OC1CCC11COC1=O,0.2692
CC12CC1OC2CO,0.3052
CC1(CC(C1)C=O)C=O,0.205
CN(C)C1(C)COC1=N,0.2425
O=C1CC2COCC12,0.2146
CC(CC#N)C(C)=NO,0.2569
OCC(NCC#C)C#N,0.2639
O=C1OC2(COC12)C#N,0.2457
O=CC1C2OC1C21CC1,0.207
O=C1C2C3N2CC13C#C,0.217
CCC1=CC(=O)CCN1,0.1885
COC1CC1C1COC1,0.3114
CCC1C=CCOC1=N,0.2622
C1C23COCC12C1NC31,0.2674
CCC#CCCC#CC,0.2895
CC1N2CC3(O)C2C13C,0.2787
CC(C)CC(C)CCO,0.3383
CNC1=CC(=N)OC1=O,0.159
CC1CC(C1)OCC=O,0.2286
c1cn2c(n1)C(=O)C=C2,0.1405
CCC(C)(CC)COC,0.3246
NC(=O)COC(=N)C#C,0.2217
CC#CCC(=O)OC,0.2636
OC1(CC=O)CN2CC12,0.2224
OC1CNC=CC(=O)C1,0.1781
CCCC(=O)N(C)C,0.2697
COC(=O)N1CCCC1,0.2911
O=CC1CC2(CN12)C#C,0.2062
CC1=CNN=C1C1CO1,0.2526
C1CC23C4CC2(CN13)O4,0.2469
OC1C2C3OC(=N)C2C13,0.2776
CC1(C)C2OC2C1(C)C,0.3261
CC(C)C1=CCC2OC12,0.2437
N=COC(=O)C#CC=O,0.2021
CCOCC#CC=O,0.2058
CC1CC(C1)C1CO1,0.351
CC1C2CC(=O)C1O2,0.2118
O=C1COC2CCC2N1,0.2616
C#Cc1cc(ncn1)N,0.1935
CC1=CC2CC1C2(C)C,0.2351
CCCC(=O)C(C)O,0.2367
FC1=CC(=N)OC=N1,0.1804
CC12CC(CC1)C2C=O,0.221
CC12CC1CCC2C#N,0.3159
C1OC2C3OC4C3CC124,0.2994
CC(C)OC(C)(C)C,0.3135
Cc1[nH]nc(n1)C,0.2627
C1OC2CC3COC12C3,0.3039
CC1(C)NC11CC(O)C1,0.3005
O=CC1CCC1C1CO1,0.2233
COC(C)C=O,0.2269
OCC12CC1C(O)C=C2,0.2422
C#CC12CCCC1CO2,0.2786
CC1CC1C(CO)CO,0.3038
CC12CC3C1C1C(C2)N31,0.2979
COC(C)(C#N)C1CO1,0.2895
CC12CC(C1)CN1CC21,0.3026
CC1C2OC3CC2C13O,0.2972
CC1C=CC=CNC1=O,0.1846
CC1CCC2(CN2)C=C1,0.2499
CC1C(CO)C(C)C1=O,0.2202
CC1CC(C)(C)C(C)O1,0.313
c1c(noc1N)CC=O,0.2073
CC(C)C12CC(=O)C1N2,0.2216
CC#Cc1conc1N,0.2106
CC(C)(O)C(C=O)C#C,0.2199
CC12C3C4C5C4N(C13)C25,0.2974
CC12NC1(C)C1CC2O1,0.3196
C#CC(=O)OCC(=O)N,0.2169
CCC1OC2CCC2=C1,0.2358
O=CN1CC2C(C#C)C12,0.2543
NCC([NH3+])C(O)C([O-])=O,0.2748
CCC1CN(C)CC1=O,0.1875
OCC(=O)N1CCC1=N,0.2302
CN1C(=N)OC(C)=C1C,0.218
NC1=C(N=CO1)C1CO1,0.215
OC1CC2(OC12)C#C,0.2617
OC(C=O)C1CN1,0.2043
O=CN1CC(C1)C1CO1,0.2667
O=CC(CC#C)C1CC1,0.223
OC1(CC11CCO1)C#N,0.2596
O=C1CC2CC2C11CN1,0.2165
C1C2C3C4CC(C3O4)N12,0.3141
CC#CCC(C#N)C#N,0.2597
CCCc1cc(n[nH]1)C,0.2583
CC1(CN=CO1)OC=O,0.27
N#CC12NC3CNC1C23,0.2368
O=C1COC2CC2C1,0.2124
O=COC1CCC2CC12,0.2847
OCCOC1CN2CC12,0.3057
O=CN1C2CC1C1NC21,0.2651
CC12CC1CC=C2C#C,0.2019
CC12NC3CC1(O)C23O,0.2631
OC1C(NC1C#C)C#C,0.2516
OCCCC1(CO)CO1,0.3361
CC12CC1C(=O)C2C=O,0.2131
N=C(C#N)N1CCCC1,0.2057
OCC1C2CN2C1C#N,0.255
Cn1c(ccc1O)C#N,0.1982
C1C2OC3CC=CC2C13,0.2454
CC1CC23CC(O2)C13O,0.278
CC1(C)C2C3CC3N12,0.2769
OC12C3CC(=CC1=O)C23,0.1621
O=C1OCC2CNC=C12,0.1875
CC(C)(C1(CC1)C=O)O,0.2247
C#Cc1cccoc1=O,0.1567
CC12CC1OC(=N2)C#N,0.2094
NC(=[NH2+])[C-](O)C(=O)C=O,0.1096
N#CC1=CC2C3CC1N23,0.1803
CC1=CC(=O)C2OC12,0.1762
C1C=C2CC=CC22OC12,0.2263
CCCC1CCC(=N)O1,0.2852
[NH3+]C(CC#C)CC([O-])=O,0.2697
CCC(=O)CNC(=O)N,0.2261
C1CNC(=O)NC1=O,0.2487
CCCCC#CCOC,0.2833
O=C1C=C2CN3CC1C23,0.1718
C(#N)c1[nH]c(c(n1)O)N,0.1762
CC(=O)CC1(C)CN1,0.2243
CCC(C#N)C(C)CO,0.3084
OC12CCC3CC1C2O3,0.2914
CC1C(OC11CC1)C#C,0.2555
CC1C2C(C=O)C1C2=O,0.2117
CC12OC1C(O)C2C#C,0.2849
OCC(O)C(C=O)C#C,0.217
CC1NC(=O)NC1C#N,0.271
O=CC1C2C3CCC1N23,0.2064
N=C1NC=C(N=C1)C#C,0.1461
CC1OC(C2CN2)C1O,0.3207
CCC1N=CN(C)C1=N,0.2212
C1C2CC3(CC4OC34)N12,0.3135
CC12CC(C1)C1CN1C2,0.3
OC(CN1CC1)C=O,0.2117
CC1CC(N)C1(O)C#N,0.3042
OC12C3N=C4NC(C13)C24,0.1597
N=C1OC23CC(CC2)C13,0.2735
NC(=O)C1=CNC2CC12,0.1926
CCC1CC1C(=O)CC,0.2308
OC1CCOC(=O)C1O,0.2619
CC1CC(O1)C(O)C#C,0.2703
C1OC11CC2(CO2)C1,0.3116
CC1C2CC(C)(O)C12O,0.3184
CCC1(C)OCC2NC12,0.3095
CC1OC2C3NC3C2O1,0.3063
COCC1C2CC1C2O,0.3248
O=C1OC2CCCC1O2,0.2673
CC1OC2CC1C(=N)O2,0.2855
CC(CCN1CC1)C=O,0.2195
C#Cc1ccc(o1)CO,0.191
CCCC1CNC(=O)C1,0.2736
CC(O)CC(C)(C)C,0.3238
[NH3+]C12CC1(NC2)C([O-])=O,0.2368
[O-]C(=O)C1CCNC1=[NH2+],0.2214
OCC1C2CC2C1C#C,0.2844
CC1C2OCC12CC#C,0.2789
CC12CC3(O)COC1C23,0.2946
O=CCC12CC1OC=N2,0.2226
C#CC1COCC=C1,0.2601
CC1(CN1)C1(C)CN1,0.3091
OCC12CCCCC1O2,0.3329
C#CC12CN3CC1CC23,0.261
CCC1CC1(O)CC#C,0.2917
OCC1C2OCC12CO,0.2983
CC1=CCCC(O)C1O,0.2566
CCOC1CNC(=O)C1,0.2764
CC1(C)CN2CC(C2)O1,0.2854
CCCC1(C)OC1CO,0.3381
O=CC1(CCCO1)C#N,0.2116
C1COC2(CC2)C=C1,0.2442
CC(O)C1C(C)CC1O,0.3062
CCc1ncn(n1)CC,0.2637
CC1CN=C2OCOC12,0.2718
COc1c(n[nH]n1)O,0.2205
OCC1CCC(=O)C=C1,0.1884
CC1(COC(N)=N1)C#N,0.2676
CC1C2NC2CC1(C)O,0.3131
C1OC2CC3OCC12O3,0.3222
OC1C=CC2C3OC3C12,0.2556
CC1=NC(=N)N=CN=C1,0.1557
N=C1N=NNC(=N1)C#C,0.175
c1c[nH]c(c1CC#N)N,0.2251
CCC1C2C3C2C1C3O,0.3245
[NH3+]CC1=CC=C([O-])O1,0.1739
C#CCC(=O)C(=O)CO,0.1555
CC1NC1(C#C)C(C)=O,0.2215
OCC1(O)CNC1C#N,0.2652
CN1N=CC=C(O)C1=N,0.1613
CC12COC1C(=O)OC2,0.2428
CNc1c[nH]c(=NC)o1,0.22
OCC1C2C=CC1C2=O,0.2427
CCC1=NC=NOC1=N,0.1724
N#CC1COC2CC2O1,0.2569
CCOC12CC1OC2C,0.3068
O=CC1OC2CC1C=C2,0.2115
CC12CC1CC2(C)C#N,0.3034
CC12CC(C1)CC2CO,0.3405
CC1COCC1C1CC1,0.3179
CC(C#N)N1CC(=O)C1,0.2224
CC1C(C)(C)C1(C)CO,0.3244
CCCC1C(O)C1(C)C,0.3029
c1c([nH]c2n1nnn2)N,0.2241
OCC1(CC2OC12)C#C,0.2876
OCC1C(O)C1CO,0.3025
CC(O)C12OC1CC2C,0.3316
CC1OC2CC1C1CC21,0.3251
c1c(nn(n1)CC=O)N,0.1847
CN1C2CC1C2(C)C=O,0.1854
CC(=NO)CCC(=O)N,0.2522
CC12CC=CC(O1)C=C2,0.2342
CCN(C=N)C(=N)C=O,0.1849
OC1C=CN(C=O)C1=O,0.2026
CCC(CC)CNC=O,0.2824
CC12C=CC3(C)C1OC23,0.2245
CC12CC3(COC13)C=C2,0.2295
Cc1coc2c1OCO2,0.2071
OCC12CC3CC1CC23,0.3331
CC12C3C4C3C(O)C1C24,0.2984
N=COCC(=O)CC#N,0.2158
CC1NC1C1=CON=C1,0.2351
N=C1CCC2(CC2)O1,0.2748
CC1C(O)C1(C)OC=O,0.2674
CC1OCC=CC(=N)O1,0.2135
CC1OCOCC2OC12,0.3435
FC(F)(F)C12CC(C1)C2,0.4109
CN(C)C(=O)C#N,0.2211
N=C1CC2CC(=O)C2O1,0.199
CC1=CC2(C)CC2CC1,0.2417
NC1C2OC3C2C13C#N,0.2527
CC(C1CC1C)C(N)=O,0.2717
CCC(O)C1CCC=C1,0.2591
C(C#N)C(=O)CC#N,0.2383
c1[nH]c(=O)c(c(n1)O)N,0.168
CC1CN1CC(O)C#C,0.2586
CC(C)OCC(C)CO,0.3235
O=CNC1=CC2CN2C1,0.1971
CC1(O)CC1(O)C1CN1,0.2918
CCC1C2OC1C2C,0.3218
CC(C)C1C2CC(=O)N12,0.2347
CC1(O)C2OCOC12C,0.3045
OCC(CC=O)C1CO1,0.21
OCC(OC=N)C1CN1,0.2541
CC1OCC1(O)C1CN1,0.291
CC1CC2CC1CC=C2,0.2602
OCC12CC=C3CC1C23,0.1768
CC12CCCC1C2C=O,0.2214
C(CO)C(=O)C=O,0.1565
CCN(C=O)C(C)C#C,0.2692
CC(=O)CCC(=O)C#C,0.1921
CCC1CN1C(=N)C#N,0.2064
c1ccc(c(c1)F)F,0.2326
CC1(CC1)CC2(CC2)O,0.3022
CC1=CC2(CO)CN2C1,0.2332
COC1(CC1C=O)C#N,0.2212
N=C1C=CON=C1C=O,0.1628
CC(=O)CN(C=N)C=O,0.2106
O=C1OC2CNC=NC12,0.2405
CC1=CC23CC2(CO3)C1,0.2293
c1c(nncn1)C2CC2,0.1653
CC#CCc1ccco1,0.2357
CC1C2COC1C(C)=C2,0.2502
C1OC2C1C1OC2C=C1,0.249
O=C1C=CC2CC1O2,0.171
C1CC23C1C1C2CCC31,0.3153
Cc1c([nH]cn1)OC,0.2457
CCC1(CO1)C(C)C#N,0.3102
CC1=NC2(CC2)C(=N)N1,0.216
O=C1CC2CC2C1C#N,0.2233
CN(C)C(=O)CCOC,0.2688
CCC1C(C)N1C(N)=O,0.2815
CC(C)CN1CC1,0.3185
c1cnoc1C(=O)N,0.2142
CC12C3NC1CC23C#N,0.2586
OC(C=O)C1=CNN=C1,0.2059
CCOC1(C)CCOC1,0.3276
c1c(c(=O)cn[nH]1)N,0.1697
CC(C)N=c1[nH]cco1,0.2181
CC1CN1C1COC1,0.3079
C1CC11C=CC2NC12,0.2376
CC1(CO1)C1CN=CO1,0.2702
CCC1(C)C2CC(C)C12,0.3302
CC1C2N=C(N)C(=O)C12,0.1722
CC1=CC=CNC(=O)N1,0.1673
C1C2CC1C21CCCC1,0.3636
O=CC1C2CN2C1C#N,0.2131
FC(F)(F)C1CCCO1,0.3433
COC(C)C1=NON=C1,0.2317
ON=C1CC2(OC12)C=O,0.2074
C1CC(=O)C(=NO)C=C1,0.175
C1C2CCCCCC12,0.3419
C#CC(C#N)(C#N)C#N,0.2929
CC1CC2=NOC(=O)N12,0.2463
c1c(nc(o1)C2CC2)O,0.2154
CC1CC(O)C1C(C)=O,0.2207
CC(C)C(=O)CN1CC1,0.2161
CCC(=O)C(=O)C1CC1,0.1582
CC1N=C(N)C2OC12,0.2451
C1OCC#CC=CC=C1,0.1717
CN1C=CC2(CO2)C1=O,0.1884
CC1C(CC#N)C1C=O,0.2247
CC1OC2CC=CC2O1,0.2655
Cn1c(cc(n1)CO)N,0.24
COC12C3CCC1OC23,0.3014
OC1C2CC3C2C=CC13,0.2409
CCCC1(C)CC1(C)C,0.3285
OC12CC1C1CC2(O)C1,0.2974
CC1CC2(C)C(C#C)C12,0.2874
C[NH+]=CNCCC([O-])=O,0.2392
c1coc(cc1=NO)N,0.1717
CC1CC2CN=COC12,0.2763
NC(=O)C(C#C)C1CO1,0.2647
CNC1(CC(=O)C1)C#N,0.2083
COC1=NC(CO)CN1,0.2714
CC#CC(=O)C#N,0.1917
NC12CN(CC1)C2C#N,0.2555
COC(C)C(C)=O,0.2293
C#CCCCC(=O)C#C,0.2035
c1c[nH]c2c1[nH]nn2,0.2079
CC1C(=O)C2NC12C#C,0.2065
CCOC1OCC2NC12,0.3144
C1CC=CCCC=CC1,0.2539
Cc1c(oc(n1)O)OC,0.2395
Cc1coc2c1CC=C2,0.1782
CNC(=O)C1(COC1)O,0.2719
c1c(c(=O)c(no1)F)F,0.1892
C1COCOCC1=O,0.2135
OC1C2CC11COCC21,0.3183
CC1COCOC(N)=N1,0.2658
C#CC1CC2(CO2)CO1,0.2946
c1n[nH]c(=O)n1CCO,0.2396
CC12CNC(CO1)C2=O,0.1929
N=C1OCC2NC12C#N,0.2538
c1c[nH]c(c1O)OC=O,0.1946
O=C1C=CC2COC1C2,0.1769
N#CC1(NC2CC12)C#N,0.2331
CC1(O)C2NCC12C#N,0.2524
CC1C(=O)C2N3CC12C3,0.1887
[NH3+]C1C2CC1C2C([O-])=O,0.1262
CC#CC#N,0.2494
Cc1c(c(on1)OC)N,0.2193
CCCOC(CC)CO,0.3231
N=C1C=CCCN1C=O,0.192
C1CNC(=NC1)C(=O)N,0.2032
C[NH+]1C2CC1C2C([O-])=O,0.1952
CC1C2CC1(C)OC2,0.3189
COC1C(C)C(=O)C1C,0.2184
CC(C)(O)C12CC1CC2,0.3148
COC1(CC1)C1CCO1,0.3082
C1N2C3C4OC3C2C1=C4,0.1751
CC1=CCOC(C1)C#N,0.2588
Cc1c(c([nH]n1)O)O,0.2466
CC(=O)C12CC1OC2=O,0.2254
CC1(C)C2CC=CCC12,0.2692
c1c(c(nc(=O)o1)F)N,0.162
OC1(CCC1=O)C=O,0.1872
CC1CC2CC3C(O1)C23,0.3219
CC1OCC=CC(C)=C1,0.1928
CC1(C)NC1(C=O)C#N,0.2197
CN1C2CCC1C2=NO,0.2429
CC1C(CC2CO2)N1C,0.2949
CC1CC11CCOCO1,0.3366
OC1CC2(CO2)C2CC12,0.3235
CCCN=CN(C)C=O,0.2362
COC(=O)N1C2CC1C2,0.2806
COC1CCC2CC2O1,0.3171
c1c[nH]cc1COC=O,0.2284
OC12CCN=C1NC=C2,0.2051
C(c1c(nc(o1)N)N)O,0.2099
C1COc2c1onc2N,0.2144
C#CC(CC#N)C#C,0.2871
CN=C1CC2C(C#C)N12,0.2393
CC(C)(C)NC(=O)OC,0.3107
CC(O)(C#N)C(N)=N,0.2567
Cc1cc[nH]c1OC,0.2439
CC1CC11COC(=O)C1,0.2762
OC12CC(C=C1)C=CC2,0.2368
CCC1=CC2OCC1O2,0.2416
CC1(CN1)C(N)=O,0.2655
C(COC(=O)C#N)C#N,0.2478
CC1CC1N1C=CN=C1,0.2504
CC(=O)CCOC1CC1,0.2334
NC(CC1COC1)C#N,0.2692
CC12OCOC11CC2C1,0.3238
CC1COC2=C1ON=C2,0.2039
CC1C(C)C1N(C)C=O,0.2621
CC1=CC(O)COC1=O,0.2213
CC12CN1C1(CC1O)C2,0.3035
CC1NCCC(O)C1=O,0.2073
CCC1(OC)C2CC1C2,0.3355
CC1CC2(C1)CCC=C2,0.257
CNC(=N)c1ccno1,0.1835
CC(C#C)C12CC(C1)O2,0.2878
CC12COC1CNC2=O,0.269
OC12CC1CC1CC21,0.3158
CC1(CC1)C1CN1C=O,0.2556
CCCOC1=NCCN1,0.2766
N=C1CC2(O1)C1CC2N1,0.2702
CCC(OC)C(C)(C)O,0.3176
CC(=N)OC(=O)CC#N,0.242
C1CNC(=O)C=C1N,0.2099
N=C1CCN=COCO1,0.253
CC1C(CC11CO1)C#C,0.3018
CC12OC3C1NC23,0.2982
COC1(C)CC(O)C=C1,0.2506
CC1[NH2+]CC1C([O-])=O,0.2728
CC12CC3OCC1C23,0.3291
C1N=COC2OC=NC12,0.2604
O=C1CC2(CC2C#N)C1,0.2202
O=CC1(OCC1=O)C#C,0.1863
CNC1=NCCC1=O,0.1758
Cc1cn(nn1)C2CC2,0.2454
CC1(COCOC1)OC,0.3258
C1OC1C1CC11CCO1,0.2976
OC1C2CCOC12,0.3133
OC12CC1CC2C1CC1,0.3036
O=CCC1CNC1C#N,0.2253
C1C2CC3=C(C=CN3)N12,0.2277
CCC1=CCCC1=NO,0.1986
CC1=C(N)C(=N)N=CN1,0.1821
OC12COCC3CC1C23,0.3009
CC1(C)C2CNC(=O)N12,0.2825
COC12COC1C1OC21,0.2883
CC1(O)C2OC11COC21,0.2632
c1nc([nH]n1)C2CC2,0.2577
CC1CC=C(CO1)C#N,0.2251
Cn1cc(c(=O)nn1)F,0.1777
c1cn(c(c1O)O)C=O,0.1676
CN(C)c1c(nn[nH]1)O,0.2217
C1CC2CCC1O2,0.3273
CN1CCCCCC1=O,0.2658
CN1CCN=C(C1=O)N,0.2008
CC12CN=C3OCC1C23,0.2218
CC(O)C(C)C(C)(C)C,0.3262
CC(C)CC(=O)COC,0.2334
c1coc2c1CC=C2,0.1794
CCC1OC(C)C1(C)O,0.3065
OCC1CCOC=N1,0.2629
OC(C=O)C1=CN=NN1,0.1993
OC1C2C3CC=CC2C13,0.2478
CCC12C3CC(C13)C2O,0.3214
CCC1(C)OCC2OC12,0.3349
CC1CN2N=C(N)C=C12,0.2291
CC(C(C)=O)C1(C)CC1,0.2258
COC(=O)C#C,0.2382
CN1C(CO)C1C=O,0.1947
CCc1cc([nH]c1O)C,0.2278
C#CC12C3C1N1CC3C21,0.2538
C#CC12CCC1CC=C2,0.2585
Cn1nc(nn1)N2CC2,0.2158
[NH3+]C1CC(O)(C1)C([O-])=O,0.2679
COc1nc(=O)nco1,0.2173
O=C1OCCC2CCN12,0.2952
OC1COC2=C1N=CN2,0.234
CC(COCC=O)C#C,0.2285
c1[nH]nc(n1)C(=O)C#N,0.1979
COC(=N)N1N=NN=N1,0.2232
CC12C3CC1(C)CCN23,0.3088
CC1(C)OCC1(C)C#C,0.2886
CN1C2C3OC2C(O)C13,0.2747
C(CO)NCC#CC#N,0.2033
CN1CC2OC(=N)C12C,0.2432
O=C1CCC=CC1C#C,0.2153
CCC1(CC#N)CN1C,0.2743
CC1CC2(O)C1NC2=O,0.2623
CCC12CC1C(C)(C)O2,0.3112
N=C1OC2(CC12)C1CC1,0.272
CC1=CC2(C)CC2OC1,0.2343
CN1C2CC(CO)C12C,0.3014
Cn1c(cc(=O)cn1)F,0.1887
CCNc1cc([nH]c1)N,0.2235
OC1C=CC2NC12C#C,0.2265
O=C1C2CC3(C2)OCC13,0.222
CC#CCOC(=O)N,0.2867
CNC1=NCCCC1=O,0.164
O=C1C2CN2C1C1CO1,0.2167
CC(O)(C#N)C1CCC1,0.312
OC1CC=CCN2CC12,0.2268
CC1CC2C=CCCC12,0.2615
OC12COC1CC1NC21,0.2936
COC(CCO)C1CC1,0.3249
CC1(O)C2CC3CN2C13,0.3195
CCC(=O)C(=O)OC,0.1821
C1N2C3C4N=COC13C24,0.2528
N#CC1CN1CC1CO1,0.271
C#CC1=CCOC1,0.2052
CCC(=O)C#CC1CC1,0.2083
CCOCC1NCC1=O,0.2155
CC1NC2C(CO)OC12,0.2863
CC1=CN=C(F)C(=N)N1,0.1619
CC1=C2C3NC3C2OC1,0.2233
CCCN1C(C)C1C=O,0.1953
c1cnc(c(c1O)O)F,0.2247
Cn1c2c(cc[nH]2)nn1,0.2131
CC1(CC1)c2ccc[nH]2,0.2421
OCCCC1CC2OC12,0.33
O=CN1CC11CC2CC12,0.2528
CC(C)(OC=N)C1CO1,0.2826
CN1CCNCC(=O)C1,0.1986
CN=C(N(C)C=O)OC,0.2476
OC1CCC=CC1=O,0.1804
CC1=CC2NC2C1C#N,0.2426
CN(CC(=O)OC)C=O,0.2454
CC1(O)CC1C1CC1O,0.3185
OC1CC(C1)C(F)(F)F,0.3322
C1C=CC2OC3C1C23,0.2265
N#CC1(CC2CN2)CC1,0.2799
O=C(OCC#C)C1CN1,0.2568
Cn1cnc2c1CC=C2,0.1936
N=C1NCC2OC2C1=O,0.1814
Cc1c(noc1OC)N,0.2425
CC1CC(CC1O)C=O,0.2283
CC(C)C(C)(C#C)C#N,0.296
CC#CC(=O)CCC=O,0.1956
C1CC23CC4(COC24)C13,0.1368
C1C2OC=NC12,0.2608
OC1C2C=CC11CCN21,0.2099
CC1(CN1)C(=O)C#N,0.1824
CC(O)C(O)(C#C)C#C,0.2703
CC(C#C)C(=O)CC#C,0.2155
CC1CCC1([NH3+])C([O-])=O,0.263
CCC(=O)C(=O)NC,0.1799
CCCc1[nH]c(cn1)O,0.2392
COC12CC1(OC2)C=O,0.1945
CCN1CC2OC3C2C13,0.2787
CC1(C)C2CCC12C#N,0.282
CC1CC11C2NC2C1=O,0.2179
C#CCN=C1CCCO1,0.2628
N#CC1OCOCC=C1,0.2608
CN(C)c1c(cn[nH]1)O,0.2312
COC1OC2(CC2)C=C1,0.235
CN1N=NC=C(C)C1=N,0.1667
O=COCC12CCC1O2,0.2741
CC1OCC(=O)C1C#C,0.2134
OC(C#C)C1CCC1O,0.2707
C1CC23COC2CC13,0.3066
CC12NC3C(OC1=O)C23,0.2405
ON=C1CC2CCOC12,0.2421
CCC(C)NC(C)C#N,0.272
OC1CC2CC(C1)C2=O,0.2206
C#CC1(CC1)C#N,0.2733
Cc1cnc([nH]1)OC,0.2446
CCC(=O)C(O)C(C)=O,0.2027
Cc1cnc(n1C)C=O,0.1771
COCC1CCC=C1,0.264
OC1=C(O)C(=N)C=NN1,0.1623
OC1C2CC2C1C#N,0.2972
CC(COC=O)C#C,0.2792
N=C1ON=NC(=O)N=C1,0.1846
C1CN1C(=O)C2COC2,0.2375
N#CC1N2CC2C11CC1,0.2559
CCC1=NCCCO1,0.2732
COC1C2OC2C1(C)O,0.3141
C1C=CC23OC4C2C1C34,0.223
CNC(CO)C(=O)C#N,0.1592
CCC12OC3CC1C23,0.312
CC1CCC(=C1)C(N)=O,0.2184
CCC(NC=O)C(C)C,0.2821
O=CC1=CCC2COC12,0.1856
CC1C(NC1C#N)C#C,0.2558
CCC1(C)OC(=N)C1O,0.2822
CCc1cc[nH]c1OC,0.2431
CC1=CCOCOCC1,0.2494
OC1=NC=C(O)C(=N)O1,0.1774
OC12C3CC1C1CC3C21,0.2971
CN=CNC(=O)C(=O)N,0.1878
CCN=COC(C)C#C,0.2675
CC(C)(C)c1ncon1,0.2679
OC1CC1C1(CN1)C=O,0.219
CC12CN1C1CCOC21,0.3052
CC1OC1C#CCO,0.2656
ON=C1C2C(O)C2C1O,0.2404
O=CNC1(CC1)C1OC1,0.264
CCc1c(onn1)NC,0.2025
CCC1CC(=NO)C1C,0.2496
C1C2OC3OC2C2C3N12,0.3017
CC1C(O)C2C3CC12C3,0.2875
NC(=O)CN1CC1C#N,0.2504
CC12OC3C4CN4C1C23,0.2661
COC12CC3C(CC13)C2,0.3299
OC(C#C)C1CCCO1,0.2747
C1CC2C=CCOC2=N1,0.2383
C#CC12CCC(CC1)O2,0.288
CC1COC(C)(O1)C=O,0.2089
CN1CC1,0.3271
CC(O)C(O)C1CC1O,0.317
CC#Cc1nc([nH]n1)O,0.2191
N#CC1C2C3C2N2C3C12,0.2762
CN=C1N(C(=O)CO1)C,0.2413
CCN1C2CCC12C#N,0.2718
OC12C3COC(C13)C2=O,0.226
CC(CCC=O)C1CC1,0.2285
COCC1C(O)C2CN12,0.2985
Cc1c(cc([nH]1)O)C#N,0.2044
CNC(=O)NC1CCC1,0.3001
CCOC(C)(C)C1CN1,0.3121
Cc1cc(n(c1C)C)N,0.231
N#CC1NC2C3NC2C13,0.2672
OC12C=CN3C=NC1C23,0.1975
CC1C2CC(C)C12C#N,0.2828
C1C2CC3CC2CC13,0.3749
CC1CC=CCCC1=O,0.2241
CCC(C)(C[NH3+])C([O-])=O,0.2754
OC1C2C3C=CCN2C13,0.23
COCC12OC1CC2C,0.3271
CCN(C)CC(=O)C#N,0.1539
CC1NC1C1CC(C)O1,0.3135
COCC(=O)NCC#N,0.2702
Cn1c(=O)nccn1,0.17
c1c(nc(cn1)N)N,0.1813
O=C1OC2CC=CC12,0.247
O=CC12CC1C(=O)CO2,0.2068
CCNc1c(n[nH]n1)O,0.2073
OC1(CCCOC1)C=O,0.2114
O=C1OCC2CCC2O1,0.3101
CN=C1CCCC(C)O1,0.2649
C#CC12OC3C1CCC23,0.2462
CC1C(C)C1N1CC1,0.3141
CC12C3OC1C3N2C=O,0.2521
CC12CC3(C)C1OC23,0.3132
CC1OCC(C#C)C1O,0.2803
O=C1NC(=O)C2CC12,0.2307
CC1CCC2(O)CCC12,0.3249
CCC1C=CCCC1C,0.2635
CC1(C#C)C2CC(=O)C12,0.2213
CN(C=O)C(C=O)C#N,0.2091
CC12CC1CCC2(C)C,0.3305
COC(CCO)C(C)C,0.3214
CC1(COCC1(C)C)C,0.3043
c1c-2ncnc2nco1,0.1803
COC1CC2C3CC2C13,0.3413
CCC1CC(C)C(=N)O1,0.2827
CN(C)c1c(nco1)O,0.2195
CC(C)CC1C(C)C1O,0.3078
OC12C=CC3CC1C23,0.2367
C1CC11C2C3N2CC=C13,0.1615
CCC#CC(NC)C#N,0.2562
OCC1OC(=O)N2CC12,0.2825
COC(=O)C#CC#N,0.2058
O=CC12C3C4C3C1C24,0.2174
C1OC2C3NC2C3O1,0.3197
O=C1CC(CC#N)O1,0.2853
CC12CC3CCC1C3O2,0.32
O=CC1CC1C1CC1,0.2279
CC12CC(O)C3C(O1)C23,0.3118
CC1C(C)C11CCC1,0.3327
CC1CCC2(CC2)C=C1,0.249
CC1OC11C2CC1O2,0.3187
c1c(nn[nH]1)OCC#N,0.2281
CCN1C2C3CC1C23C,0.2883
OC12COC1C2N1CC1,0.2798
[O-]C(=O)CC[NH+]1CCC1,0.277
c1c2c(no1)OCOC2,0.2433
CC1C2NC1C2(O)C#C,0.2671
CCC1(C)N2CC2C1=O,0.2164
CC1CN1C(C)(C)CO,0.2874
CC1=CC(=O)N2CC2C1,0.2026
C(=O)(C(=O)NC(=N)N)N,0.1759
OC1C2CCC(=O)CC12,0.2278
O=CC(=O)C1CC(=O)N1,0.1457
COC(=O)C(=O)C=O,0.1315
CC1=CC(=NO)CC1=O,0.1696
O=CC12CC3CN(C1)C23,0.1831
CN1C(COC1=N)C#C,0.2526
CC1CC(=O)O1,0.2861
CC1CCOC2CC2C1,0.3185
CC(O)C1=C(O)N=NO1,0.201
COC1C2CC1(CO)C2,0.3227
CC12NC=NC3C1OC23,0.2427
COC1(C)CC1(C)CO,0.3139
N=C1OCCOC1C#N,0.2661
CCC12CC1C1(C)OC21,0.2915
CC(=O)COC(C)(C)C,0.2347
C#CC(COC=O)C#C,0.2795
CC1C2C3C1C2N3C=O,0.2518
CC1=CC2(O)C3CC1C23,0.2344
C1C2C1C1CCC2CO1,0.3166
CCCCC#CCC#N,0.288
C1CC2C=CCOC12,0.2595
NC(=O)C12CC1C1CC21,0.2397
CN1N=CC2=C1ON=N2,0.1391
CN(C)C1C2OC2C1=O,0.1715
CCN=COCC(=O)N,0.2566
C1CN2C3C4OC(C34)C12,0.2692
N#CC1OC11C2CC1C2,0.2822
NC1C(O)CC=C1C#N,0.2134
CC1(C)CC11CC(O)C1,0.3176
N=C1OC2C3NC2C13,0.2567
CC1CN=COC(C)O1,0.259
CC(C)C1C2CC3C2N13,0.3145
O=C1C2OC3C2OCC13,0.2074
O=C1CN2CCC1C2,0.2028
O=CN1C2CC2C11CC1,0.2509
CC1=CNC(=[NH2+])[CH-]C1=O,0.2056
CC1C2C3CC2(C#N)C13,0.3191
COc1cc(c[nH]1)CO,0.238
CCC1C(O)CC11CO1,0.3099
COCC#CCCC#C,0.2793
C#CC#CC1NC1C#N,0.2169
CC(O)C(C)OCC=O,0.2284
CCC(C)(C)C(C)C#C,0.3122
CC1C2C1C(=O)CC2=O,0.2097
Cc1c([nH]cn1)C#C,0.2053
OC12CCC1OC(=O)C2,0.2737
C1COC(=O)C(=O)O1,0.211
OC1(CC2OC12)C1CO1,0.3085
CC1CCC1,0.3823
CC1C2CC2(O)C1(C)O,0.2842
CCC1(O)C(O)C1(C)O,0.2879
OCC(=O)C12CC1CC2,0.2321
CC1CC1C1=NON=C1,0.231
CC12OC1CCCC2O,0.3397
O=C1CC2N3CC2(C3)O1,0.2476
OCC1(CN=CO1)C#C,0.2684
C1CCN(C1)C(=O)C=O,0.1749
OC12CC1OC(=O)NC2,0.2998
CCOc1c(nn[nH]1)N,0.2107
CC1CC2OC1C21CC1,0.3225
CC(C)CC1(C)CN1C,0.2957
C#CCc1cn[nH]n1,0.2533
O=CC12CC(C1)C2C#C,0.2121
Cc1nccc(n1)NC,0.21
CCOCC12CCC1O2,0.3301
N=COC12CCC1OC2,0.2658
CCn1cccc1OC,0.2384
O=C1NCC2=CCOC12,0.2231
CC(CCC#C)NC=O,0.2807
NC(=O)C1CN1CCO,0.2413
C1C2C1C1C2OC11CC1,0.2965
CC(=O)C1OCC=C1C,0.2034
c1c2c(on1)CCCN2,0.2066
CCC1(O)C2CC1C2,0.3285
C#CC12C3NC1COC23,0.2501
CC1C2CC(O)CN12,0.2824
CCC1C2CC1C2C#N,0.3294
OC12CC1C=CCCC2,0.2496
C#Cc1c(nc([nH]1)O)N,0.1908
OCCOC1CC1O,0.3134
C#CCCCOC=O,0.2764
CC(C)(CCC#C)CO,0.3175
COC(=O)C1OCC1O,0.2358
CC#Cc1cc(no1)N,0.1964
Cc1nc(nn1C=O)O,0.1964
CC1OC1C(C=O)C#C,0.2226
C#CC1OC=NCC=C1,0.2431
CC(C)C1(CC1)CC#N,0.3203
COCC1CC(O)C1,0.3278
O=CC1NC1CC#C,0.2208
NC1=C(OC(=N)O1)C=O,0.1744
CCC1=CC2OC2C1=O,0.1751
N=COC1(CNC1)C#C,0.2509
O=CC12CN3C(C=C1)C23,0.2061
c1c([nH]c2n1nnn2)O,0.2329
CN1C(CO)C1(C)C#C,0.2659
COC1C2CC(=O)C1O2,0.2107
CCc1cc(c([nH]1)N)O,0.2262
C#CCCc1cnno1,0.2291
N=C1NCCNCC1=O,0.1651
CC1(CCN1)C(=O)C#N,0.1682
O=CC1C2CC1C2C=O,0.2092
OC12CC3CC(OC1)C23,0.305
OC1CC1C1C2COC12,0.306
COC1OCC2CC12O,0.3382
CC1CC2(C)CCCC12,0.3484
OCC12CCC1C2C#C,0.2901
CC1CCC11OC2CC12,0.3099
C1C2C3C4C(CN24)N13,0.2596
CCC1(CC)NC1C#N,0.2846
O=C1C2COC11CNC21,0.2066
CCCCN(C)C(=O)N,0.2902
OC1COC(=O)NC1=N,0.255
Cc1cc(n2c1CC2)C,0.2422
O=CNC1C2CCOC12,0.2671
NC(C#N)C(O)CC#C,0.2794
CC1CCNC(=O)C1C,0.2681
CN1C2(C)C3OC2C13C,0.292
C#CCCOC(=O)C#C,0.2276
C#Cc1ccncc1N,0.1716
CC(=O)CN=C1CCO1,0.2308
CC1C2CC2C1C=O,0.2177
OCC1CN(C=O)C=C1,0.2047
OC1CC=C2COC12,0.2425
OC12CN3C1C3(C2)C=O,0.22
CC12C3OC1C1CC3N21,0.2632
C#CC#Cc1ccon1,0.1893
c1coc(=O)c(n1)F,0.1767
C1C2CCOC3CN2C13,0.2894
OCC(CC#N)C#C,0.2993
OC1CCN(C=O)C1=O,0.2151
CC12COC(=N)C1CO2,0.2787
CCC(=O)CC(C)C#N,0.2352
C#CC12CCC(OC1)O2,0.2783
CCC1=CCCOC1C,0.26
C1NC11CC2NC2C=C1,0.2282
CC1(CCC=C1C#N)C,0.2202
CC1C2OC(=N)C1C2O,0.2762
CCCC(O)C#CC=O,0.2048
C1CN(C1=O)C(=N)N,0.2306
O=C1NC2CC1(C2)C#C,0.2555
CC(=O)NC(C)(C)C,0.2737
C1CC12CCOC=N2,0.2578
CNc1c(cno1)OC,0.2122
CCN1C(C)C1COC,0.289
C(=Nc1c([nH]nn1)N)N,0.1922
COc1[nH]nc(n1)N,0.2472
C1C2C3C4C5C(C2N14)N35,0.2948
C1C2NC22C=CCCC12,0.2378
C(c1c(c([nH]n1)N)O)O,0.2217
c1c(c(oc1N)C=O)N,0.1725
CC1(C)CC=CCC1O,0.2676
OC12CC3C1CCOC23,0.3091
c1c(c(oc(=O)n1)F)N,0.1559
CCn1c(noc1=O)N,0.2578
COC1C2C3C(C)N2C13,0.305
CC1C2CC1C(N2)C#N,0.2733
NC1=C(N)C(=N)N=NN1,0.1484
C1OC23CN4CC12CC34,0.3038
CC(O)C(C#C)C(C)=O,0.2167
N=C1OCCC(=O)C1=O,0.1432
CCNC(C)(C)C#N,0.2747
O=C1C2OC3CC1OC23,0.1962
CCC1=CCC(C1)OC,0.2578
CC1CC2CC2(O1)C=O,0.2181
NC(COC(N)=O)C#N,0.2968
CC(=NO)CCC#N,0.2526
c1c2c(no1)CN=CO2,0.223
OC1CC1(O)C(=O)C#N,0.1852
Cc1[nH]cc(n1)CC#N,0.2476
N=C1OC2CN=COC12,0.2618
C1C2CC(C12)C1CCC1,0.3382
OC1C2OC=NC1C2=O,0.1878
CC1(OCC1C#C)C#N,0.275
CCC(O)CC(C)=O,0.2297
CCC12CN1CC21CC1,0.3054
C1C=CCN1CC(=O)N,0.2297
O=C1CN2CC2C=CN1,0.1942
c1c2c([nH]c(=O)o2)[nH]n1,0.225
CC1C2(CC2)CC11CO1,0.3286
COCC1CC1(N)C#N,0.2737
OC1CCCCCC=C1,0.2543
C1C=CCN1CCC#N,0.2303
CCCC1COC1C#N,0.2782
NC(=O)C1OCC1=NO,0.2207
CCN(CC)C(=O)OC,0.2965
CC(C)OC(C)CC#N,0.2983
CCC1C2C(CN12)OC,0.3018
C#CCC1=CC(=O)CC1,0.1924
CC1=CCOC1(C)C,0.2508
c1cnc-2n[nH]cnc12,0.1515
CC12NC1C(C=C2)=NO,0.1886
O=C1CC2CC(C2)N1,0.2671
C#CC1N2CC1(C2)C#N,0.2581
C1C2CCC3OC=NC123,0.248
OC1CC2C(C#N)N2C1,0.2587
CN1CC2C(O)C12C#N,0.2299
C1CC=CC1,0.2661
COC1C(=N)OC1(C)C,0.2708
CC(CO)CC(C)(C)C,0.3357
C1CC2CCC1C1OC21,0.337
CC1(C)OC1C(N)=O,0.2626
c1(c(oc(n1)N)O)N,0.2166
OC1CC1N1CC1C#N,0.2465
CC1(C)OC1COC=O,0.279
OC1CN=C(C1)N1CC1,0.2524
C#CC12CCC1OCC2,0.2879
CN=C1CC2C(O)C2O1,0.268
CCCCCOC(C)C,0.3331
O=C1CC2OC2C=CN1,0.2174
N#CCC1C2CC1O2,0.2837
c1nc(on1)COC=O,0.2424
CCC(=NO)C#CC#N,0.1812
CC12CC1(CC2)NC=O,0.2615
CC1C=CC(C=O)C1=O,0.2066
CCCC#CC#N,0.2467
CC1C2COCC(O)C12,0.3052
CC12CCC1(N)C(=O)O2,0.2488
C1NC1C1=CN=NO1,0.2212
N=C1OC2CCC12,0.2844
Cc1[nH]c(=O)c(=O)on1,0.201
C1C2C3OCC3N12,0.2828
CC1OCC2NC12C=O,0.2118
CC1CCCC2OCC12,0.307
OC1CCC2=C1C=CO2,0.2342
OCC1OC(=O)C2NC12,0.2472
OC1COC(=N)NC1=O,0.2434
CC12OC1C1(C)COC21,0.2967
CC1=C(N)C(=O)NC1=N,0.1619
Cc1cc(cn1C)OC,0.2301
CN=c1ccnc(o1)N,0.1791
CC1=CC2C3COC1C23,0.2336
CC1=Cc2nccn2C1,0.1788
C#CC(=O)CNCCO,0.1473
OC1C2C(=O)OCC12O,0.2555
CC#CC1NC1(C)C,0.2743
CC(C)CC1(CN1)C#N,0.2942
C1CC11OC2OC1C=C2,0.235
COC1OC=NC11CC1,0.2582
CC1OC(C2CN2)C1C,0.3158
CNc1ccco1,0.2189
Cc1c[nH]c(c1C#C)O,0.2145
CCC1(CO)CN1C,0.3116
CCOC(CO)C#N,0.2985
Cc1ncc(n1C)C=O,0.1836
CCC(CCOC)C#N,0.2926
c1cc(cc(=O)nc1)O,0.1615
CC1C2OC(=O)C1C2=O,0.2178
CC1C2OC3CC3(O)C12,0.2962
C1CC11C2C3C4C1C2N34,0.3077
CCC1COC(=N)CO1,0.2725
CC12C3C4C3C1(C=O)C24,0.2141
C1NC1C12OC1C1CC21,0.2868
O=C1OC2CC1C21CC1,0.2714
C(CC#N)CNC(=O)N,0.2912
O=CC1CC(CO1)C#C,0.2157
C1NC1C1C2C=CCN12,0.2232
CC(C)c1cc(n[nH]1)O,0.2455
CCN=C(NC=O)OC,0.2318
CC12CCOC(=N)C1O2,0.2647
COC(=O)C(=O)C#N,0.175
CC12OC3C(OC13)C2=O,0.1938
CC1CC11C(C)NC1=O,0.2772
CCc1c[nH]nc1N,0.2348
OC1C=CCC1C#C,0.2623
CC(=O)C12CC1CC=C2,0.2217
CCC1CCCC1=NO,0.2512
CC1(CN=CO1)C=O,0.2129
CC1CC2OCC1C2C,0.3125
COCC1CCC1(C)C,0.3275
CCC1C2OC1C2CO,0.3023
CC1(C)C2CC(O)CC12,0.3216
CC12CC3C4CN1C2C34,0.3083
OC1C2N3CC3C12C#N,0.2433
CC12CC3(O)C(CO1)C23,0.3154
CCC1OC(=O)C=C1,0.2242
C1COC(=O)COC1=O,0.2559
OC1CNCC(=O)C=C1,0.1824
C1C2OC3COC=NC123,0.2334
CC1CCOCC=C1,0.261
C1C2N1CC1OCC=C21,0.2259
CC(=O)C1(CO1)C=O,0.204
CCC(C)C1OC2CC12,0.3093
c1c(non1)N2CC2,0.2151
OCC1NC1CC#C,0.3026
C1OC11CC2(CO2)C=C1,0.2366
CCCC(C)CC#N,0.3475
CC1C(C)C1(C#C)C#C,0.2624
CC1C2CC1OC(=O)N2,0.2971
N=C1NC(=N)C(C=O)=C1,0.1558
COC1C2C3CCC1C23,0.3226
N#CC12CC3C(C1)N23,0.2634
CC12C=CCC1OC2=O,0.2433
CC12COC(C)(C1)OC2,0.3198
CN=C1C=CNN=C1,0.1669
N#CC1NC2CC=CC12,0.2503
OC12C3CC1COCC23,0.3045
CC(C)(C)C1OCC1=O,0.2226
OCC1(C#C)C2CC1O2,0.2756
CN(C)CC(=O)CO,0.2043
OC12CC1CCC=C2,0.2449
CC12CC1C=CC2(C)O,0.243
CN=C1OC(C)C1(C)C,0.2816
CC12CCC3OC3C1O2,0.3255
CC1(C=CCNC1=O)C,0.2531
COCC(C)OC,0.3385
NC1=CC(=O)C(=N)NC1,0.1777
CC1CC2(C)C3OC1C23,0.3042
Cc1nc([nH]c(=O)n1)N,0.2152
Cc1c(nc(o1)N)O,0.2211
CC12COCC1C=CC2,0.2623
c1c(noc(=O)n1)N,0.1553
Cn1cc(nc1)N(=O)=O,0.1934
CC1OC(CO)C2CC12,0.3277
CC12C3C1N1CC3C21,0.2973
[O-]C(=O)C12CC3C([NH2+]1)C23,0.2518
Cc1[nH]cc(n1)CC#C,0.246
O=CC1CNC1CC#N,0.2105
OC1CC2NC12C#C,0.2586
CC12CC(CC1O2)=NO,0.253
C(C#CC#N)C#N,0.2453
CC1OC1C(F)(F)F,0.3595
c1c(c(on1)N2CC2)N,0.2016
O=C1C2CCC1C21CN1,0.221
CC(C)(C(=O)OC)O,0.2815
CC1CN(C(C)=O)C1=O,0.2268
CC(O)C(N)(CO)C#N,0.2899
OC12CCC(C1)C=CC2,0.2619
CC(N)=[NH+][C-](C#N)C#N,0.136
CCC1C(=N)OC1(C)C,0.288
CC1C2CC1C1(CC1)C2,0.3505
COC1(CCC1O)C#C,0.281
CC12NC3C(OC1=N)C23,0.2464
CC1(CCC1)NC=O,0.2764
CCC(OC)C(O)CO,0.308
ON=C1CC2CCC12,0.2452
CCCOC1CC1C#C,0.2772
c1cc(=O)oncc1=O,0.1583
CCC1C(O)C1(C)C#C,0.2792
CC12C3N1CC3=CC2O,0.1743
CCC1CC2CC2C1C,0.3332
CC1(O)CC1C1CCO1,0.3214
C1NC11C2NC2C2NC12,0.2838
CCC1OC1CC#C,0.31
CC(=O)N1CC(O)C1=N,0.2313
C[NH2+]CC1(CN1)C([O-])=O,0.2671
CC#CC1OC2CC2O1,0.2718
CCC1=CC(=N)ON=C1,0.1663
C(=N)N(C=O)C(=O)N,0.2294
C#CC(=O)CCOC=O,0.2071
CCC1C(O)C1COC,0.3187
ON=C1C2C3C4C3C1C24,0.2525
C1CC11CC=CC11CO1,0.2487
CC12CN1CCC2C=O,0.2158
CC1C(OC=N)C2CN12,0.2644
CC1CC(=O)OCO1,0.2727
CC12NC1C1(OC21)C=O,0.1867
C1C2OC3CC2OC13,0.3351
Cc1cn(nnc1=O)C,0.1732
CC12C=CC3C(O)C1N23,0.2174
N#CC1OC11CCOC1,0.2595
CC#CCNCCC#N,0.2797
C1C=CCN1C(=O)CO,0.2458
[O-]C(=O)C1=CCC(=[NH2+])N1,0.1774
CC1C2C(C#C)N2C1=O,0.227
CCC1C2CCC=CC12,0.2487
COC=NCC(F)(F)F,0.2722
N#CCC1CC2(CC2)O1,0.2724
CC1C2CC1C(C)CC2,0.3512
CC1OCOCC1=NO,0.2496
CC1CC2OCCOC12,0.3035
CC1(COC1C=O)C#C,0.2131
CCCC1(C)CCC1C,0.3541
OC(C=O)C1=CN=CN1,0.1797
C1CC11C2OC1C1OC21,0.303
COC1C(O)C1(C)O,0.2879
Cn1c(cc(c1O)N)N,0.2171
CC(=O)c1c[nH]cc1O,0.168
CN(C1CC1)C(=O)C#C,0.207
CC1=CCCC=CC1O,0.2444
CC1C2C(C=O)C2C1O,0.2194
N=C1OC2CC2N1C=O,0.2358
CC12OC1C(=O)N1CC21,0.217
C1C(N1)(C=O)C=O,0.2084
CC(O)C(O)C1(C)CN1,0.2811
N#CC1OCC2CC12,0.2967
CCN1CC11CC2OC12,0.3136
c1c(c(c(cn1)F)F)N,0.2076
Cc1cc[nH]c1N(C)C,0.2443
CC1(OCCO1)C(=O)N,0.2562
C#CC(=NO)CC(=O)N,0.1924
O=CCC1OC2CC2O1,0.2268
COC1C2C3CC2C13,0.3389
COC1CCCC=CC1,0.2529
CC1=CC2NC2C(O)C1,0.2376
CC1CC11CCC1CO,0.3308
C1C2C3CC(CO3)N12,0.3205
C#CC12C3C1C1CC3N21,0.2508
CC1CCC2(C)OC12,0.3405
CC1(O)CCOC1CO,0.3044
OC1CC11C=CC2NC12,0.2369
Cc1ccc(c(=O)[nH]1)N,0.1665
CC1(C)C2C3C4C3N1C24,0.2947
CC1OC(=O)C11CC1,0.2789
c1c(cn2c1CC2)C#N,0.223
O=COC=NCC1CO1,0.2454
CC12CCC1N=CO2,0.2638
CC12CC(CC=C1)O2,0.2417
C1C(=C(C(=O)N1)CO)N,0.2104
COCC(=O)CCC#C,0.2312
CC1CC(C1)C1(C)CC1,0.3382
c1ncnc(n1)N,0.2191
COC1=NC(=N)OC=C1,0.1841
OC1CN2C3CC1(O)C23,0.286
C(#N)C(F)(F)F,0.3587
C1CC2C3C4OC2C1C34,0.3195
CC1C2C(C)C(C#C)N12,0.257
c1c2cocc2cnn1,0.1634
CCC1(O)C=CCC1C,0.2641
CCC1N2CC2C1(C)O,0.2913
CN1C2C3C4OCC13C24,0.2901
CC1C=CC(CO)C1O,0.2625
CCCCC(O)C(C)O,0.3184
CCC12NC1CC1NC21,0.2901
Cn1c(=O)nc(cn1)F,0.1801
CC1=CC2(C)NC2C1=O,0.1789
CC1N(C)C1(C)CC#C,0.2712
CC(C)C#CC#CCO,0.2151
CC(=O)OCC1(CC1)C,0.2829
c1c(nc(c(n1)F)O)F,0.1933
COC12CCC1C1NC21,0.2963
CC1OC=NC1C1CN1,0.2534
OC1C2C3C4OC2C1C34,0.3266
CC1C(CC#N)C1(C)C,0.3113
COCC(=O)OCC#N,0.2681
CC(=O)NC(CO)C#C,0.2715
Cc1cocc1C#C,0.216
CC12C3NC1C(C#N)C23,0.2709
CC12CCCC(O)C1O2,0.337
CC(=O)CN(C)C=O,0.212
OC(CC=O)(C=O)C#C,0.2006
CCCC(C)OC1CC1,0.323
O=C1C2OCC11CCC21,0.2076
OC1(CCC(=O)C1)C#N,0.2203
OCC12CC3C(C1)C23,0.3097
N=C1OCC(C#C)C1=O,0.1822
OC1CC2OC(C=O)C12,0.2115
OCC12CCC1CCO2,0.3218
c1cnn(c1)CCCO,0.2613
CC1CC2=NNC(=O)N12,0.2379
CCc1cc(on1)C#C,0.205
CC1C2OC3CC1(C)C23,0.3164
CC1C(=O)CC2CC12O,0.2223
O=C1OCC2OC=NC12,0.2509
CC12CC3C1OCOC23,0.3475
CCC1CC2C(C)C2O1,0.3148
COC1(C)COC1C#C,0.2755
CC1C2C(=O)C(C)C12O,0.2237
CC(OC(C)C#N)C#N,0.2962
OC1C=CC2OC2C=C1,0.2351
c1coc-2cncc2n1,0.1155
CCC(CCC#C)C=O,0.2254
O=C1NCC2CC1CO2,0.2725
CC(O)C#CC1OC1C,0.266
CC1C2NC2C1(O)C#C,0.2618
[O-]C(=O)C12CC(CC1)[NH2+]2,0.2665
O=C1CC2CCN=C2O1,0.2595
CN1C2COC2(C)C1=N,0.2497
CC12OC(C=C1)C2C=O,0.2104
CCNc1c(cno1)N,0.2167
OC1=NC(F)=NC(=N)O1,0.2071
NC12CC1C(=N)OC2=O,0.2358
CCC(CC)(CC)C#C,0.3167
O=C1CC2CC2(C1)C#C,0.2211
OC1COC2=C1C=NN2,0.2477
N=C1OC2(CC=O)CC12,0.2217
CC1C2CC(C=O)C12C,0.2167
CC1=CCC2(CN2)C1O,0.2622
CC1CC2(CCC2)C1=O,0.2132
O=CCC1(CC#C)CO1,0.2231
CC(=N)OC(=O)CC=O,0.2267
CC12CCC1(C)N2,0.2912
CC1CC2CC(O)(C2)C1,0.3276
N=C1OC2C3CC3C12,0.2808
CNC(=O)C1=CCCC1,0.2215
C1N=CN2C=NC3C1C23,0.217
OCC1CC1CC=O,0.2269
c1c(c2c(o1)OCO2)N,0.2106
O=C1C2CC1C(C2)C#C,0.228
O=C(C1CC1)C1CN1,0.2284
CC1=CCNCC(=O)C1,0.2048
C1CC2C1C1OC2C=C1,0.251
CNC(=O)C(=O)C(=N)N,0.1555
COCC(OC=N)C=O,0.2187
OC1CC2(C1)C1CC2O1,0.3011
OC(C#N)C(=O)CC#C,0.22
CC1C2C1N(C=O)C2C,0.2569
CC1OC2(C)C1C2(C)O,0.2979
Cn1cc(c(n1)CO)O,0.2229
COC(C)C(C)(O)C=O,0.2173
CC(O)CC(C)(C)C=O,0.2253
c1c(c(=NO)cn[nH]1)N,0.1538
O=CC1CCCN2CC12,0.2036
CC1CC2C(CO)C12O,0.3162
CCCC1COC=NC1,0.2722
CCC(CC)C(O)CO,0.318
[O-]C(=O)C1CN1C=[NH2+],0.2618
NC(=O)C1NC(=O)C1O,0.2532
O=CC1NC2C3CN3C12,0.2087
OC1CC2NCC(=O)C12,0.1898
Cn1c(ccc1O)CO,0.2236
CC(C)(C)COCC=O,0.2291
[NH3+]CC#C[C-](C#C)C#N,0.1433
CCC1N(CC)CC1=O,0.1983
CCCCC(C)COC,0.3368
FC1=NC(=N)C(F)=CN1,0.1994
CC1COCC(C)(C)C1,0.318
C1CC1C12OC3C1NC23,0.2927
CC12OC1C1NC1C2O,0.3004
Cn1cnc2c1[nH]nn2,0.2181
OCC1=NC=CNC1=N,0.1626
C(C#N)C(=O)COC=O,0.2285
CC(O)C1=NOC(=N)O1,0.2451
CC12CC1C1(CC1)CC2,0.3291
O=CC1OC11C2CC1O2,0.2119
CCCC12CC(=O)C1O2,0.2165
OC(C#C)C1CCO1,0.27
CC(CO)(CO)C#N,0.3005
CC1=CCC=CC(=O)C1,0.179
CCCC1=NC2CC2O1,0.2623
CC1C(O)C1C1(O)CC1,0.2989
CCC12CNC(=O)C1O2,0.2505
CCC(C)C(OC)C=O,0.2124
OC1CC(CC#N)C1,0.3024
CC12CC1C1(C)OC21,0.294
C#CC1CC11CC2NC12,0.2749
C#CC#CCOC=O,0.2218
CCN=C1NC=NC=N1,0.1678
OCC1OCCCC1O,0.3181
OCCCC1CC(=O)O1,0.2832
CC1N=C(N)C(O)C1O,0.2563
CC1COC1(CO)C#N,0.2724
CC1CC(=O)C(C)C1=O,0.1997
OC1C2CC1(CO2)C#C,0.2754
CC(O)C(=O)CC1CO1,0.2315
COCC1(CC1O)OC,0.2872
CC1CCC1C1COC1,0.3148
CNC12CC1OC2=O,0.2365
CCCC(C)C(O)CC,0.3335
CCC12OC1CCC2C,0.3302
CC1C2CC2OC1C#C,0.2712
CC1C(=O)NC1(C)CO,0.2717
O=C1CNC2CC2CO1,0.2569
COC12CC1C(O)C2C,0.3043
CC1CN=CNC(=O)O1,0.2441
CC1(C)CC1CNC=O,0.2798
CC1OC(=O)C2(CC2)O1,0.2612
OCC1OC2C(O)C12,0.2901
CC1=CC2CC1C21CO1,0.239
CC(COC)COC,0.3344
C1C23CCC=CC12CO3,0.2363
CC12CCC3(C)CN1C23,0.3022
O=CC1C2CC1C2C#N,0.2209
NC1(C#N)C2NCC12O,0.2402
CC1(C)C2OC11CCC21,0.2816
OC(C#C)C1=CC=CO1,0.2265
CC1CC(O)C(=O)N1,0.275
CC12CC1C(=O)N2C=N,0.2241
CCCOCC(=NO)C,0.2536
CCCC(O)CC(C)C,0.3308
CC(O)C(C)CCC#C,0.3134
CC(O)C1COC(C)O1,0.3411
CC#Cc1cc([nH]n1)C,0.2199
c1c(nc(cn1)O)C=O,0.1699
C1NC11C=CC2OCC12,0.2399
OC(C=O)C1CC2NC12,0.203
CC1CN2C1C(O)C2=O,0.2176
OC12CN3C1C2C3C#N,0.2589
CC1C2CC3OC1C2O3,0.3339
CN=C1NCC(=O)N1,0.226
CCC1C(C)C(C)C1=O,0.219
CN1C(=O)C2CCC12C,0.2674
CC#CC1CN1CC#C,0.2546
CCN1CC1(C=O)C=O,0.1924
CCOc1c[nH]nn1,0.223
CC1CC23CC4C2N1C34,0.301
OC1C2OC(OC12)C#C,0.2563
CNC1C=CCC1C#N,0.2302
OC(C#CC#N)C1CO1,0.2275
C#CCc1nccnn1,0.1641
CC1C2OC2C1CC#C,0.3061
COC=NC(C)C#C,0.2693
COC(=O)C1CC(O)C1,0.2447
CC#CC1C2C3CC1N23,0.2877
OCCCC(=O)C1CN1,0.2339
CC1C2C3C(O)C2(C)C13,0.321
OCC(C#N)C(=O)C#C,0.1986
CC12COCC1(CO)O2,0.3256
OC1CC2OCOC2C1,0.3046
CCN1CC(C#C)C1=O,0.2688
CC(C)C(=O)CCC#C,0.2277
CC#CC1CCC(C)=C1,0.2566
CC1(CCC1)OCC=O,0.2285
C#Cc1c(onn1)C#C,0.1755
O=CC#CC1(CN1)C#N,0.1991
OC1C=CCC1C=O,0.2319
O=COC12CCC1CC2,0.2734
OCC1(CN1)C1CCO1,0.2983
C#CC1C2OC2C2CN12,0.2714
CCC(C)C1CC1(C)O,0.3222
CC1C2CC2C(=O)C1=O,0.1499
OC(C#N)C1=CCCC1,0.2435
CC1CC1COCCO,0.3409
O=C1OCC1C#CC#C,0.2195
CC12OC1C1(C)OC21C,0.2932
CC1C2CC2(O)C1=NO,0.2311
CN=COCC#C,0.2679
C1CC=CC2(CC2)OC1,0.2451
[O-]N=C(CNC=[NH2+])C#N,0.172
N#CC1NC1C#N,0.2868
C1CC1(CNCC#N)O,0.2699
OCC1C2OC1C=C2,0.235
CC1(C)CC2(OC12)C=O,0.2204
CC1=CC(=O)[CH-]OC1=[NH2+],0.1128
C(=N)Nc1nc(no1)O,0.2167
C1C2OC3CCC(O3)C12,0.3075
CC12C3CCOC1CN23,0.3102
c1c(c(no1)N)CC#N,0.2299
CC1(OC2CC2O1)C#C,0.2838
CC12CC1(C)C(=O)OC2,0.2726
COCC1N=COC1=O,0.2362
C1COC(=O)COC=N1,0.237
CN=C1OC2CN3C2C13,0.2506
CC1C2C3C2(O)CC13O,0.3091
C(C=O)N=C(N)NC=O,0.2165
CC1=CC2OC1C2O,0.2417
NC1=[NH+]C(=N)N=C[N-]1,0.1909
N1C2C3OC3C3NC2C13,0.2807
CC1C2NC2C1(C)C#N,0.2844
COCC1(C)CC2CN12,0.3119
C#CC1OC2C3OC1C23,0.2585
CC12CC([NH2+]1)C2C([O-])=O,0.2648
c1cc2c(nc1)nc[nH]2,0.2039
c1cc2conc2nc1,0.1646
CC1(COC1)CC2CC2,0.3175
CC1NC1C(=N)NC=O,0.227
O=CCN1C2C3OC2C13,0.2128
Cc1cc(cnc1)CO,0.2242
CC1C(C#N)C(=O)N1C,0.2717
OC1COC2C=CCC12,0.2641
O=C1C2CCC3C2N13,0.2366
CC1=NNC(OC=N)=C1,0.2303
CCN1C(=N)CN=C1C,0.2198
CCC(C)(CC)C1CO1,0.3394
CC(C#N)C1(C)OC1C,0.3074
CC1N2C3CC(C23)C1=O,0.2133
COCCc1ccn[nH]1,0.2585
c1[nH]c(c(n1)C(=O)N)N,0.211
CC12OC3CC1C2(C)O3,0.3197
OC1CC2CCC12C#N,0.2909
OC1C2CC(O)C12,0.3131
C#CC12CC(CC=C1)O2,0.2325
C#CCc1cnccn1,0.1947
OC12CC(C1)OC2C#N,0.2794
CC12CCC3(CCC13)O2,0.2931
CC1OC2C(O1)C2(C)O,0.305
CCOCC(C)(C)CO,0.3205
C(CO)C#CC=O,0.2053
C1OC2CCCCC2=C1,0.2429
O=CC1CC2C=CCN12,0.1888
NC(CCNC=O)C#N,0.2518
COCc1ccc([nH]1)N,0.2241
N#CCCN1CC2CC12,0.2634
CCC(C)CCC(C)O,0.335
OC12C3NC1C3C21NC1,0.3091
COC12CCCC1C2O,0.3047
CN(CC1COC1)C=O,0.2713
CC(C)C(=O)OC1CC1,0.2796
CC1C2C3C(C2C=O)N13,0.2265
OC12CC1(C#N)C1OC21,0.2726
CNC(=O)C1C2CN1C2,0.2716
CC1C(O)CCC1CO,0.3268
CCC12C(O)C3C1OC23,0.2989
CC(C#C)C1CC1CO,0.3087
CC(C)CN(C)C(=O)C,0.2667
CC(O)C1COC=NC1,0.2704
CC(O)(C#N)C#CCO,0.265
CC1CC2(C)OC12C#C,0.2588
O=CCN1C2CC1C=C2,0.2029
OC12CCC1C(=O)OC2,0.2698
C1CC1c2[nH]nc(n2)N,0.2293
CCn1cc(cn1)C=O,0.2083
COCCCOC(=O)N,0.3144
CCC1(C)CC(=N)O1,0.2892
N=C(CC=O)OC1CC1,0.2316
CC(=NCC#N)NC=O,0.2158
CC1C2CCCCCC12,0.3332
C(C#N)NCC(=O)C=O,0.1367
c1c(c(ncn1)F)CO,0.2283
c1coc(=O)cnc1=O,0.176
CCCOC(=NCC)C,0.2759
CC12CN1CC=CC2=O,0.1805
Cc1c(nc(=O)on1)F,0.1859
CC1CC2(CO2)C(C)O1,0.321
CN1C2CC1C21CCO1,0.2951
OCC12CC(N1)C2=NO,0.2638
CC1CC2CC2CO1,0.3265
CCn1c(ncn1)C,0.2627
CC12CCC1(C)CC2,0.3308
C(C#CC#N)NC=O,0.2208
CNc1ccc(o1)C=O,0.1628
O=C1OC2C3OC3CC12,0.2813
c1cnc(c(c1N)O)O,0.2128
CC1C(C)C(=NO)C1O,0.248
OC1C=CC(O)C2CC12,0.2671
CNC(=N)C(=O)CC=O,0.1657
C(CO)C#CC#CC=O,0.1781
CCN1C(C#C)C1C#N,0.2468
CNc1cnnn1C=O,0.1759
C1CN(C1)C2COC2,0.2919
O=C1CC2(OC12)C1CO1,0.2149
Cc1cn(nn1)C=O,0.2023
C1CC23COCC12N3,0.3075
OCC1CC11CCC1=O,0.2186
CC(C#C)C1(C)CC1O,0.3109
OC1C2CN(CC12)C=O,0.2604
C1CC2OC=NCCC12,0.2605
CCC(=O)CC(O)C=O,0.2195
CC(C)C(C)(C)C(C)C,0.3613
C1CC(C1)(CO)C2CC2,0.3327
CC12CC1OCCOC2,0.3236
CC12CC1NC(=O)CN2,0.2471
C#CC1C=CC2CCC12,0.2569
CC1C2N1CC(C)C2=O,0.2109
CC1NC11C=CNC1=O,0.2
CC1CN(C)C(C)C1=O,0.1901
c1c(c[nH]c1C2CC2)N,0.2175
C(C1CO1)C1=NNN=N1,0.2417
C1CC12CCOCC2=O,0.2117
NC1CC1(CO)C#N,0.2632
CC1OC11C2C3CC2C13,0.3503
CC12C3C4C3C1C24,0.3049
CC12CC3C1C1C2C31O,0.3065
CCC1=CC2CC2C1O,0.2406
CC1=C(O)C(=N)OC=N1,0.1746
Cc1c[nH]cc1N2CC2,0.2374
OCCC1CC2(CC2)O1,0.3048
O=C1C2C3OC4C(C23)C14,0.2252
CC#CC(=O)C(=NC)N,0.1709
CC1(O)C2NC2C11CO1,0.2955
CC(C)CCNC(=O)N,0.3019
OC1CCC1(O)C1CN1,0.2896
CC12CC1(CO2)C#N,0.2674
CC12CCC(CC1=O)O2,0.2141
C1OC11CCOC2CC12,0.327
CC1(CO)C2OCC12C,0.2942
CC(OCC1CN1)C=O,0.2223
CC1(CO)CC2(O)CC12,0.3194
OC1CC23CC12COC3,0.3021
CCC1C2C3CC(C3)N12,0.3069
OCC1(NC1C#C)C=O,0.2138
OC1C2NC2COC1=O,0.2686
CC12C3C1C1CCC3C21,0.3212
COC(C)C#CCC#C,0.2808
O=CC12C3C4CC(C14)N23,0.2029
COC1=COC(=N)O1,0.2435
OC1CC23CC(O2)C13O,0.2934
OC1C2CN2CC1=O,0.2005
Cc1c(n[nH]n1)C,0.2534
O=CC1OCCC2OC12,0.225
CC12CN1C(=O)NCC2,0.2848
CC(=O)C1C2CCC12O,0.2187
COC(=O)C(=N)N,0.2117
CCC1C2CC1(O)C2,0.3376
CC1=CC(CC#N)OC1,0.2493
CC#CC1(CC1)OC=O,0.2521
COC(=O)CCCC=O,0.229
CC1C2NC2C(C)=C1C,0.2412
CCC(C#C)C(C)=NO,0.2553
OC1C(=O)C=CC11CC1,0.1914
CC1=CCC2CC(C1)O2,0.2611
CC1CCC2OCOC12,0.3157
[O-]C(=O)CC1=CC[NH2+]C1,0.2212
CCC(O)C1=NNC=N1,0.2563
CC12C3CC1N3C2C#N,0.2627
CC1(C)C(O)C1CC#C,0.2997
CC(=O)C1OCC2CC12,0.2257
CCC1NC(=O)OC1C,0.3091
C#CCCCC#CC#C,0.2297
N=C1NC=CC=NC1=O,0.1622
C#Cc1c(non1)C=O,0.1851
CCCCOC(=O)CO,0.2747
CC12OCC(O)C1C2O,0.2729
CC12OC1COC2C=O,0.2201
CC(OC=N)C(C)C#C,0.2814
CC(CCO)(C=O)C#N,0.226
CC1=CC(O)CC1C#N,0.2556
O=C1OCC2(NC12)C#N,0.2424
CC(CO)C1NC1CO,0.3141
C1C=CCC(=O)NC1=O,0.225
NC1=NC2C(O)C2O1,0.2662
CC(C)(C)OC=O,0.2791
C(=O)c1nc(no1)O,0.1821
CC1(CO)C2CN=CN12,0.2378
c1cnn2c1OCC2=O,0.199
CC#CC(=O)CC(=O)N,0.1787
CC1(O)CC1OC=N,0.2704
CC1C(=O)C2CC12C#N,0.2209
CC1(CC1(N)C#N)C#C,0.2545
CCCC(=O)C=O,0.1567
CC1COCC=CC1,0.263
C1OC2C3CNC12CO3,0.2777
CC1C(=O)N2CC12C,0.2333
C1OCC1C12CC(C1)O2,0.3148
Cc1nc(c(o1)N)NC,0.2009
NC1CC(N)C1(N)C#N,0.2661
CC1C2OC(=O)C=CC12,0.2101
C#Cc1nc(=O)cco1,0.1821
C#CC1CC2OC=NC12,0.2589
O=C1NCC2CNC2=C1,0.2111
Cc1c(ocn1)NC,0.2153
Cn1c(ncn1)CC#N,0.2597
COC1CC(C)C2CC12,0.3243
CCC(C)C(=O)C#CC,0.2051
C#CC1CC=C(C1)C#N,0.2204
NC(=O)NC(=O)OC=N,0.2533
CCc1cc(oc1C)N,0.2178
COCC12CC1N1CC21,0.2873
OC1CCCC1OC=N,0.275
N=C1OCC2=CCCC12,0.2488
COC(CO)C=O,0.2134
CC1=CC(OC1)C1CC1,0.2496
NC1=CC(=N)NN=C1,0.1593
CC1C2C3CC1(C)C23,0.3312
COC12COC1C(=O)C2,0.2
CC1CN1C,0.313
O=CC1OC2CC2C=C1,0.1957
C#CC12CC1CCCC2,0.2896
CC(C)C#CCC(=O)C,0.2228
NC1=C(F)C(=N)NN=C1,0.1625
COC1(C)CC2NC12,0.3135
CCC1C2CC(C)CC12,0.3303
CC1C2COCC1N2C,0.2872
C1CNC=CC1=O,0.19
OC(C#N)C1OCCO1,0.2898
COC1C2CC1C2=NO,0.265
N#CC12OCC1C1NC21,0.246
CC1CC2C(C=O)C12O,0.2158
C1=CC23C=CC4C2C1N34,0.1914
COc1c[nH]cc1OC,0.2407
O=C1C2NC3C2COC13,0.2028
CN=COC1CC2NC12,0.2644
CC1=C(C)C(O)C(O)C1,0.2549
CC(O)(CC[NH3+])C([O-])=O,0.2684
CC12CC1C(=O)OC2=N,0.2506
CC1CCN1C(=O)C#N,0.2178
CC1=NC2C3C2C(=N)N13,0.2176
C1C2C3C=CC=CC1N23,0.1845
CC#CC1C(C)OC1=N,0.276
CCC12CC1COC2=O,0.2719
[NH3+]CC1(CC([O-])=O)CO1,0.1988
COC(C)C(=O)C(N)=N,0.1819
CC(=O)N1CC2OC2C1,0.2707
OCC12CCOC1CO2,0.3178
Cc1c(c(c(o1)C)N)N,0.2174
CC1C(O)CC1CO,0.3217
CC12CC1(C)OC(=N)O2,0.2972
OC1CC2CC3CN3C12,0.2808
CCC1CC(C)(O)CO1,0.3026
CC1C2CCOC12C=O,0.2237
CC1=CCC(O)C1(C)O,0.2611
CC(NC(N)=O)C1CN1,0.3026
c1cnoc1CC=O,0.2122
CC(=O)CN(C)CCO,0.2097
OC1C2CC=CC1C=C2,0.234
O=C1CC2(CC2)C11CN1,0.213
COC1CCC1C(C)O,0.3202
CC1CN2N=NC(O)=C12,0.2287
CC1=CCCCC2OC12,0.2361
C#CC12CC1C1OCC21,0.2555
O=C1CC=CC(C1)C#C,0.2226
COC(C)C1C(C)N1C,0.2867
OC1(COC1=O)C#C,0.2452
CCOC(C#N)C(C)=O,0.2318
CC(=O)n1cncc1N,0.1563
c1c(c(n[nH]1)C=O)CO,0.1992
COC1CCC1C(C)C,0.3221
O=CC1=C2NCC2CC1,0.1827
CC#CC(C)OCC#C,0.2693
CC1C2C1C(=O)C1CN21,0.2107
O=CNC1C2OC2C1=O,0.1984
Cn1cccc1OC=O,0.206
N=C1NC(=CC1=O)C#N,0.1384
C1C2C3C2C2OC3OC12,0.328
CC12CN3C(CC1O)C23,0.2886
CC(=O)C1C2C3CN3C12,0.2056
CC1OC(=O)C11CCN1,0.2361
Cn1c2cc[nH]c2nn1,0.2075
O=CC1=CC2CN3C2C13,0.1817
C1C2C3OC=NCC1C23,0.2681
CC1(CO1)C1CC(=O)N1,0.2837
C1CC2CC=CCC1O2,0.2552
N=C1CCN1C=O,0.2301
CC1OCC2(O)C(O)C12,0.297
NC1(CC#N)COC1=O,0.2474
CCC1(C)C(C)CC1O,0.3148
C1C2C3C4C3C1CCC24,0.3342
c1c(nc(nc1F)F)O,0.2437
CC1(CO)C=CCC1O,0.2646
Cc1nc(cn1C)C#N,0.2265
c1cnc(cn1)CC=O,0.1886
CC1CC(C)(CC#C)O1,0.2904
CN1CC2OC2C1C=O,0.1956
Cc1c2c(c[nH]1)[nH]cn2,0.1914
CN1CC11C(O)CC1=O,0.201
CCCC(O)C(C)=NO,0.2548
CN(C(=N)CO)C(=O)N,0.2486
O=CN1CC2(CN2)C=C1,0.2032
CC1(CCC1)C2(CC2)O,0.3035
C#CCC1CC1C1CO1,0.3138
C1CC2C3CC(C3)CC12,0.3439
c1c(ocn1)C(=N)N,0.2015
CC1COC11CC2CC12,0.3121
CC1(COC1)C2(CC2)O,0.2988
CCn1cnc(=O)nn1,0.1663
O=CCC1OCCC1=O,0.2074
CC1(CC1O)C(N)C#N,0.2895
OC1(CC=O)CC2OC12,0.2225
CC1CC2C3OC2C3O1,0.303
C#Cc1[nH]c(cn1)C=O,0.1712
COC1COC1CC#N,0.3009
CC12CC(O1)C2(C)O,0.3013
CC(=N)N1CCOC1=O,0.2586
CC1C(CC11CC1)=NO,0.2475
OC1C(OCC1=O)C#C,0.2046
CCOC(=O)C(C)(C)C,0.2799
CN1C(=N)CN=C1CO,0.2218
CC1OC(=O)OC1C#C,0.2936
CC1C(C)C1(CO)CO,0.3087
OC1C2OC1C21COC1,0.3099
c1c(noc1C#N)C=O,0.1857
O=C1C=CC2CC3C2N13,0.1918
NC1=COC(=N)NC1=N,0.1811
COCC#CC=O,0.2057
N=C1CCCC=CCO1,0.2472
N=C1N=CNC(=N1)C#C,0.1676
O=CC(OC1CC1)C#N,0.2199
CCC1C2CN2C1C#C,0.2622
CCC12NC1C(=O)C2O,0.2009
CC1CC2OC1C2=NO,0.2577
CC1=CC2(CC2O)CC1,0.2359
CC12CC1(C)C(O2)C=O,0.208
C1C(CO1)C=O,0.2215
CCN=CNC(=N)OC,0.2387
N=COCC12CC1CC2,0.2811
CC(O)(C#N)C(F)(F)F,0.3257
CN=C(c1ccon1)N,0.2039
Cn1cc(c(c1N)O)N,0.2219
OC12CN=C3NC1C23O,0.13
OCCC1(CO1)C#N,0.2792
CC12COC3(C)C1OC23,0.3119
CC1CC2C(CO)C2C1,0.3231
C(CO)Nc1nnon1,0.1918
CC(COCCO)C=O,0.2302
CC1=C2COC3C(C1)C23,0.1992
CC1OC2CCCC12C,0.3215
COC(C)C(=O)NC=O,0.2114
C1C2COC3CC2C1O3,0.3289
O=C1CNC11CC1C#N,0.2072
CC1(C)OC2C3CN3C12,0.2861
ON=C1C2CN2CC1O,0.2193
C1CC2(CC(=O)C2)C=C1,0.2154
CCC1=CCC2(C)NC12,0.2439
O=C1COC2COCC12,0.2157
c1(nnc(o1)N)N,0.242
CC(C)Oc1ncco1,0.2452
C1OC2C3NC3C=CC12,0.2377
C#CC12COC1C2C#N,0.257
c1c(cncn1)C#N,0.1986
OC12CN3C(CC13)CC2,0.2818
CC#CCc1ncco1,0.2433
CN=COC(C)CC=O,0.2214
C1C(=O)CC1(C#N)C#N,0.2229
C1CC2COC1CO2,0.3168
CC#CC1C2C(O)CN12,0.2649
Cc1c2n(nn1)CCC2,0.2465
CCOC(C)C1CN1,0.3158
CCCC(C#N)N1CC1,0.2837
CC12CC(O1)C1C(O)C21,0.306
CCCC(=N)OC1CC1,0.2923
OC12CC(C1)CC1NC21,0.3144
COC1C2C3NC3C12C,0.2672
CC1COC(=O)C1O,0.2759
CC#CC#CC1CCO1,0.2128
CN1CC2NC2(C)C1=O,0.257
COC=NCC1CCO1,0.26
CC12CC3NC3(C)C1N2,0.3203
C1COCOC(=O)OC1,0.2962
CCC(=O)N(C)C(C)C,0.2691
C1OC2C3C4COC12C34,0.3088
C#Cc1noc(=O)o1,0.2115
OCCC1CN1CC#C,0.2678
CC12NC1(CC=C2)C=O,0.2051
O=C1NCC2C3CC3N12,0.2788
N#CC12CC1(NC2)C#N,0.2232
O=CC#CC12CC(C1)O2,0.1823
OC1CCC11COC1=N,0.2818
O=CC12CN1C(=O)C=C2,0.1945
OCCC1C(O)C1C#N,0.2863
CCC12C(C)C1CC2=O,0.2279
O=C1OC2COCC1O2,0.2618
CC1CCOC(=N)CO1,0.2781
CC#CC12C3C4C3N1C24,0.2333
CNC(C)(CC#C)C#N,0.272
COc1c[nH]c(c1O)N,0.2401
CN=C1C(C#N)C2CN12,0.2441
CC1CN1C(CO)C#N,0.2776
CC1=Cc2c(cco2)C1,0.1756
CC1C2CC1C(=O)C2C,0.2254
NC1=NCC2NC12C#N,0.2328
CNc1c(cn(n1)C)N,0.2149
O=C1CCC23CC(C2)C13,0.2128
C[NH2+]C1(CC1O)C([O-])=O,0.2572
C1C2OC3C=CCCC123,0.239
CC(CC#CCO)C#C,0.2806
O=C1C2CC1C(=O)CN2,0.185
CC1CN1C1(CC1)C#N,0.263
CC12OC3C4C1C2C34C,0.3132
OC12C3CC1CC23C#N,0.2851
OCC1C=CCC2CN12,0.2439
C#CC1(CO1)C1COC1,0.2652
OCCC1C2OC1C2=O,0.2458
CC12CCC1(O)C(=N)N2,0.2601
CCC(O)C(OC)C#C,0.2793
CCN(C)C(=O)N(C)C,0.2775
CC1(CC1O)NC=O,0.259
NC(=O)C1NC2COC12,0.2525
CCC1(C#N)C2CN1C2,0.2592
CC12OC1CC=C2CO,0.2457
N=C1C=CN(C=O)N=N1,0.1628
NC1C(=O)OCC11CC1,0.2622
N=C1N=CC=NN1C=O,0.1462
CC(=NO)CC(=O)C#C,0.1837
CNC(CCO)C#N,0.2709
CC(C#N)C1CCC1,0.3399
N#CC12CCC1OC2,0.2747
N=C1CNC(CO1)C#C,0.2484
Cc1c(oc(c1O)C)C,0.2177
c1c(nc(o1)C#N)C=O,0.1965
O=CC1CC=CCO1,0.2249
CC12C(O)C1CC2O,0.3111
C1C2CC3C4COC13C24,0.308
NC(CN1CC1)C#N,0.2772
CC1=C(C)C(=O)NC1=N,0.1932
[O-]C(=O)C[NH2+]C1COC1,0.2663
CC(C)C1CN=C(C)O1,0.271
NC1=NCCC1(O)C=O,0.1925
CC1C(C=O)C11CCO1,0.2135
CNC(=O)COC1CC1,0.2706
OC1CC(CC=O)C=C1,0.2233
C#Cc1ncn(n1)C=O,0.1911
Cc1c(nnn1C=O)O,0.1719
O=CC1OC11COC1=O,0.2138
CC(C)n1ncc(n1)N,0.2202
CCCC(O)CC#N,0.315
O=C1CCC(N1)C1CN1,0.2696
COC(C)C(OC)C#C,0.277
CC(=N)N1C=NCC1=N,0.2203
N#CC#CC1CC=CC1,0.2255
COc1cnnoc1=O,0.1835
CN=C1ON=NC=C1F,0.1615
OC1C(=O)N2CC12C=O,0.1923
CC1OC1C1(C)CCO1,0.3217
N=C1OC2=C(OCC2)O1,0.237
NC(=O)C1(CN1)C1CO1,0.2642
C#CC1CC2COC2=N1,0.2588
CC1C2C(CO)N2C1=O,0.2321
OC12CCC1C1NC21,0.2923
CC1C2C3OC3C1N2C,0.2862
O=C1C2C3CC(=O)N1C23,0.2296
CC1N(C)C11CC(=O)C1,0.2048
Cc1ccncc1,0.2312
CCC1CC(C)C=C1,0.2614
Cc1ccc([nH]1)CC#C,0.2329
CC1(CN1CCOC)C,0.3098
OC12C3C1C1(O)C3C21O,0.2567
N#CC1C=CCOC=N1,0.2294
OCC12NC3C1C(=O)C23,0.231
OC1CC(=O)NC2CC12,0.2624
OC12CC1C1(CC1)C=C2,0.2367
CC1OC2CCC2C1C,0.3088
CCC1(CCCC1)C,0.3669
c1coc(n1)C2COC2,0.2388
C1C2C1C1=CN=CN21,0.2309
OC1=NNC=CC1=N,0.1783
N=C1OC23CC(C2)CC13,0.2832
Cn1c(=O)oc(n1)C#C,0.1892
N=C1NC(C#C)C(=O)N1,0.2355
CC12CC1C1CCC21O,0.2922
CCC1C2NC(=O)C12O,0.2338
N#CC1CCC2(CN2)C1,0.2881
CCC1(CC(=O)O1)C#C,0.2794
CC#CC1CCC(=N)O1,0.2829
OC1C2NC2CC2OC12,0.3043
CC1CC11CC=CC1=O,0.1949
CC12OCC(CO1)C2=O,0.2065
CC12CC(OC=N1)C=C2,0.2361
C#CC1(CCOC1)C#N,0.2819
[O-]C(=O)C(=O)CNC=[NH2+],0.0901
Cc1cc(nc(c1)C)C,0.225
OCC12CC1C=CC2O,0.2403
CCc1c(c(n[nH]1)C)O,0.2316
CC#CC1CCCC1O,0.2914
CC(C)OC1CCC1=O,0.201
CC#CCC12CC1OC2,0.2817
N#CC12CC(C1)C=C2,0.2413
N=COC1CC1C=O,0.224
COCC(C#N)C1CC1,0.3063
C1C2C3CCOC1OC23,0.3171
CC1CC(=O)C2(C)OC12,0.2129
CC12CN1CCC(=O)C2,0.2124
O=CCC1CCC(=O)N1,0.1982
ON=C1COC11CC1O,0.2156
C1CC12CC=C(C2)CO,0.2603
CC1(CC1)OC2COC2,0.3156
OC1CC2CC(C1)O2,0.306
CCCOC1CC(O)C1,0.3271
O=COC1CNC1C#C,0.249
CC(O)CC1OC1C#C,0.2767
CC(O)CC1OCC1=O,0.2167
C1C(O1)(CC#N)CC#N,0.3036
OC12C3CC1(C3)NC2=N,0.2304
COC=NC1C(C)C1C,0.2444
N#CC12OCC3C1NC23,0.2712
NC1=CC(=O)C(C1)C#C,0.2041
N=C(N1CC1)C(=O)C=O,0.1502
N=C1CC2=C(O1)N=CN2,0.2092
NC1CC=CCOC1=O,0.2257
N=C1OCC(C=O)C=C1,0.2033
C#CC1(CN2CC2)CO1,0.261
CC1=CC2COC2C1,0.2577
CCN1C2C3C=CC1C23,0.2123
CC(C)C(=O)CCOC,0.2308
C#CC#CC1CCC1,0.2257
OCC1NC(C#N)C1=O,0.2101
[O-]C(=O)C1CNC(=[NH2+])O1,0.2595
CCOC1CC(=O)C1C,0.2213
OC1(CC1)C1CCC=C1,0.259
C#CCC1C2C3OC2C13,0.2824
CC1(CC1O)C1COC1,0.3174
COC1C(=O)CNC1=O,0.1957
C1OC2C3C4C=CC12N34,0.2071
OC12C3CC(C1N3)C2=O,0.2203
CCC1(COC=N1)C#N,0.2683
OC1C2NC2C2CCC12,0.3017
CCN1C2C3OC3(C)C12,0.2902
CC1=CC(COC1)C#N,0.2585
C1C(=O)COC(=O)N1,0.2164
c1c(c([nH]n1)CO)C#N,0.2375
CC1C2OC3C2(C)C13O,0.2803
c1c(c([nH]c1N)N)C#N,0.2034
O=C1OC2(CC#N)CC12,0.2779
CC(C)(COCCO)O,0.3181
C#Cc1c[nH]ncc1=O,0.1728
C1NC11C=C2CN3C2C13,0.1698
COC12CC3C(OC1)C23,0.3138
N=C1NC2CC2NC1=O,0.197
COC12CC1(OC2)C#N,0.2345
CCC1=CC(=O)OCC1,0.2173
ON=C1C2C3C2N2C3C12,0.233
CC(C#N)C1CN2CC12,0.2784
C#CC1=NCCN1C=O,0.1971
CC(=O)C1(COC1)C=O,0.1974
CC1CC2(CC2O)C1,0.3043
CC1=CC23CC(C2)C3C1,0.2441
C#CC#CC#CCC#N,0.1849
Cc1cccc(=O)o1,0.1766
CC12CC1C1OC21C=O,0.1965
CNC1=CC=NC(=N)O1,0.1685
CC(OC(=O)C=O)C#C,0.1793
COC1C2OCC(=O)C12,0.2155
c1nc(nnn1)C#N,0.1556
C#CC#CC12CN(C1)C2,0.2235
CC(=O)CNC(=O)C,0.2131
CC1C2C3C1C(=O)C23C,0.2443
Cc1cc([nH]c1C=O)O,0.175
O=C1C2CC1(CC#N)O2,0.2461
CC1OCC(C#N)C1O,0.2796
CCOCC(O)C#C,0.2881
CC(C)(C)CC1CO1,0.3379
C1OC2C3CC12C1OC31,0.3101
N#CC1=NC2CCC2N1,0.1939
Cc1c(c(n[nH]1)C)CO,0.2498
COC1C2C3COC1C23,0.3096
CC1CC(CO)C1(C)O,0.3138
CCC1CC(=O)C1,0.223
COC(CCC#C)C#C,0.2893
CC#CCC#CC(=O)C,0.2066
N=C1OCC2(CO2)CO1,0.2939
CN1CCN(CC1)C=O,0.255
CCC1C(C)N1CCO,0.2977
COC1COC(=N)CO1,0.2739
CC1=C(N=CN1)C1CN1,0.2302
C1NC1C12NC3C1OC23,0.2874
NC1=C(C[NH3+])OC([O-])=C1,0.1791
CNc1[nH]c(=O)n(n1)C,0.2412
O=C1CC2C3OC3CN12,0.2618
CC(O)C1=CON=C1C,0.2497
CNC(C#C)C(N)C#N,0.2686
CC1C2OC2CC1O,0.3384
CC12OC1C(C)(C)C=C2,0.2472
C1CCC(C1)C(=O)C=O,0.1559
CC12CC3(O)C4C(C14)C23,0.3115
CC12OCC1(O)C2C#C,0.2545
COCC1(N)COC1=O,0.256
COC1(C)OCC2OC12,0.3392
O=C1CC2(N1)C1CC2O1,0.2781
N=CN1C(=N)CCC1=O,0.2237
N=C1N=CON=N1,0.2239
CC1(C)C2CCC=CC12,0.2473
CC1OC2=C(O1)C=CN2,0.2141
CC12NC(C1CO)C2=O,0.2478
CCC1COC1CC=O,0.2237
CC(C)C1C(C)C1C#C,0.2875
CC1=C(C)C2COC2C1,0.2526
C1C2C1C1OC2C2OC12,0.3321
CC12CC1(C#C)N1CC21,0.2532
C1OC2CC3NC3C2=C1,0.2351
OC(C=O)C1COC1=N,0.2302
CC1N(C)C(=O)NC1=O,0.2458
c12c(nc([nH]1)N)non2,0.2046
CC1COCC=CC1O,0.2435
CC1(CCC(=O)C=C1)C,0.1875
CCC1C2CC2C1C#C,0.3006
CC1(CC2OC12)NC=O,0.275
COCC1OC1COC,0.338
c1c(nc2n1CC2)CO,0.2509
CN1C2C1C1(C)COC21,0.2811
CC1(O)C2C3C4C3N2C14,0.2959
C1C2N1CC1=C2C=CO1,0.2224
CC1(CC(=O)N1)C1CO1,0.2834
CCC1C2C3CC3N12,0.2783
O=C(C#N)C1CO1,0.2011
CC1CC=C(C)C2OC12,0.2397
CC(O)C1=NNC(C)=N1,0.2558
C1CCC(C1)OCC=O,0.2288
C1C(CO1)C(=O)C=O,0.1533
OC1(C#C)C2CC(=O)C12,0.2227
NCC(=O)OCC1CN1,0.2507
CC(O)C1=CN=CN1,0.2468
O=CC1NCCCC1=O,0.2016
CC1=NNC(=N)C(F)=C1,0.1647
O=CC12OC1CC1OC21,0.2192
COC1OCC(=C1)C#C,0.2128
NC(=O)C1NC1CCO,0.2633
c1cnc2c(n1)con2,0.1607
CC(=O)C1=CCC(=O)C1,0.1873
COCC1C2NC1C2=O,0.2511
c1[nH]c(=O)n(n1)C2CC2,0.2259
CC1CC(C)C1(O)C#N,0.3007
CC#CC1CC2C(C)N12,0.2613
OCC1(CC2CC12)C#C,0.2903
CN1C(=N)CNC1=O,0.2477
OCC1NCC1(O)C#N,0.2507
Cc1c(c(=O)nn[nH]1)N,0.1673
O=C1CC2C3CC3CN12,0.2616
CC1OC2C3CC3CC12,0.3158
O=CC1C2OC2C1C=O,0.2039
CN1C(=O)C2CC12C=O,0.2023
CCCC#CC(O)C=O,0.2123
C1OC2C=CC3OC2C13,0.223
C1C(=O)C=CC(=O)CO1,0.1522
CC1=NOC(=O)OC1=N,0.2157
Cc1ccnc(c1F)O,0.2112
COc1[nH]cc(n1)CO,0.2516
CCCc1c(c[nH]n1)C,0.2583
COC1C2NC2(C)C1=O,0.198
C#CCNCC(F)(F)F,0.2835
CC1(CNC1=O)C#N,0.2716
CN1N=C(CO)OC1=N,0.2174
OC1C2C3C=CC2(O)C13,0.2246
C#CC#CC1C2CC1C2,0.2231
OC1CN=C2OCCC12,0.2723
CC1(NC2CC12)C#N,0.2563
O=C1NCCC1C#N,0.2629
CC1=NC(F)=CC(=N)N1,0.1784
CC1C2OC2(C#N)C1=O,0.2115
CCOC(CC#C)C=O,0.2139
CCC12CC3C(C1)C23C,0.3137
C1CN1C1CC2OCC12,0.3028
CCCCC(=O)C(=O)C,0.1577
CC1OC(C)C2CC12,0.3374
CC1(OCOC1=O)C#N,0.2649
CC12C3OC(C1O)C23C,0.3031
c1(=O)[nH]nnc(n1)F,0.171
OC1(CNCC=C1)C#N,0.2253
CC(=O)C(C)(O)CC#N,0.219
CN=c1[nH]c(n[nH]1)C=O,0.1328
C1OC1C1=CNC=C1,0.2447
CC1=CC(=N)N=C(O)O1,0.2115
CC1CC2(CN12)C#N,0.259
Cc1coc(n1)OC,0.2447
N#CC1C2C3CC3C12,0.2557
CC1(C)CCCC(=N)O1,0.2769
CC12CN1C(CC2)C#C,0.2811
OC1CC2OC12C1CC1,0.3186
O=C1NCC2C3OC2C13,0.2532
C1OC1C1=NCC2CN12,0.2307
OCCC(CO)C1CN1,0.3033
O=C1CC2(CC3OC23)O1,0.279
CC1CCOC1(C)C=O,0.2132
c1c(cnc(n1)O)O,0.1861
O=C1CNC2C3OC1C23,0.1801
CC1=CCCOC1C#N,0.2589
O=C1C2C3C2C2OC3C12,0.2121
Cc1nc(nn1C)N,0.2265
COC12CC(C1)C2C,0.3447
OCC1C2CN2C1C#C,0.2554
CC1C2COC1C2C=O,0.2127
N=C1OCC2COCC12,0.2806
C(=N)N(C=O)C(=O)C#N,0.1929
CC1NC2CC2CC1=O,0.21
Cc1cncn(c1=O)C,0.1952
C1OC1C1CC2CCC12,0.3334
COC1COC1(C)C,0.3195
CC1CC2(CC12)C1CC1,0.3172
c1ccc(c(=O)cc1)O,0.1533
CC#CCC1(CN1)C#N,0.2798
CC1C2OC(=O)CC12O,0.259
NC12C3CC1(C3)OC2=O,0.1809
CNc1c(oc(=O)o1)O,0.2416
O=C1CC2OC3CC2C13,0.2186
CC1COC(C)C=C1,0.2639
COC12CC(C1)C21CN1,0.324
C1COCC(=C1C=O)N,0.1842
OC(C=O)(C#C)C#N,0.2181
CCC([NH3+])(CC)C([O-])=O,0.2698
c1c(c(c(nn1)F)N)F,0.2067
c1cc2n(c1)C=CCO2,0.1814
CC(O)C(O)(CO)C=O,0.219
C1CC12C(=O)NC=N2,0.2237
CCC(=O)COCC=O,0.2203
C#CC1(CCO1)C#C,0.255
OC1C2C=CC3CC3C12,0.2347
CC1(C)OCC1CCO,0.3155
OC1CN(C1)C(=N)C#N,0.2003
N=C1OC(=O)C=C1C=O,0.1524
C(c1c([nH]c(=O)o1)N)O,0.2243
OC1CC1C(C=O)C#C,0.2034
OC1C2C3OC1C1C3N21,0.3128
CC12CN3C1CC23C=O,0.2035
CC1=CC(=O)NC1=N,0.189
C1C2CC11OC1CCO2,0.3199
CC(=O)C1(COC1)OC,0.2145
CCC1C(CC)C1C#N,0.3103
CN1C(=O)C=C(N)C1=N,0.172
OC12C3C1C1C=CC3C21,0.2441
OC1CCCCC1C#C,0.2986
CCC1C2C=CCC12C,0.2442
CC12CC1C(O)CCO2,0.2899
COCC(C)CC=O,0.2294
OC1CN(C1)C(=N)C=O,0.1652
OC1C(O)C2N=COC12,0.2472
CC12CC1(O)C1(O)CC21,0.303
OC1CC1N1C2CCC12,0.309
CC12CC3CC(O1)C3C2,0.318
CCC(CO)C1CC1,0.3401
C1CN2C3CCOC1C23,0.2975
CC1(CC2(O1)CC2)C,0.3062
OC1CC(O)C2(O)CC12,0.3167
CC(CO)C#CCC#C,0.2876
CC12CC(C1)C(C2)C#N,0.3403
OCC12CC1C(O)CC2,0.3288
Cc1c(c(no1)N)C#N,0.2133
CN1C(C#C)C1(C)C=O,0.2032
OCC(=O)OC(=N)C=O,0.1831
CN=CNC(=N)C#N,0.1878
Cc1conc1CC=O,0.2177
C#CC1=CC2CCC1C2,0.2027
N=C1OC2C3CC2C1O3,0.2629
C#CC1OC2C3OC3C12,0.2688
CC1C2OC2C1CO,0.3219
CC1C2C(O)C1(O)C2O,0.298
OC12CC3COC1C2O3,0.289
CCCC12CC1C(O)C2,0.3212
CCC#CC(C)C=O,0.2168
CC1C=CC2CC1C2=O,0.216
CCn1cc(cc1C)N,0.2194
OCC1OC11CCCC1,0.3249
CCC1C2CC(C2)C1=O,0.2238
O=C1CN2CC2CCN1,0.2587
CC12OC1C1(CC1)C2=O,0.2127
Cc1cc(c[nH]1)N2CC2,0.2272
CC1=CCCCC=C1C,0.212
N=C1OCOCCC=C1,0.2138
CC12NC1C1CC2CO1,0.3011
CC1(O)COC2CC12O,0.2706
OCC1CC1(C#N)C#N,0.2755
CC(O)(CO)C1(C)CO1,0.3278
CC1CNC2=NOC=C12,0.2247
CN1CC1CCOC=O,0.2425
CN=C1OC(O)=NC=N1,0.186
OC12CC3C(OC13)C=C2,0.2351
O1C2C=CC3OC3C12,0.2392
CC1C(N1C)C1(O)CC1,0.3068
CCC12CC(C1)C(=N)O2,0.2864
CC12COC1CN=CO2,0.268
CC12C3NC3C3C1CC23,0.3135
c1c2c(n[nH]1)nno2,0.1841
CCC(=O)n1cncn1,0.2271
CC1C2C=CC1(O)C=C2,0.2177
CC1N2C3CC3C12C#N,0.2353
COCC(O)(CO)C#N,0.2834
CC1COCC(O)C1C,0.3061
CC1=CC2CC1(C)C=C2,0.2138
OCC#CC1CC(=N)O1,0.2703
OC1CC2(O)C(C#C)C12,0.2763
CC#CC(C)CC=O,0.2191
CC(C#N)C1CCC1O,0.316
CC#CCC#CC(C)C,0.286
C(C=O)NC=O,0.2203
C#CC1CC11CCO1,0.2714
CCC1CC(OC)C1=O,0.1989
C#CC1CC11CCC=C1,0.2358
CC1CC2(C)CC(=O)C12,0.2154
COC(=O)C#CCCO,0.235
N#CCC1OCC11CN1,0.2901
C1CCC(C1)C2CCC2,0.3643
CC(=O)C1C(O)CC1=O,0.2004
CC(=O)C1=NCCO1,0.1975
CC(O)CCCNC=O,0.2834
CCC12CC1OCC=C2,0.2461
CC1COC(=O)C=CC1,0.2207
C#Cc1cc(cnc1)F,0.1966
c1cc(c(cc1O)F)N,0.1914
c1cn2c(n1)CNC2=O,0.2227
CC(C)C#CC1COC1,0.2891
COCC(CO)COC,0.3205
CC1CN1CC(C)=NO,0.2439
COC1(C)C2OC(C)C12,0.3056
N=COCC1=NC=CO1,0.2372
CC1CN(CC1O)C=O,0.2641
OC1CN2CC(C=O)C12,0.1782
OC1CC(O)C11CCC1,0.3065
C1NC1C1OCCC=C1,0.2619
CC12CC(O)CC1(C)N2,0.3022
C#CC1OC2CC1C=C2,0.2493
CC1(O)CC2(CC12)C#N,0.2846
COCCc1c[nH]nc1,0.2597
c1nncn1CCC=O,0.2069
CC1C2CC2(O)C1O,0.3018
CCc1cc[nH]c1C#C,0.2004
OC1C2CC(C2)C11CO1,0.3192
O=CC1C2CC(C2)C1=O,0.2096
CCCCC(C)O,0.3349
CC(CC#C)CC(N)=O,0.2767
CCOC(=N)NCC#N,0.265
CN=COC(CO)C#C,0.2586
C#Cc1cc([nH]c1)C=O,0.1728
CC12CC(CCC1=O)O2,0.2092
N=COC1=CN=CN=N1,0.1656
CN1C=CN=C1OC=N,0.2203
Cc1cccn1CC=O,0.1655
O=CC1C2CC(C=O)C12,0.1977
OC12CC1CC=CC2,0.2584
CC(O)C(=O)CN1CC1,0.2245
Cc1c(nn(c1N)C)C,0.2424
NC1=NCC2OCOC12,0.2535
O=CNC1CC2NC12,0.2733
CC1OCC2C1N2C,0.3087
COC(CC#N)C1CC1,0.2968
COC1=CC(=N)NC=N1,0.1697
COC1(C)C2C3CC1N23,0.3144
c1cc(n(c1)C=O)C=O,0.1725
CC1C(CCO)C1C#C,0.2879
C1CN=C2OC3C(O1)C23,0.2266
N=C1OC(=NC=N1)C#C,0.1623
CCC(C)C1(C)CO1,0.3419
CCC12CC(C=O)C1N2,0.2162
C#CC1=CCC(=NO)C1,0.2091
CC1C=C2CC3C2C13C,0.1775
C#CC1OCC1C#N,0.2754
O=C1NCC2CC3C2C13,0.2594
CC(O)C#CC1CCO1,0.2702
COCC(CO)C(C)=O,0.2293
CC12CC1C1(CN1)C2O,0.3194
OCC(CO)COC=N,0.2625
C#CCn1c(=O)ocn1,0.2419
CC1C2CCCC12CO,0.3287
CN1CC(O)C2OCC12,0.2681
CC12CCC1N2CCO,0.3253
CCn1c(ccc1O)N,0.2338
ON=C1CCOC1=N,0.2079
C#CC1COCC2NC12,0.296
O=CN1CC1CC#N,0.2513
CC1C(O)C1C(=O)C#N,0.1774
OC1C2C3C1CCC23O,0.3142
OC(C#N)C1=CN=CO1,0.2357
OCCC12CCCC1O2,0.333
C#Cc1ccncc1F,0.1992
CC(C)CN=C(C)OC,0.275
C#CC(=O)C(C#N)C#N,0.2082
CC1=C(C)C(NC1)C#N,0.2405
CCC1(CC)C2CC1C2,0.3644
CC1(O)C2OC2C2OC12,0.3105
CCNC(CC#C)C#N,0.2605
CN=C1NC=NC1C#C,0.2224
C1OCC11CCC2NC12,0.3112
CCC1CC(CC)O1,0.3273
OC12CN3C1CC23C#C,0.2646
CC12COC(=O)CC1O2,0.2713
CC1(O)COCCC1O,0.3073
NC(=O)C1CC1OC=N,0.268
Cc1c(cnnc1O)O,0.1994
C1N2CC11CC=CC21,0.2207
CCOCCC1OC1C,0.3443
CN1CCC1(C=O)C#C,0.1953
c1conc1C(=N)N,0.1984
C1CC2OCCCC12,0.3222
CC1=CC(COC1)C=O,0.2071
CC1(O)CCC=C1,0.2665
CC#CC(O)C1(C)CO1,0.2916
CC(C)(O)C1CCC1O,0.3039
C1COc2c1c([nH]n2)O,0.251
ON=C1C2CC1C(O)C2,0.2566
CC1(CC(C1)C#C)C=O,0.2224
NC(CO)C1(CO1)C#N,0.2586
CC12CC1OC2C1CN1,0.3113
C1C2NC2C2=NNC=C12,0.2501
CC1CC2(C)CC12O,0.3153
CC12CC(C=C1)C=C2,0.2163
CC#Cc1[nH]c(cn1)O,0.193
CCNC(=O)C(=N)N,0.2209
C1CC11CC2OCCC12,0.3192
OC1C(O)C1CC=O,0.225
C#CC1OC2CC=CC12,0.2566
COC1C=CC(=O)C1O,0.1724
CC12C3C4CC(N13)C24O,0.2707
CC1CCC(CC1)C#N,0.3462
C1C(=O)C2(O1)COC2,0.2112
NC(C#C)C1=NOC=N1,0.2258
OCC12CC(C1)OCO2,0.3302
CC(O)C1C(C)CC1=O,0.2198
CN1CC1(CO)CC#C,0.2723
NC1(CNC11CC1)C#N,0.2545
CC(=O)OCCC=O,0.2274
CC1CC(NC=O)C=C1,0.2507
CCCC(CO)CCO,0.3352
CC(=O)CC#CC(=O)C,0.2072
C(C=O)OCC#N,0.2299
c1cnc(cc1O)N,0.2137
O=CC12CCC1C1CC21,0.2237
COc1c(nco1)O,0.2137
Cc1c(n(c(=O)[nH]1)C)N,0.2261
OCC1CC(O)C(=O)N1,0.259
CCC12OC1CC2C,0.3209
CC#Cc1cc(co1)C,0.1934
C1CC2CC(C1)OCO2,0.3095
N=C1NCCNC(=O)N1,0.2532
CC1C2OCC2C1=O,0.2158
CCC1OC(C#C)C1=O,0.2122
C1CC2(C1)CCOCC2,0.3191
CC(O)C(O)CC=O,0.2304
COC1=NN(C)C(=N)O1,0.237
CN1C2COC2C1C=O,0.199
O=C1C2CC1C(O2)C#N,0.2089
O=CCC1OC1CC#N,0.2251
ON=C1C2C3C1CC23O,0.2487
O=CC(=O)C1CN=CO1,0.1454
CC(C)(C#N)C1COC1,0.2853
O=C1C2CC=CC1C=C2,0.2194
NC(=O)C1NC1CC#C,0.2598
CC1(CO)C2C3OC2C13,0.2936
CN=C1OCC1CC#N,0.2739
CC(O)COCCO,0.3027
COc1cc([nH]c1)OC,0.2416
c1[nH]c2c(n1)C=CCC2,0.1892
CC1C2CCC12C(C)=O,0.225
CCC1(O)C2C3CC1N23,0.3007
C1C2C1C1=CCCCC21,0.2458
CC12C3C1C1(O)C3CC21,0.2876
CCC(=O)C(O)CC=O,0.2122
CC(=O)N1C2C3OC3C12,0.2474
N=C1N(CC11CC1)C=O,0.2296
CC1C2CC3N(C2)C13C,0.3148
C1C=CC(=O)COC=N1,0.1827
C1Oc2c(n[nH]n2)O1,0.2146
c1c(cc(=O)[nH]c1N)N,0.1886
CCC(=NO)C1COC1,0.2469
CCC(O)C(C)(N)C#N,0.2868
CC1=NC2CC(C2)CO1,0.2654
C1CC2C3C4CC3C24O1,0.3232
c1cnc(cc1O)F,0.2385
COCC(O)CC#CC,0.3004
C(COCC#N)O,0.2792
CCC(C)NC(=O)C=O,0.1748
OC1CC1C=O,0.2289
OC1C2CC2C=C1C#N,0.2049
CCC1(CO)CCCO1,0.3182
CC1CC=CCC(O)C1,0.2561
NC(=O)CC(O)CC#C,0.2642
CC1(CN1CCC#C)C,0.2851
CCC1CC2C3CC2C13,0.3769
O=C1CC2C3CCC3C12,0.215
O=C1C2C3C2C2(CC2)N13,0.2404
CC1=CCCN(C1)C=O,0.257
CCC#CC1COC1=O,0.2577
Cc1cc2c([nH]1)OCO2,0.2067
CC1(O)CC=CC1C#C,0.2604
CC(=O)C1CC11CCO1,0.2209
O=CC12CC1(NC2)C=O,0.1704
COC(=N)NC(=O)CO,0.2479
Cc1c(cc(o1)N)O,0.2157
CN(C)C(=N)C(F)(F)F,0.2347
CCCC1NC1(C)C#C,0.2741
CN=C1COC(=N)N1,0.2459
CC12OC1CC2(C)CO,0.3132
CC1(O)C2C3CN2C13,0.3164
CC1OC2C(C)(O)C12O,0.2818
N=C1NC2CC2OC1=N,0.1965
CC1C2CC1(O)C2O,0.3066
CCC1(CCC#C)CO1,0.313
COC=NC1CCC1C,0.2616
CC12CC3(C1)OC(=O)C23,0.2553
OCC1CCNC(=O)O1,0.3077
CN1N=C(O)N=CC1=N,0.1297
ON=C1C2CC1C1OC21,0.2605
c1c(=O)c(non1)F,0.1729
CNc1cc(no1)O,0.2347
CC12CN3C1CC(=O)C23,0.2167
CC1C2CC1N=CO2,0.2608
CCC1=NC(C)CO1,0.2688
CC(C)(CC(=O)N)O,0.2655
CC1CC2NC12CCO,0.2957
CC1(CC1C1CC1)C=O,0.231
CCC1(C)NC1C=O,0.2185
C#Cc1coc(=O)[nH]1,0.1929
CC1=CC(C)(OC1)C#N,0.2522
CCCN1CC1C1CO1,0.313
OC1C=CCC11CCC1,0.261
CCC1C2CC1(N2)C#N,0.2662
CC12OCC1CCC2=O,0.2026
CCC12NC1C1NC21,0.2684
COC1C2CC2C=C1C,0.2385
CCN1CC(C1)(C#C)O,0.2456
CCC1C2C3CC1(O)C23,0.2946
CCC(CC)CC#CC,0.3023
OCC12C3OC1C(O)C23,0.2865
COC1OCCOC1=O,0.263
Cc1nn(c(=NC)o1)C,0.2103
CC12CC(O)(CO)C1O2,0.3044
CNC(CO)C(=O)OC,0.2342
C(=O)C(=O)C#CC(=O)N,0.1477
CC1(CCC=O)CO1,0.2293
COC1(COC1=N)C=O,0.2056
COC1CCN(C)C1=O,0.251
CC12CC3(C)CC1N2C3,0.3082
OCC12CC(O)(C1)CC2,0.3219
O=C1NCC2OC2CO1,0.2992
OC1CCCC(=O)C1=O,0.1682
CC1CN(C1)C(=O)C,0.2677
CNC1C2NC2C1C#N,0.2556
N=C1NCC2OC12C=O,0.1951
OCC1CN2CC1(O)C2,0.2885
COC1CC1CC(C)O,0.3097
CCC12CC1(CO)CO2,0.3005
CCCC(C)C(C)O,0.3294
Cn1nc(nn1)OC,0.229
CC1OC=NC2(C)CC12,0.252
C1Cc2n[nH]c(=O)n2C1,0.2368
CC12NC1C1(OC21)C#N,0.2301
O=CC12NC1C(=O)C=C2,0.1773
N=COCC1=NCCO1,0.2567
CCN=c1[nH]cco1,0.218
C1CC1CC(CO)CO,0.3054
N#CC12OC3C1CNC23,0.2354
[NH3+]CCCCCC([O-])=O,0.0246
CCC1CC(C1)C#CC,0.2937
NC(=O)CCC1CCO1,0.2788
CC1C2C(C)C1C2C=O,0.2205
OCC12CC3N=CN1C23,0.2367
CN1CC2C(O)C(=O)C12,0.1908
CCC1N=COC1OC,0.2757
C1C2COC=NC12,0.2525
O=C1COC2CC2N1,0.2571
CN1C=CC(=N)C(N)=N1,0.172
CC1C2CC3C=CC1C23,0.2465
COc1cc([nH]c1)CO,0.224
CCC1C(CO)OC1=O,0.2775
CC(C)C1C2CC1C=C2,0.2405
OC1CCOC1CC=O,0.2272
CC1C2N1CC=C2C=O,0.1687
NC(=O)C1CC2CN1C2,0.27
CC1OC1(C=O)C1CC1,0.2142
CC12OC=NC3C1CC23,0.2626
COC1CCC(O1)C=O,0.2228
CN1C2CCC2NC1=O,0.291
CC(C)C(=O)C1CCC1,0.2249
N=C1OCC2CCC=C12,0.2128
O=CC1C2COCCN12,0.2038
CC1(O)CC2C(C#C)C12,0.2933
N#CC12CC3NC3C1O2,0.2632
CC1(C)C2COCC12O,0.3105
C(CO)n1c(=O)[nH]nn1,0.2205
CN1CC=CCOC1=O,0.2433
c1c(con1)N2CCC2,0.2012
c1c([nH]cn1)CO,0.2452
OC1(CC1)C1COC1=O,0.2609
CCC(C#C)C#N,0.2989
C1C2COCC1C=C2,0.2487
O=CC12CC3C1CC23,0.2169
Cc1coc(n1)NC=N,0.206
CN(CC([O-])=O)C(C)=[NH2+],0.2366
CNc1nc([nH]n1)CO,0.2252
CC1(CO)OC1C(N)=O,0.2637
C#CC1=C2CC3C2N3C1,0.1391
COCC1(O)CC1O,0.3156
OC(CC#C)C(O)C=O,0.2126
CC12CC1CC(CO)O2,0.3131
CC1OCC2C(O)C12C,0.3095
CC(C)c1cc(c[nH]1)N,0.2254
[NH3+]CC(O)C([O-])=O,0.2659
OC1C2C(O)C1C21CN1,0.3024
OCCC1(O)C2CC1C2,0.3284
CN=CN(C=O)C(=O)N,0.2233
O=CC12NCC1CC2=O,0.1794
NC(CC(O)CO)C#N,0.2716
OC1C2C3CN2C1C3O,0.2867
Cn1c(c(nn1)O)CO,0.219
FC1=COC(=N)NC1=O,0.1993
C1C2OC3=C(N=NO3)C12,0.1626
CCC1CC2(C)CC1O2,0.3285
COC1CC(C1)C(C)O,0.3031
CC12NC1C(CO)C=C2,0.2397
CC1(CC1)OCC1CN1,0.3177
Cc1ccc(cc1N)N,0.2045
N=C1OC=CN=C1,0.164
CC1(O)C2NC2C11CC1,0.2979
C#CC12NC3C1OC23,0.2554
CC12CC1(C)CCC2,0.3312
Cc1c([nH]cc1NC)C,0.2243
CC12C3C4OC1C2(C)C34,0.3146
c1c(c(=O)[nH]c(n1)N)F,0.1893
Cc1nc(co1)NC,0.2111
CC1CC2C3CC12OC3,0.3037
Cc1nc(nn1C)O,0.239
C1COC(=O)C(=C1)C=O,0.1719
COC1C2CC2(O)C1O,0.3078
NC12CNC1COC2=N,0.2602
COCC(CO)NC=O,0.2793
COCC1CN1CCO,0.2994
c1cc([nH]c1)C#CC=O,0.1565
NC(=O)C12CN3CC1C23,0.248
c1c(c(cnc1N)F)F,0.1974
CC1=CN2C3CC3C2=N1,0.2189
CC1CC1C1(C)CC1C,0.33
CCCC(=O)C(C)C,0.2306
CCN1C2C(O)C1C2O,0.2824
NC1COC1=NC1CC1,0.2516
CC(=NO)C1C2CCN12,0.2315
CCC(C=O)(C=O)O,0.1888
COCC1OC2COC12,0.3021
C1CNC(=O)COC1,0.2541
CCC#CC12CC1CO2,0.2445
CC(=O)c1conc1O,0.1954
CC1=CC(F)=NC(=N)N1,0.1706
FC1=COC(=O)NC1=N,0.2102
c1c(c(no1)N)C(=N)N,0.2166
COC1C(C=O)C1(C)C,0.2213
CC1C(C)C2=CC=NN12,0.2657
CN1CC2(C)CC(=O)C12,0.194
CC1C2C3OC1C23C#N,0.2634
O=C1CC2CC2C2CN12,0.2498
CN1C2C(C1=O)C2(C)O,0.2476
O=CC(=O)C12CC(C1)C2,0.1482
OC1C2C=CN(C=O)C12,0.1955
CN1CC1C#C,0.2631
CCC12CC3C(C1)C23,0.3234
CCC#C,0.3157
CC1(C)CC1(O)C1CO1,0.3205
N#CC1OC(C=C1)C#N,0.2597
O=C1CNCC1N1CC1,0.1978
CC(C=O)C1(O)CC1,0.2191
CC1C2CC(=O)N(C)C12,0.2584
CCc1ccnc(n1)F,0.2156
N#CCC1C2C=CCN12,0.2257
CN1Cc2cnoc2C1,0.2094
C1C2OC3OC2COC13,0.3246
CC1N2CC1(O)C21CC1,0.3119
CC1CC2C3C4OC13C24,0.3027
CC1(CC1O)OCC#N,0.2717
c1nc(on1)OCC#N,0.2598
CC1(C=CC2OC12)C#N,0.2416
O=C1NC2CN3CC1C23,0.2421
COCC1C2CCC12,0.3334
CC12COC1(C)C2CO,0.2948
COCC(C)(CO)OC,0.316
Cc1coc(c1C)OC,0.2299
NC(=O)C1C2C3CN1C23,0.2519
COC(=O)C1C2CC1C2,0.2756
CC(CC#C)C1CC1C,0.3108
OC1CC1C#CC1CN1,0.2574
c1c(nno1)CCC=O,0.2116
COC1CC(C)C1,0.3303
CC12OC3CC1(O)C2O3,0.2907
c1c(c(=O)c(co1)F)F,0.1984
O=CC12CC1(NC2)C#N,0.1942
COC1OCC(O)C=C1,0.2464
CC(C)(C#C)OC=O,0.2766
CC1C(C)(O)C1(O)C#C,0.2623
C#CC12CN1C1CCC21,0.2386
CC1=C(CC(=O)C1)C#C,0.2036
CC12OC3(CO)CC1C23,0.2982
CC1=CC2CC1CCC2,0.2502
COC12CN3CC1C23C,0.3018
CC1OC1C1(C)CN1C,0.3106
CC1(CC11CCC1)C#C,0.2852
CC(CC=O)NCC#N,0.2091
c1c(nc(c(n1)O)O)O,0.1752
C1CC1(C#CC#N)O,0.2176
CC12CC(CC1O)C=C2,0.2518
O=CCC12OC3C1NC23,0.2177
CCC(C)C12CCC1O2,0.3266
CC12CN1C1(C)CC21O,0.2823
CCC(=O)C(C)C(C)O,0.2261
CC(O)CC12CC1CO2,0.308
CC1(O)C(O)C11COC1,0.2963
CCC12CC3(CN3)C1N2,0.3123
CC1OC2=NCC3C1C23,0.2241
CC12CC(C1)(O2)C#C,0.2558
c1c(c(on1)N)CC#N,0.2251
Cn1c(cc(c1O)N)O,0.2167
CN1C(C(N)=O)C1(C)C,0.2339
CC1C2C(O)C1(C)C2O,0.3109
[NH3+]CC1=N[N-]C(=N1)C#C,0.2274
OC1CCCN2CC2C1,0.2984
CC1=CC2OCC2(C)C1,0.2518
CCc1ncco1,0.2445
COc1ccoc1N,0.2154
CC1(O)CCC11CN1,0.299
CC12CC(CC1)C21CC1,0.3501
CC1=CCC(O)C(O)C1,0.2615
COC1(C)CC(=O)C=C1,0.1893
OC12CC1C1CCC=C21,0.2363
O=CN1CC11C2CC1C2,0.2523
CC(C)C1C=CC2CC12,0.2462
C#CCC12CCC1O2,0.2994
CC(C)(c1cnc[nH]1)O,0.249
CC12C3C4C3C1OC24,0.3259
CC#CC1CC(C)CO1,0.2823
CCC1(CC#N)CC1O,0.3032
CCC(O)C#CCC#C,0.2869
[NH3+]CCC1=NOC([O-])=C1,0.0623
O=CC12C3CC1=CCN23,0.1673
COC(=O)C1(CNC1)O,0.2294
c1cc(oc1)C2CC2,0.2254
CC1C2C1C1N=COC21,0.266
c1c[nH]c2c1CN=CO2,0.2035
CC#CC1CCC(=O)O1,0.2756
O=C1CC=C2C3CN3C12,0.2172
C1CCCCCCCC1,0.3782
CC12CC3CC1(O)C23O,0.2668
CN1CCn2c1cnn2,0.2241
OCC1CC1(O)CC=O,0.2138
CN1CC2(C=O)C(O)C12,0.1896
COC1CC2CC1C2=O,0.2319
CC1(C)OC2C3OC3C12,0.3009
OC12CC1C1(NC21)C#C,0.2348
c1cn(c(n1)N)C(=O)N,0.1888
COCCN1CC(C1)O,0.3003
O=C(C#C)C(=O)C1CO1,0.1462
CC1=NCC(CO1)C=O,0.2124
c1c(c2n(n1)CC=C2)N,0.1666
OCC1(O)CCC1C#N,0.2978
CN=COC1CCCC1,0.27
C1OC23CN4C5C2C5C134,0.2484
OCC1OCC11CC1,0.3029
CC(C)N1CC1C(C)=O,0.2025
CCCC12CC(C1)C2O,0.3209
CC1OC2(C)CC12C,0.3074
C#CC12CN1CC=C2,0.2291
CC1C(C)C(=O)C1C,0.2205
CC(C=O)C1COC1C,0.2196
OC1(CC1C1CO1)C#C,0.2733
CC1CN2CC2(C)CO1,0.3042
O=C1CC2CC2CC=C1,0.1879
NC(C#C)C(O)C#N,0.2886
C#CCCNC(=N)C=O,0.167
C1CC2C3OC2C2C1C32,0.3185
O=CC1OC2C=CCC12,0.2147
CN(CCC#N)CC#N,0.2639
CC1=C2COC2CC1O,0.2404
CC12C3CC(CC1O)N23,0.2955
CC(C)c1ccc(o1)N,0.2191
NC1C(O)C(=N)OC1=O,0.2316
COC(=N)C#CCCO,0.237
CC1(NCC1=O)C1CC1,0.2138
CN1C=CC=C1C1CN1,0.2329
c1nc(c2n1CC=C2)N,0.1623
C1CC2=CCN=COC12,0.2441
OCC1CC2(CN12)C#C,0.253
CN1CC11COC2CC12,0.3103
OC1C(=O)C2CC12C#N,0.208
COC(C#N)C1CCC1,0.3009
c1cnc(cn1)NC=O,0.1914
CC1C2OC2(C)CC1=O,0.2262
CC1=C(F)ON=CC1=N,0.1773
COC1=NOC=CC1=N,0.1904
CCC#Cc1ccno1,0.2001
c1c(nno1)NC=N,0.196
C1OC1C1C=CC2NC12,0.2431
c1c(n[nH]n1)C#CC=O,0.1861
C1CC23C4C=CC2C4N13,0.2089
CC(C#C)C1NC1C#N,0.2821
CC12CC1CC2C1CC1,0.3293
c1c2c(c(o1)N)[nH]cn2,0.184
CCC1C2COC(=N)C12,0.2771
OCC1OC2C3CN3C12,0.2777
C#CC12CC1C1CC2O1,0.2791
N#CC12CN(C1)C1CC21,0.2618
C1NC1C1=CN=NN=N1,0.1675
COC(=O)C1CCC1O,0.2548
Cc1cccc(=O)[nH]1,0.1768
c1c(c2n(n1)CC2)C#N,0.2437
COC1(C#N)C(C)C1O,0.259
NC1=COC(=N)C(N)=N1,0.1471
COC1C2OCCC12C,0.2984
COCC1C2C3CN1C23,0.305
O=C1CC2OC3CC12C3,0.2172
O=C1NC2CC1C21CC1,0.2557
CC1OC2C(CC12)C=O,0.217
C[NH2+]CC1=NNC=C1[O-],0.2269
CCC1C(O)CC1(C)C,0.3152
O=C1C2C3C4C3N1C24,0.2276
OC12C3NC11C=CC2C31,0.2167
CC1OC2C1C1NC21C,0.291
C1COc2c1n[nH]c2O,0.2253
CC1(C)C=CCC1C#C,0.2639
O=C1C2OC3CC2OC13,0.2107
ON=C1C(O)CC11CO1,0.2283
C#CCC(=O)CC#C,0.23
N#CC12CC3CC1CN23,0.2572
CC(C)CC(=O)OC,0.2857
OC1C2(O)CC1(C2)C#C,0.2853
C1CC11CC2COC2C1,0.323
CC#CC1=NCCCO1,0.2255
CC1(CC1)OCCCO,0.3229
COC1OCCC1C,0.3399
N#CC1OCC2NC12,0.2828
CC1OCC2(O)CC1C2,0.316
C1OC2C3C4OCC12C34,0.3046
c1c(onc1O)C(=O)N,0.2154
CCC1C2CC3N2C13C,0.3121
CCCC#CC1CC1C,0.2787
COC12CC1C(=O)C2C,0.2256
COc1c(nccn1)O,0.1923
OC1C2C3CC2C13C#C,0.282
OC1CN2CC2CC=C1,0.2197
CC1=CC(=N)ON=C1C,0.1668
CCCOC=NC1CC1,0.2514
O=C1OC2C3C=CC1C23,0.2279
OCC1C2CC3C2OC13,0.3096
N=COCCCC=O,0.23
O=CC1CC2NC12,0.2082
OCC12CC=CC1C2O,0.235
CCC12CCC1C2C#C,0.2896
COC1CCC11CN1C,0.2974
CC1OC2C1CC21CO1,0.2969
CC1(O)CC1(C)N1CC1,0.296
OC1CC2(C1)CC(=N)O2,0.2846
CNC(=N)NC(=O)C=O,0.1292
CN(C)C(=O)C(=O)N,0.205
Cn1c(cc(n1)N)N,0.2342
CCc1cc(c[nH]1)OC,0.2323
OC1CC2NC12CC#C,0.2818
OC1CC2OC1C2=O,0.234
c1c(nc(=O)ncn1)N,0.1541
C1CC1CC(=O)N2CC2,0.2503
O=CC1CC11CCCO1,0.2161
C1C2C=CC3=NC=C1N23,0.1515
C#CC1CN=C(O1)C#N,0.2222
CC1CC2CC1C2,0.384
N=C1NC(=CN=C1)C#N,0.1378
CCN=COC(=O)CO,0.2402
N=C1OC=CC(C=O)=N1,0.1365
C1OC11COC11CCC1,0.3119
NC=[NH+][C-](C#N)C#N,0.1353
C#CC12OC3C1C=CC23,0.2148
CC1(COC1)COC=O,0.2599
CC1C(N=CN1C)C#N,0.2377
COc1cn(nn1)C=O,0.1724
CCC1CCC1=O,0.2193
CC1(C)CC2OC12C=O,0.217
CC(=O)N1CCC1C=O,0.2081
COC12C(C)C1CC2C,0.3161
CN=C1OC2(CC12)C=O,0.2143
CC1CC(OC1=O)C=O,0.2208
N=C1NC(=N)N=CO1,0.2041
O=C1N2CC2C=C1C#C,0.1807
CCC#CCCC1CC1,0.3008
NC1=C(F)C(=N)C=NN1,0.1699
c1c(c([nH]n1)C=O)CO,0.1913
CCc1c[nH]cc1CC,0.2472
O=CC(=O)C1CC=CC1,0.1515
CC1C2C3CC3C1C2=O,0.2378
CCC12CN1CC21CN1,0.2861
CN1CC2(C)CC2C1=O,0.2638
OC1CN2C1=NCC2=N,0.2237
c1cc(oc(=O)c1F)O,0.1689
OCC1=CC2C3CN2C13,0.2111
CN1CC(=N)OC2CC12,0.2494
CC1CC2=C(O1)C=CN2,0.2188
OC1=NC=CC(=N)N1,0.1865
CC1C(=NO)C2OC12C,0.2459
CCC1OCC1(O)CO,0.2956
CCC12CN1C(=N)C2O,0.2455
CC12CC1CC1CC21,0.3225
CC(C)OCCC(=O)C,0.2338
COC(C(C)[NH3+])C([O-])=O,0.2564
c1c([nH]c(nc1=O)O)N,0.2211
N=C1CC2C(O1)C2C=O,0.2199
CC1CC=CCC=CC1,0.2301
C1OC11C2COCC1N2,0.3126
COC(CC1CC1)C=O,0.2113
C1C(CC12COC2)C=O,0.2226
C#Cc1cnnnn1,0.1547
CCC1CC2(NC12)C#N,0.2616
COc1cc(=O)[nH]cn1,0.1883
c1c2c(n[nH]1)CCCN2,0.2183
OCC12CC(=O)C1N2,0.2211
C1CC(C1)NC(=N)C#N,0.2053
CN=COC(C#C)C#C,0.2521
CC1C2C3C(C2O)C13C,0.3223
CC1CC(CC#C)C1O,0.2951
Cc1cc(c(o1)C)O,0.216
CC1=NC(=N)N=C(C)N1,0.1994
c1c(coc(=O)n1)CO,0.1782
N#CC1C2CC1N=CO2,0.2572
OC1C=CC23CN(C2)C13,0.2101
CC1C2C3CC2C1(C)O3,0.3246
C#CC1CC2C3CC1C23,0.3045
C(C(=O)NC=O)NC=O,0.2114
CC1CC11C2C3CN2C13,0.307
CCC(O)(C#N)C#CC,0.2736
COC(C1CO1)C1CO1,0.3277
CC12COC1C(O2)C#N,0.2706
CCN(CC)C(=O)NC,0.2871
c1c(nnnn1)F,0.1721
C1C2C3C4CC(CC14)N23,0.3146
CC(C#N)C1OCC1=O,0.2241
CCc1cc(c([nH]1)N)C,0.238
C1OC2C3CC12CC=C3,0.2395
C1NC1C1CCOCO1,0.329
c1c(c(=O)nco1)C=O,0.1706
C1OC1C1OC2CC12,0.311
CC1OC1C(C#C)C#C,0.2939
CCC1C(C)C1CC=O,0.2257
CC1CC2(CO2)C2OC12,0.3302
OC1CCC=C1CC=O,0.2062
C1CCC(C1)(C=O)C#N,0.2281
CC1(CC1C#N)OC=O,0.275
NC(=O)C1CC=CC1,0.2625
CCCN=C(CC)OC,0.2734
CC1(CN1)C1=CN=NN1,0.2483
O=CN1CC2(CN2)C1=O,0.2107
N=C1CCC(=O)N1,0.2516
NC1=NC(=CO1)C1CN1,0.2287
CC#CC1(CO1)C=O,0.2144
C1C(CO1)NC(=N)C=O,0.169
CC1(CCCOC1)C,0.3191
COC1OCC2OC12,0.3342
ON=C1CCCC1O,0.25
CC1(C=O)C2CC1(O)C2,0.2199
c1cc([nH]c1)N(=O)=O,0.1713
c1ccncc1,0.2293
CCOC1COC11CC1,0.3006
C1CC12C(=O)OC=N2,0.2394
CC12CN3C4C3C1(O)C24,0.2876
OC1CC2CCCOC12,0.2911
CC12C3CC1OC23C#C,0.2416
c1[nH]c2c(n1)COCC2,0.2434
CN(C)C(=N)C(=O)C#N,0.136
CNc1c(ocn1)CO,0.1958
c1c(nc[nH]1)OC2CC2,0.2281
CC1(COC(=O)C1)C#N,0.2772
CCC1OC1CC(C)C,0.3402
OC1C2OC11CC=CC21,0.2466
C1OCC23NC4C2NC134,0.2907
CC1CC(C)(CO)O1,0.3205
c1c(ocn1)CCO,0.2426
CCC(O)C12CN1CC2,0.2917
COC1C(C)C1C,0.3139
CC1C2N3C1CC23C#N,0.2687
OC12COC1CC2C#N,0.2785
OCC#CC(O)C1CO1,0.286
c1c(c(c(nn1)N)F)F,0.199
OCC12CC(C1)CCC2,0.3337
CC1CN2C3COC3C12,0.2619
C1CCOC(=O)NC1,0.2865
CCC1OC(C)C2CC12,0.3345
CN1CC2(CC=O)CC12,0.1895
CC12CC1(C)OCCO2,0.3032
CC1=CCN2C(C#N)C12,0.2321
CN1CC11COC1C=O,0.2061
C#CCOCC#C,0.2727
CC1(C)CC2COC12C,0.3141
O=CCOC1CC1C#N,0.229
C#CC12CC1C1NC21,0.2427
C1C(=O)N(C(=N1)N)C=O,0.2121
C1C2OC3CC=C1C23,0.2122
CC1=CNC(=[NH2+])C=C1[O-],0.2056
COCC1(CCC1)C#C,0.3039
O=CC1NC11CC2OC12,0.2218
CC12COC1C1CCN21,0.2643
CC1CC11NCC1C#N,0.2531
CC1CCCC=CC1O,0.2562
CN1C2CC1C21CN1,0.2925
c1c(c(c([nH]1)C=O)N)N,0.1678
NC1=NCC2CN2C1=O,0.1917
CC(C)(C)C1OC1C#N,0.2885
CC(C)(C)C1(CC1)C#C,0.295
N=CN1CC2(CO2)C1=N,0.2155
CC(C#C)C1CC(=O)C1,0.2217
OCCC1C=CC2NC12,0.2434
CN(C)C(=N)C=O,0.1652
CNC1(C#N)C2COC12,0.2668
COC(C)CC(=O)C=O,0.1557
COC(C)C(C)C#CC,0.302
C#CC1CC2(NC12)C#N,0.2558
CC12CC(C=C1)N2C=O,0.2222
O=C(CCC#C)C1CO1,0.2196
NC12C3CC3C1OC2=O,0.2411
CC12CC(C1)CCC2=O,0.228
CC1CCC(C)C1(C)C,0.3562
CC(C)C(CC#C)C#C,0.2971
CCc1cc(c[nH]1)C=O,0.1901
Cc1c(onc1O)C,0.2469
[NH3+]C1CC1(CO)C([O-])=O,0.1543
CC(C)CC#CCOC,0.2833
N=C1C=NN(C=O)C=N1,0.1831
OCC12CCC1N2C=O,0.2496
CC1(C)OC2CC12O,0.2963
CN1CC2OC2CC1=O,0.2703
CC(CO)N1C=CC=C1,0.2483
O=CC1COCC(=O)N1,0.1944
N=C1OCC11CC1C#C,0.2613
CC1(CO)COC1CO,0.3059
N#CCOC12CC1CC2,0.2774
CC12C3C4C(N14)C23C=O,0.2063
c1c2c(ncn1)n[nH]n2,0.1775
OC1CCC1NC=O,0.2781
O=CC12C3CC1CCC23,0.2269
C#CCc1cc([nH]n1)N,0.2414
CC12CC3C(C=C1)N3C2,0.2378
C1NC1C1=CN=CN=C1,0.2094
C1OC2(OCC=C2)C=C1,0.2503
O=C1NC=CC11CN1,0.2007
c1c2n(nn1)C(=O)C=C2,0.1515
c1cc(c(nc1)C=O)F,0.1777
CC1CC1(O)CO,0.3137
C(OCC1CN1)C1CC1,0.3218
O=C1CN2CC2C11CO1,0.192
CCOC(C)(C)C(C)O,0.3183
CC#CC1C2OC(=N)C12,0.2492
N=C1OC=CC=NC1=O,0.1787
CCCC12CC1N=CO2,0.2597
CC1NC1(C)C1(C)CN1,0.3119
O=C1NC2COC2C1=O,0.1605
CC1=CC2OC2C1=O,0.1764
CC1CC2CC2(C)O1,0.3137
CN=C1NC=NNC1=N,0.1884
c1c(n[nH]n1)CCO,0.2579
CC1=CC2C3OC3C2C1,0.2581
NC1CN2C1=NC=C2O,0.2342
NC1=NCCC1(O)C#N,0.2308
CC1C2CC1C(C)(C)C2,0.3655
OC1C(O)C23CC(O2)C13,0.2933
CC12CC(CC1)C2C#C,0.2974
CC(C#C)C(C=O)C#N,0.2161
CC1(O)CC1OC=O,0.2691
CC1(C)C2CC(C=O)C12,0.2203
CC(C)C1OC11COC1,0.3194
COC12CC(C1)(C2)C#C,0.2921
C#CC12CCC1N=CO2,0.2595
CC1(C)C2OC(C)(C)C12,0.3165
[O-]C(=O)CC[NH2+]CC=O,0.2064
CC(OCC#C)C#N,0.2735
CN1CC2(O)C3NC2C13,0.2825
COC1C=CCC11CC1,0.2608
Cc1ncncc(=O)n1,0.159
CC(C=O)C#CC1CO1,0.2145
NC1=C(F)C(=N)C=NO1,0.1624
OC1CC1C(=O)C1CN1,0.2103
N#CC1CN2CCC1C2,0.2719
CCC1C(C=O)C1(C)O,0.222
CC1CC11CCOC1,0.3372
CC(O)C1CCC2CN12,0.3085
CC1CC=C(C)C1C#N,0.2568
OC1CC2NC2(C1)C#C,0.2712
CC(=N)OC(=O)C(N)=O,0.2011
CC(=NO)C1NC1C#N,0.2375
O=C1C2CC1CC2,0.2306
CN1CC1C(N)C#N,0.2629
CC1C2C(O)CC2C1=O,0.2176
Cc1c(c(c[nH]1)NC)N,0.2271
OCC1CC=CC2NC12,0.2431
CC1=CC(=O)CCCC1,0.1906
CC1CC=CC(=O)CO1,0.1823
Cn1nc(nn1)N(=O)=O,0.2066
c1c(onn1)NCCO,0.209
CC12C3C4C5C4N1C5C23,0.2999
C(CC(CO)CO)C=O,0.2284
OCC1CCC(C1)C#C,0.3118
CC1OC2C3CC(O3)C12,0.3227
CC(=O)N(C)CC(=O)N,0.2452
N=C1C=NNC(=O)C=N1,0.1629
NC(=O)C(C=O)C#C,0.2047
c1c(c(cnc1O)O)F,0.1963
CC1(NC1(C)C#N)C#N,0.2749
O=COC12CC1OC2,0.2461
Cn1cc(nc1O)C#N,0.213
c1cc2c(nc1)CC=C2,0.1936
CC1C(C#N)C2CC12O,0.2979
C#CC1OCCC11CC1,0.2909
CC1(CC1OC=O)C#N,0.2715
OC1C2C1C(=O)N2C=N,0.2199
CC1C2CC2CC1CO,0.3374
CC1=CC2CC3C(O2)C13,0.2432
C#CC12OC1C1CC21,0.2409
OC1CC2N(CC2=O)C1,0.1986
CCC1CC11OC2CC12,0.3043
CC1OCC(=O)C1(C)C,0.2154
C1CC23CC(CC=C2)C13,0.2359
c1cc2n(c1)CCCO2,0.2285
CC1OC2CN3CCC123,0.287
CC(O)C1=CN(C)N=N1,0.2483
CC1COC(C)C(=O)O1,0.2606
CN1CCC2(CC12)C#N,0.2563
OCC1CC2OC1C=C2,0.2536
CNC1=NCC(=O)CO1,0.1992
O=C1C2CC(O2)C1=O,0.1417
O=CC1C2CC1(C2)C=O,0.2081
O=CC12CC3CN1C23,0.2212
CC(O)C1OC(C)C=C1,0.2452
CCC12CC1CC21CC1,0.3226
CC1COC(=O)C(=O)C1,0.1786
C1CCN=C(NC1)C=O,0.175
CC1(O)C2OC1C=C2,0.2375
CC(=NO)CCN1CC1,0.2495
CC(O)C1OCCO1,0.3281
CC1COC(C)C1=NO,0.2494
OC1C2OCC12C1CO1,0.292
NC1=NC(CO)CO1,0.2755
c1conc1N2CCC2,0.2179
CC(N)(CC#N)C#N,0.275
CC1C2CC3C2C3C1=O,0.2221
N=C1NN=CC(C=O)=C1,0.1351
CC1COC1C1COC1,0.3088
CC1C2CCC(C=O)C12,0.2273
c1c2c([nH]n1)CCCC2,0.2497
CC(O)CC1CCO1,0.3099
O=CC12CC1CC2C#C,0.2245
CNC(C#N)C1OC1C,0.2745
CC1C2CC1(CO)CO2,0.297
CC(C#C)C#CC1CN1,0.2629
CC1(COC(N)=N1)C=O,0.2053
C(CNC=O)C(=O)C=O,0.1539
NC1=NCC2(OC12)C#C,0.2395
CC1CCC1C1(C)CC1,0.3334
CN(CC#N)C1COC1,0.2538
CC1=NC=NC(=N)C=N1,0.1715
CC1(C#N)C2CC(=N)N12,0.2431
CC1CN2C=C(C)C=C12,0.2468
C1C2C=CCOC=NC12,0.2068
c1c(noc1C#N)CO,0.214
N=C1CCCOC(=O)N1,0.2517
CN=c1c(=O)occ[nH]1,0.1604
O=CN(CC1CO1)C=O,0.2143
[NH3+]CC1=C[N-]N=NC1=O,0.1828
OCC1C2CN=COC12,0.2757
CC12CC1C1COC2C1,0.3276
C1C2C=CC3CCCC123,0.2471
CC12CN3C1C(O2)C3=N,0.2234
COC1CCCCC1O,0.3098
O=CC1OCC=C1,0.2039
OC12C3C1C1=NC3C2O1,0.1366
CCC12CC1OC2CO,0.3013
C(C=O)NCC#CCO,0.219
CC1(CCOC1=NC)C,0.2764
COC12CC(C1)CC2=O,0.2118
CNc1cnc(cn1)N,0.1563
C1CC11C=CC2CC1C2,0.239
NC1(CC2CC2C1)C#N,0.2964
CCOc1nc([nH]n1)C,0.2472
CC(=O)CC(C#C)C#C,0.231
O=CCCC1CN=CO1,0.2278
CC1CC2(CN2)C=C1,0.2447
CC(=O)C(=N)NC(=O)N,0.189
OC1CCC2OC2CC1,0.3155
CC1CC(O)COC=N1,0.2575
CC(=N)OC1CCC1=O,0.2037
CCC(C=O)C(O)C#N,0.2195
CCc1ccc(cn1)N,0.1931
CC(=O)OC1CCCC1,0.2839
COC(=O)CC#CC#N,0.2457
COC1CCC(C)C1,0.3263
OC1C=CCC1(O)C#N,0.2615
CC1COCC2CC12,0.3206
CC1OC1C(O)CO,0.316
O=C1NCC2OC12C#C,0.2361
CC(=O)C(=O)CN(C)C,0.1435
C(C(C#N)(C#N)N)N,0.2472
O=C1OC(C#C)C1C#N,0.2714
CC(CC1OC1C)C#C,0.3156
CC(=O)CC(C)(O)C#C,0.2268
O=CCC1CC11CCO1,0.2086
C1C=CC=CC=C1C#N,0.1647
OCC1(CCOC1)C#N,0.2993
CC1=CCCC1C1CC1,0.259
OC1C2C(=O)CC12C#C,0.2234
N#CC12CNC(CO1)C2,0.262
Cc1cc(=O)c(c[nH]1)F,0.1983
CCC1(O)CC1COC,0.3211
CN1CC2OC(CO)C12,0.2779
C1Cn2c1nc(c2N)O,0.2241
C(#N)c1c(c(no1)N)N,0.1869
OC1COC11CCCC1,0.3026
C(C1CC1)C1CN=CO1,0.2705
CCC(C(C)O)C(N)=O,0.2726
CC1OCC23CC(C2)C13,0.329
CC1C(=O)C2COC12C,0.215
CNc1ccc([nH]1)OC,0.2311
O=CCC1(CCO1)C#C,0.2213
CN(CCO)C=O,0.2698
C1CC1(CN2CC2)O,0.3146
Cc1c([nH]nn1)C2CC2,0.2318
OC1C2OCCC12C#C,0.2754
CC(C)C1=CCCC1O,0.2556
CC1(C)C2C(O)CC12C,0.3149
OC12C3C4C=C1CC2C34,0.1764
Cc1c(nn[nH]1)OC,0.2171
C1C=CC#CC=CCO1,0.1643
O=CC12CC(N1)C1OC21,0.2027
CC1=CC2CN2C1=O,0.2011
CC1CC1(O)COC=O,0.2789
CC(C)C1C(C)C1(C)O,0.3095
C1CC2C=CC3OC23C1,0.2463
COC(C)COC=O,0.2821
CCC1OCCC1C#C,0.2944
OC1C2CC3OC2C13O,0.3014
CC1=CC2C3NC2C13O,0.2241
CC(C#C)C(O)C1CC1,0.3069
COC(=O)C(C)NC=O,0.2489
CC1N2C3CC3C12C,0.2801
O=CC1=CC2C3CC2C13,0.1813
c1c(oc(=O)c(n1)N)O,0.149
OCC(C#N)C#CC#N,0.2354
CC1[NH2+]CC(=O)[C-]1C=O,0.1762
O=C1NC(=O)C2OCC12,0.223
C1OC11CC2N=COC12,0.2635
CC1(CCC1)OC(=O)N,0.3185
CC1CC2(CO2)C(=O)O1,0.2515
CC12CC(=O)CC1(C)O2,0.2263
NC12CC1(OC2=N)C#N,0.2331
CNc1c(nc[nH]1)C#C,0.2078
C1NC1C1OC2CC2O1,0.3224
OC1C2CC1C21COC1,0.3086
COC=NCC1CC1,0.2703
OC1CC(=O)C=CC=C1,0.1639
[NH3+]CC1OC1CC([O-])=O,0.2727
N=C1CC2=C(O1)N=NO2,0.1884
C#CC1CC2N=COC12,0.2609
CNC(=O)C1C2CCN12,0.2475
C1CC2CCOCC2=C1,0.2519
C1OC11CC=CC=CC1,0.1945
OC1CC1CC#CC=O,0.2056
CC(O)C1(COC1)C#N,0.2831
OC1C2CC2C11CC1,0.3217
N=C1CC2(COC2)CO1,0.2797
CC#CC1CN1C(N)=O,0.2688
CC1COC11CCC1=O,0.1959
NC(CO)C#N,0.2834
O=CC1CC1C1CCC1,0.2285
CCC1CC2(CC2)C1=O,0.2142
CC(=O)C(=O)OC=NC,0.1741
C1CC2C=CCC3C1C23,0.2678
OC1C(=O)CC11CO1,0.2066
CC1C(CO)C1(C)C,0.3191
Cn1nc(nn1)C#C,0.2254
CC1C2NC2C2(C)CN12,0.2904
CC1C(C)C1C#N,0.3122
O=COC1OCCC=C1,0.2621
CNC(C=O)C(O)C=O,0.1875
N=C1OCC=CC2CN12,0.2385
Cc1nc(nn1C)NC,0.2196
CCCc1coc(n1)N,0.2366
OCCC(C#N)N1CC1,0.2835
CC12CN=C3C1C1C2N31,0.1557
CNC=Nc1ccno1,0.1834
CCC1CN1C=O,0.2531
CC1=C(NC=C1)OC=N,0.2197
NC(=O)NC12CN(C1)C2,0.285
CC(C)C12CC1OC=N2,0.2601
CCNC(=O)C1CC1,0.2779
CC1(C(=NO)C=CN1)C,0.1765
COC1COC11CC1O,0.2912
CC12CCN1CC21CO1,0.2852
CC1CC2CC3CCC123,0.3345
OC12CC1C1(OC21)C#C,0.2417
CC(C#N)C(=O)CCO,0.2319
c1cnoc1OCC=O,0.1953
COC1=NOC(=N)C=N1,0.1565
OC1C2N=C3OCC3C12,0.24
CCN1CC=CC1C#N,0.224
CC1=CC2(CO2)CC1O,0.2487
C1CC23C4CC(C12)C3O4,0.3049
C#CCC1CC2OC12,0.3065
C(=O)C#N,0.2066
OC1=NC(=N)ON=N1,0.1612
CC(=O)NCC#CCO,0.2678
CC1(CC1(C)C#N)C#C,0.2794
CC1C2C3N2C(=N)C13O,0.272
C1CC2OC3C(CO1)C23,0.3075
COC1CC11CCC1=O,0.2145
CN=C1NC(F)=NC=C1,0.1847
OC1(CC(=O)C=C1)C=O,0.1806
CNC(=NCCO)C=O,0.1534
OC1CC1C12CN1CC2,0.2989
CC12CC3CC(O1)C23,0.3137
Cc1c[nH]c2c1onn2,0.1915
c1nc2c(o1)CN=CO2,0.214
OCCC(O)C1CCO1,0.3246
CCC1(O)CC1C1CC1,0.3164
CN1CC(C2CN2)C1=O,0.2689
CC1=CC(=O)NC1CO,0.2148
COCC12CC(C)(C1)O2,0.3063
COC(C=O)C#CC,0.2038
CC1CC11CCC1C#C,0.2984
CC(C)C(=NO)CCO,0.2538
CC1C2C1C(C=O)C2O,0.2071
CCN1C(C)C1C#CC,0.2558
OC1C2CC2C1O,0.321
O=C1COC1C#CC#C,0.1974
CCCC(COC)OC,0.3285
COC(=O)C1(CCC1)O,0.2601
CCC(CC(C)=O)C=O,0.2169
CC12COC1C(=O)CN2,0.1956
O=CC1N2CCC12C#N,0.206
CC1CC2=CCC3C1C23,0.2228
CC12CC3NC3(C)C1O2,0.3275
COC(=O)C(=O)C(=O)N,0.1689
C1C2CC3=CN=NN3C12,0.254
CC(C)N1C(C)C1C#N,0.2613
N#CC#CC1(CO1)C#N,0.2242
c1coc(n1)NC2CC2,0.2322
CN1C(=N)C=NNC1=O,0.1911
Cc1c(coc1NC)N,0.2171
Cc1cnc(o1)CC#C,0.2357
CC12CC1C(C)(O)CO2,0.2961
OC1(CC1)C1OC1C#C,0.2725
CC1(CN1)C1COC=N1,0.264
CC1(O)C=CCC1C=O,0.2241
CCCC1CCC1C=O,0.2234
OCC1NC1C#CC=O,0.1966
N#CCOC1CCC=C1,0.2569
c1c(cnc(n1)O)C=O,0.193
CC(O)(C1CC1)C(N)=O,0.264
CC12CN1CC21CCO1,0.3027
ON=C1CCCC1C#C,0.246
CCN=C1OCCC1C,0.2697
OC1CC1OC(=O)C#N,0.188
CC12CC1OCC2(C)O,0.2853
CCC1C(=O)C2OC12C,0.2103
OC1CC(C=O)C1C#N,0.2238
O=CC12CC3C(C1)N23,0.2151
CC(C)Nc1c[nH]nn1,0.2063
CC(C)Oc1[nH]ccn1,0.2516
O=C1OC2COCC2O1,0.3217
CCC(C)OCCCO,0.3258
C1CN1Cc2nnon2,0.1856
C1C2CCOC12,0.3186
CC1(C)COC2C(O)C12,0.3036
CCOC=O,0.2868
COC1CC2CC2C1=O,0.2049
C[NH2+]C1C(O)C1C([O-])=O,0.2694
CC1C2(CN2)C2OC12C,0.31
NC1=CC(=CO1)C1CN1,0.2228
CC1[NH2+]C(C=C1)C([O-])=O,0.2326
CC(C#N)N(C=N)C=O,0.2363
O=CN1C2C3CC1CC23,0.2642
O=C1OCC1C1CN1,0.2584
CNC(=O)C#CC=O,0.1915
[NH3+]CC(C#N)C([O-])=O,0.2344
CCCC1OC2C(O)C12,0.3003
Cc1c2n(nc1O)CC2,0.2358
COC1C(C)(C)C1(C)O,0.2919
OC12CCC=C3CC1C23,0.219
COc1[nH]cc(n1)O,0.2396
c1c(nn[nH]1)NCC=O,0.1782
C#CC#CCC1COC1,0.2297
CC1(O)CC2(CO)OC12,0.3265
O=C(C#N)N1CC1C#C,0.2087
N=C1OC(C=O)C1C=O,0.2087
CC1(CO)CCC(=O)O1,0.2781
CC1C=C(C)C2(O)CC12,0.245
CC(C1CO1)C(=O)C#C,0.1979
OCC12OC1C1COC21,0.29
CC1=NC(C(=O)N1)(C)C,0.2329
CC12C=CCC1C2CO,0.2465
O=C[C-]1C2[NH2+]CC12C=O,0.1571
CN1C2C3CC1C23,0.2979
Cc1[nH]nc(n1)C#C,0.2261
CC1C2CC1(C)C=CC2,0.2531
CCC1OCC2(C)OC12,0.3416
C(C#CC1CO1)C1CN1,0.2702
CC1(O)CC=CC=CC1,0.1894
CC(=N)N(C=O)C(=O)N,0.2217
CCOc1c(con1)C,0.2513
C(c1[nH]c(=O)on1)O,0.2546
O=C1CCCC1CC#C,0.2171
CC12OC3C4C1C2C34O,0.2942
CN=C1OC=NC(O)=C1,0.1704
O=C1C2CC1OCO2,0.1974
CCN=C1N=CNC=N1,0.1847
COC1C(O)C1C(C)=O,0.2085
OCC(=O)C1CN2CC12,0.2094
CC1(C2(N1)COC2)C,0.2983
CC(O)CCC1CCO1,0.3187
Cc1c(cc([nH]1)N)C#N,0.2055
CN1C2CC2(O)C1C=O,0.1829
N=C1NC2CC12OC=O,0.2472
NC(=O)C12CC3CN1C23,0.2587
C1C2CC1C1CCC2O1,0.325
CC1OCCC1OC=N,0.2648
CC#CCC1C(C)N1C,0.2723
CN=C1OCC2CCC12,0.2683
CCCOCC(C)CO,0.3257
CC1CC(O1)C1CN1C,0.3053
c1cnc([nH]1)CC=O,0.1766
CC12CC1C1OCC1O2,0.3024
OC1C2NC2C2CC1C2,0.3109
COc1cnc([nH]1)OC,0.2475
N=C1NC2CC(=N)OC12,0.2628
CC1CC(O)C11COC1,0.3021
CC1OC(CO)C1C,0.3136
C1CC2(C1)CCOCO2,0.3328
CC1(O)CCC1O,0.3266
OC1C(C=O)C1C#N,0.2225
c1c(c2n(n1)C=CC2)N,0.1796
CC1CCC(CO)C1=O,0.2166
OC1CCC(C1)NC=O,0.2821
COc1cncnc1O,0.2102
OC1C2CC1(O2)C1CC1,0.2993
CC1CC2NC2C(C)=C1,0.2473
CCC1(C)CC(N1)C#N,0.2672
CC12OCC1OCC2=O,0.1975
COC(C=O)C(=O)OC,0.2174
OCC(OCC#N)C=O,0.2033
CC1=CN(C(=O)C1=O)C,0.1408
C(C=O)C(CC=O)CO,0.2079
N=C1CC(CO1)C1CN1,0.2775
NC(=O)CC1CC(=O)O1,0.2465
CC12CCN3C1C=CC23,0.2231
c1cn(c(n1)C=O)C=O,0.174
CC12CC1C(C)(C2)C=O,0.2273
COC1C2CC2C2OC12,0.3082
C(CC#CC(=O)N)CO,0.2342
N=C1NCC1(C=O)C#N,0.206
OC1CN2N=NC=C12,0.2579
Cc1ncnc(n1)CO,0.2123
Cc1c(nc(o1)C)CO,0.2301
OCC12CC1NC(=O)O2,0.2973
C1C(=O)NC(=N1)NC=O,0.2181
OC1CC1N1C=CN=C1,0.249
OCC1C2OC2CC1O,0.3309
CCN1C(C)CCC1=O,0.2678
NC1=C(NC=N1)C1CO1,0.2099
CN=C1CCC(O1)C#C,0.2689
CC(CCO)CC(C)=O,0.2338
N#CC1CCC1C1CN1,0.275
CCC1C2C3C(O)C2C13,0.3219
OC1CC2CC2(C1)C#C,0.2869
CN=C(C=O)OC(=O)N,0.1649
OC1C2C3NC2C13O,0.2894
C1C2OCC3C4OC23C14,0.223
C1OC11CCCN2CC12,0.302
CC#CC1=CCOC1=O,0.1924
C1COCC(=C1)C(=O)N,0.219
CC1CC2C3CC3C2C1,0.3181
CC(=O)C(CO)CO,0.228
CNc1c(nccn1)F,0.1826
COC(C)C1C(C)C1C,0.3174
CC1OCC11C(O)C1O,0.274
CCC1CCCOC1=N,0.2751
COC(=O)COC1CC1,0.2587
CN=C1C=CON=N1,0.2015
O=CC(C#C)C#CC#N,0.204
COC12CCC1C(O)C2,0.3045
NC1C2CC2C1(N)C#N,0.268
O=CC(C#C)C#CC#C,0.1989
COC1CC2OCC2O1,0.3305
C1=CC2C=CC3C1C23,0.2339
CC(O)(CC=O)C1CN1,0.2219
COC1CC(C#N)C1N,0.2707
CC1CC1N=COC=O,0.2314
OCC12OC3C4C(C14)C23,0.3315
C1CC11CC2OCC2=C1,0.2279
CCC1(C)OCC1OC,0.318
CCC(CC)CN1CC1,0.3182
OC12CC1N1CC21C#N,0.234
OC1(C=O)C2OCOC12,0.2039
C#Cc1ncc2n1CC2,0.2026
CC1C2CC1(C2)OC=O,0.2836
NC1=NC(=NO1)C1CO1,0.2356
c1[nH]c(c(n1)NC=N)O,0.2124
CC1COC11CCC1,0.3135
CCn1ccc(n1)C,0.2589
C1CC(=NO)C(=O)NC1,0.199
CC1CC=CC(=O)C1C,0.186
CC1C2CC1N2CC=O,0.2093
OCC1CC11CC=CC1,0.2642
N=C1OC2(CC1C2)C=O,0.2203
CC1CC(CC#C)C1C,0.3131
CC#CCC(C)C,0.3016
COCC(OC=O)C#N,0.2561
C1CC2C3CC1C2C=C3,0.2507
OC1(C#C)C2OC1C=C2,0.2337
CC1C2CC2(C)C1(C)C,0.3215
CC12CCC1(CC#C)O2,0.2946
OC1C2C3C4C1CC2N34,0.3019
CC12NC1CCCC=C2,0.249
CCC1(C)CN1C(N)=O,0.2849
OCC(=O)C1CC(=O)N1,0.2188
CC(O)C(O)C1CC1,0.3113
O=CC1C2CC1C(=O)O2,0.2155
C1CC2(COCC=C2)O1,0.237
OC12CC1CCC2=O,0.2209
CCOC(=O)NCCO,0.3073
CC#CC1=NCC2CN12,0.2078
CC12OC3C1OC23C=O,0.1988
CC1(CCC1=NO)C#N,0.2449
C#Cc1cccc(=O)o1,0.1574
CC1C2CC1C1(C)CN21,0.3178
C1C2N1CC13CC21OC3,0.2606
CC1(C#N)C(O)C1C#N,0.2791
CCCC12CC1CC=C2,0.2477
CCn1cncc1O,0.2443
O=C1OCCC2CCC12,0.2699
c1conc1OCC#N,0.2557
CC1OC11CCOC1,0.3266
OC12CC(=O)C1C1CC21,0.2035
C1C2C=C3CC4C3C2N14,0.1798
C(C#N)C(=O)C#CC#N,0.189
C1OC11C2CC3CC1N23,0.2859
OC1C(CC1C=O)C=O,0.2232
C1OC2C3OC=NC1C23,0.2645
CN(CCC1CC1)C=O,0.2713
c1c(c(on1)C=O)N,0.1688
CC1OC(=O)C=CC1C,0.217
C1C2NC1C1=C2ON=C1,0.2095
CC12CN1C1CCC21C,0.2918
C1OC11CCN=COC1,0.258
c1nc2c(o1)CNC2=O,0.2298
CC(C)Nc1ccoc1,0.2164
OC1C2CN2C1=N,0.2474
CC(C#N)N(C)C1CC1,0.2626
O=C1NCC11C2CC1C2,0.2702
C1CC11C=CCC2CC12,0.2477
c1coc2c1NCCO2,0.2174
CC(=O)C(=N)NC,0.1711
C1CCC(C1)CO,0.341
CC1OC2COCC1O2,0.3265
CC(O)C1CC11CCO1,0.2919
C1C2N=COC3CC12C3,0.2366
CC1CN2C=NC(N)=C12,0.2227
OC1CCCC2CC1C2,0.3332
C1CC2(CC2)CC1=O,0.2212
CCC(=O)C1C2CCC12,0.2213
CC1C(CO)N1C1CC1,0.2878
O=C1CCC2OC2C1=O,0.1667
CCC(CO)CN1CC1,0.3255
O=CC12CC3CC1N2C3,0.2231
CC1(C)C2OC1C1NC21,0.3072
CC1CNC2=NNC=C12,0.2209
CC1C=C(CC1O)C#N,0.2202
CC(=O)C1NC11CCC1,0.2207
C1CC2(C1)C1CCOC21,0.3046
CC1NCC2OC2C1=O,0.1945
CCCC(=O)NC=NC,0.2357
CC(=O)N1CC1CC#C,0.2522
C1CC2OCCC1C=C2,0.2447
CC1(CCC1O)C1CC1,0.328
CC(=O)OCCC#N,0.2851
OC12CC1C=CC2=O,0.1878
N=C1OCC1(C#C)C#C,0.2774
C1OC23CC4CC2NC134,0.2663
CCCn1ncc(n1)O,0.2309
CC1CCCC(O1)C#C,0.2921
CC12CNC1(CO2)C#N,0.2461
CCc1noc(=NC)o1,0.2373
CC1C2C3C2(C)OC13C,0.3119
CC(=O)C12CCCC1O2,0.2229
CC(CC#N)C=O,0.2308
CC1(CO1)C(=O)C1CN1,0.2183
CC1(OC11CCC1)C#N,0.2904
CCC1=NCC2(O1)CC2,0.2588
CCC12CC1(OC2)C#N,0.2482
FC1=COC=CC1=N,0.1954
OC12CC1C(NC2)C#N,0.2756
CC(C)(C)C(=O)C(=N)N,0.1934
CN1CC1CC(C)=O,0.2079
N=C(CC1CN1)OC=O,0.2241
OCCC1(O)CC2CC12,0.313
CC(O)C1(CC=O)CC1,0.224
O=CC12CC3C4C(C14)N23,0.2002
CN=C1NC(=N)ON=N1,0.1575
CC(O)C1=CC=C(O)N1,0.2275
O=C1NC2CC2C1C#C,0.2599
NC1=NC(OC=N)=NN1,0.234
CC1N2CC(C#N)C12C,0.2664
COCCCOC1CC1,0.3317
CCC1(CC2(C1)CC2)O,0.3178
CN1CC(O)C1C(C)=O,0.2099
c1c(c(no1)N)C=O,0.192
OC1CN=CNC1C#N,0.2523
CN(C=O)C1CC2OC12,0.2717
OCC12COC1C1CC21,0.307
CCN(CC([O-])=O)C=[NH2+],0.2381
C(C#N)OC=O,0.2797
CC1CC(O1)C1CC1,0.331
C(=O)Nc1c(n[nH]n1)O,0.2109
CC#CC(O)CC1CN1,0.2751
C(CC=O)COCCO,0.2301
CC1CC2C(=O)NC12C,0.2711
Cn1c2ccoc2cn1,0.2113
COC1(C=O)C2CC1O2,0.1964
Cc1c(ccn1C)O,0.2271
CC12CC=CC(O1)C2=O,0.2163
CNC1=CC(=O)C2OC12,0.1837
CC12C3CC4CC1N4C23,0.3001
CC1=CCC(=O)C1C#C,0.2163
O=C1C2CC3C2N13,0.2506
CC(O)CCC(=O)C=O,0.1571
CN(C)C1=C(N)ON=N1,0.1666
CC(O)C1(C)CC1C#N,0.3062
COCC1(C)CC(O)C1,0.3285
CC1N(C)C1(CN)C#N,0.2695
CC(C)C(C=O)C(C)C,0.221
CCC(C)C1=CN=CN1,0.2489
O=CC1OC1C1COC1,0.2029
OCC1CC11COC1=O,0.2787
NC1=NNC(=C1)C1CN1,0.2242
CN1CC1(CC=O)C#C,0.2096
OC1CC2OC2CC=C1,0.25
CC(=O)Nc1ccno1,0.2122
c1cnc(nc1F)O,0.2241
CC12CCC(C)(N1)C2=O,0.2264
Cc1ccc(cn1)F,0.2176
CC12CC3C4C3C1C4O2,0.3126
CC#CCNC(C)C#N,0.2637
N=C1NN=NC(=N)C=C1,0.1723
CC(=O)NCCCC=O,0.2264
CC1OC2(CC12C)C#N,0.251
c1ccc(=O)nc(c1)N,0.1656
CC1(COC(=O)N1)C#C,0.2882
OC1=NNN=C1C1CN1,0.2138
C1C2CC3CCCC3C12,0.3289
Cc1[nH]c2c(n1)CCO2,0.2221
CCC(CC#N)C#N,0.3421
O=C1CC2C3NC3C12,0.2071
CC#CC#CC1(C)CN1,0.2099
CC1(O)CC(O)C=C1,0.2525
OC12CC1C1OC21C=O,0.2001
O=CC1CC2CC1C2,0.2249
OC1CC(C1)C1CC1,0.3338
CC(C#C)C1OC1CO,0.3069
CC1OC(=O)C(C=O)=C1,0.1735
CC1=C(O)N=COC1=N,0.1733
CC(C)C1CN1C=O,0.256
O=C1CC(N1)C#C,0.274
CC1(O)CC(CC#C)C1,0.3054
C#CC1C2NC1C2=O,0.244
CC12CC1(CO)CO2,0.3017
CN=c1ccoc(n1)N,0.2021
OC12CC1C1(O)COC21,0.2957
CN1N=NOC1=N,0.2064
C(C=O)N=C(C=O)N,0.1813
NC1=NC(C#N)C2NC12,0.2532
CC#CC1CC(=O)N1,0.2734
CC(C=O)N(C)CC#C,0.199
CC1CC2C3C4CC13C24,0.3541
CC1(C)CCCC1O,0.3288
CC(O)C1=CCOC1=N,0.218
CC12C3OC1C1OC3C21,0.2583
CC12CNC1CN=CO2,0.2622
CC1CCC(C1)C#N,0.3452
CC(C)C(C)OC(N)=O,0.3241
CCN1CC1(C)CO,0.2989
CC12C3CC1OCC23,0.3259
COC1C(OC1=N)C=O,0.2165
CC(C)C1C(O)C1(C)C,0.306
C#CCc1cnn[nH]1,0.2564
c1cc-2cnc[nH]c2c1,0.1417
COC(=O)CN1CC1C,0.2447
CNc1cnc([nH]1)C#C,0.1836
CC12CC(O)(C1)C=C2,0.2384
CC#CCCN1CC1,0.2973
CC1C2COC2C1(C)C,0.3125
CC12CC3(CO3)C1CO2,0.3066
CCC#CC12CN(C1)C2,0.2773
COC(=O)C1CN1C,0.2321
C1C2C3CC(N12)C31CN1,0.3051
C1CC1OC2(CC2)C=O,0.2162
CNC(=N)C1OCCO1,0.2555
COC(=N)NC(C)C#N,0.264
NC1=NOC(=N)NC1=N,0.1822
CC12CC1OC(=O)N2,0.2988
CC1C(O)C2CN2C1=O,0.2409
C1C2COCCN12,0.2969
OCCC1(CO1)C1CO1,0.3321
C1COC(=N1)NCCO,0.2752
CC12OC3OC1C2C3O,0.3168
CC12C3C4C3C1C1C4N21,0.288
CCC12CN(C1)C21CC1,0.3079
CC(C)C12NC3C1NC23,0.287
C1CCCC(=O)CC1,0.2222
CC1C2CC3(C)OC3C12,0.3275
O=C1CC2COC1O2,0.2122
OC1CC2CC3OC1C23,0.302
c1c(nco1)CC#N,0.249
OC1C2C(CC12O)C#C,0.2969
O=C1COC2CCOC12,0.2004
CC1(CN1)C1=CC=CO1,0.2297
OC12CC1C1OCC21O,0.2749
CC1CC(O)C2(O)CC12,0.3172
C1OCC2CCCCC12,0.3217
O=CCCC1C2CC1C2,0.2289
c1c2c(c(o1)N)COC2,0.2166
O=CCCC1CC2NC12,0.2176
CC1=C2CC=CC2CC1,0.2421
CN=C1OC2CC2C1O,0.2655
OC12C3C4C1NC2CN34,0.2883
c1c[nH]cc1CCO,0.2501
CC1(O)CC2OC3C2C13,0.3083
C1C(CO1)(CC#N)C=O,0.2179
OCC1(O)C2NC2C1O,0.3032
CC1COC(=N)C(=O)N1,0.2199
C#CC1OC2CNC12,0.2506
c1c(c2c([nH]1)OCC2)N,0.2326
C1C(OC=N1)(C#N)C#N,0.2539
C1CC2(COC2)NC1=O,0.2724
CC1(C)CC(C)(CO)O1,0.3149
CC12CC3OC1CC3O2,0.3263
CCc1c(nn[nH]1)C#N,0.2407
CC1=CC2OC2C11CN1,0.2286
CC(NC1CC1O)C#N,0.2559
OCCC1CNC(=O)N1,0.3055
CC1(CN1)C(=O)CCO,0.2242
C(C=O)OCC(=O)N,0.2107
OC1C2C(=O)CC12O,0.2304
N=C1OC2(CC2)C2OC12,0.256
CC1NCC(=NO)C1=O,0.1482
NC1(CC2OCC12)C#N,0.2724
Cc1cc(c(o1)CO)O,0.2132
C(CN=C(C=O)N)C#N,0.1881
CCC1CC=C(C)CO1,0.2625
CC1CC11OC2CC12O,0.2921
CC1C2OCOC12C,0.3294
CCC(C)(C)CC#N,0.3439
CCCN(C)C(C)C#N,0.2652
CCc1c(onn1)C#C,0.1947
CC1CCOC1CC#C,0.3037
CC1OCC(=O)C(C)=C1,0.1811
CCOC(C)(C)C(C)C,0.321
CCC(COC)CC#C,0.3084
CC1(C)C2C3OC3C12,0.2825
CC1=CC2OC3C1C23C,0.228
CC1C=CCC(=O)N1C,0.2484
CC(O)C1(C)NCC1=O,0.2142
CCc1c([nH]c(=O)[nH]1)O,0.2291
CC1C(O)C1(C)CC#N,0.2938
OCC(=O)C(=O)OC=N,0.1747
CC1=C(COCCC1)C,0.2434
COC1(CC1)C1(C)CO1,0.3177
OC12C=CCC3OC1C23,0.2312
O=CCC(NC=O)C#C,0.2261
C#Cc1ncc(nn1)O,0.1703
OC1C2OC2C2OC12,0.2968
OC12CCC(C1)C1OC21,0.3227
CCCCC1(CC)CO1,0.3473
COC1C2OC(C=O)C12,0.2203
O=C1CC2OC=NC2C1,0.2161
CC12COC1C2C1CO1,0.3071
CC1=CN=C(N1)C1CN1,0.2291
N=COC1OCC2NC12,0.2773
O=CC1(CO1)C1CCO1,0.2131
O=CC1CCC2CN12,0.2159
c1cnc([nH]1)CC#N,0.2496
CC1CC(O)C(C)C1=O,0.2157
OCC1N(CC1=O)C=O,0.2197
OC1C=CCCC1C#N,0.2628
OC1C=CCC2CC1C2,0.2603
CC1CC=CC1(O)C=O,0.2142
CCCCc1cocn1,0.2455
O=CCNC1CC1C#N,0.2112
Cc1cc(c(o1)C=O)N,0.1744
CC1NCC(=O)C11CO1,0.1833
CC1=CC2OC1C(=N)O2,0.2343
Cn1cc(cn1)N(=O)=O,0.2047
CCC12OC3(C)CC1C23,0.3123
CNc1ccc(n1C)N,0.2283
C1N=COC2C3OC3C12,0.2776
COCC(C)C1CC1,0.3423
CC1=CC=C(N1)C1CN1,0.2326
OC1CC11C2CC2C1O,0.2983
CC(C#C)C1=NCCO1,0.2656
OCC1=CCC(O)CC1,0.2616
CC1CC2(O)CC2C1O,0.315
OC1CC1OC1CC1,0.3104
CN1C2CC1C(=O)C2O,0.1979
CC1=CNCC1=NO,0.178
c1cc(cnc1)C(=O)N,0.2049
COC1CN(C1)CC=O,0.2011
CCC12CC1C(N2)C#N,0.2685
CC1(NC1(C)C=O)C=O,0.2005
CC1C2N(C)C1(C)C2=O,0.2466
CN=C1NC=NOC1=N,0.1878
CC12CC3(C)N=CN1C23,0.2371
CCC1(CC2CC12)OC,0.3321
O=C1NC23CC12CC=C3,0.241
COC1CCCC11CN1,0.3076
C#CCC1(CO1)C1CC1,0.3064
CCc1c(n(cn1)C)C,0.2429
CCC1(CN(C1)C)C#N,0.2644
N#CC12OC(C=C1)C=C2,0.2027
N=C1NC=NNC1=N,0.1888
CC1=CC(OCC1)C#C,0.2593
COCC(O)C#CC#C,0.2234
CC#CCC(=O)C#N,0.1803
CCNc1cnnn1C,0.2303
c1c(oc(=O)[nH]1)CCO,0.2367
COC1C(N)C1(N)C#N,0.2612
O=CC1NC11CNC1=O,0.2194
CC1CC2(CCO)OC12,0.3228
C1C2C3NC3C3OC2C13,0.3007
Cn1c(c(cn1)CO)O,0.2461
CC1C2CN1C(C2)C#N,0.2696
CC(=O)OCCNC=O,0.2621
CC1CC1C1OC1CO,0.3371
CC#CC1C2CN1C2,0.258
N#CC12CC3(CN3)C1N2,0.2684
C(CO)N=CNC(=O)N,0.2443
CC(=O)C1(CC1)CC=O,0.2212
CC1OCCN2CC12C,0.3028
OC(C#C)C1OC1C#C,0.2719
CC(=NO)C(O)CCO,0.2548
C(C#N)N(C=N)C=O,0.233
CC1(CO)CC(=O)C=C1,0.1932
O=C1CC(CC=C1)C#N,0.1884
O=CN1CC1C#C,0.251
N=C1OCOC11COC1,0.2622
CC1COC(=O)C(C)C1,0.2682
CC(CC=O)(C#C)C#C,0.2203
CNC(=N)c1ccon1,0.1867
CC1(CC1)CCO,0.3413
Cc1cc(=O)c(c[nH]1)O,0.1909
CC1(C)CC11CNC1=O,0.2768
CC12CC3C(NC1=O)C23,0.2594
CC(=O)C1(O)C(O)C1O,0.1981
CC1C=CCC2CCC12,0.2603
CC1CCC2CCC1C2,0.3542
CC(C)(O)C1COCO1,0.3257
c1cnnc(n1)NC=O,0.1614
CC1CCC11CC1O,0.3261
CNC(C#N)C(C)N,0.2847
CN1CC1C(C)(O)CO,0.2818
CNC(C)C1=NC=CO1,0.23
CC1COC2COC2=N1,0.2631
C1C23CC=CC12OCO3,0.2398
CCC(O)CC1CO1,0.3272
CC#CC(O)CNC=O,0.2702
CCCN=C(C#N)OC,0.2284
OC12C3NC1C3C21CO1,0.3111
CCC(C)CN(C)C=O,0.2668
CCNC(=NCC)C#N,0.2028
CC1C2OCC=CC12,0.2437
Cc1c(n[nH]c1C#C)C,0.2106
CC1C2OCC(O)C12,0.2993
C1CC12C=CC(=O)CO2,0.1777
CC1(CN1)C1=NNN=C1,0.2429
OC1CC11CCC11CN1,0.2918
CCC12COC3C1NC23,0.3128
c1c(cc(=O)oc1O)N,0.1892
OC1CC11C2C3CC1N23,0.2989
N=COC1C2C3OC3C12,0.2691
CC12CC(C1)(C2)NC=O,0.2758
OCCC1C2C3NC3C12,0.2753
O=C1C(C2CO2)C2CN12,0.2359
N=C1OC2CC2C2OC12,0.2571
O=C1OC2C3CN3C12,0.2443
c1c(c([nH]c1N)N)O,0.2269
CNC(=O)NC1CC1C,0.2978
CC12CCC(C1)OC=N2,0.2695
CC1=NC2CC2(CO)O1,0.2598
C1C2C3C4C5C(C3N45)N12,0.3046
CCC(C)(O)C#CC=O,0.2049
C1OC1C1CCC2OC12,0.3469
COC1OC(=N)CC=C1,0.2508
C1C2C3C4OCC(C34)N12,0.3009
CC1NC11CC(O)C1=O,0.1949
CC12CC3N1C2C3=O,0.2343
CC12CC3C1C(C=O)N23,0.2105
CC1(C)C2CC2C1C#N,0.3064
C1N2CC11N=COCC21,0.2397
CCCNC(=O)NCC,0.3024
CC(O)C12CC1OC2,0.301
C#CC1(CC1)C(F)(F)F,0.2951
OC12CC1OC1COC21,0.2975
CCN1CC1(CN)C#N,0.271
CC12CCC(CO1)OC2,0.3145
CN=CNc1cocn1,0.2106
CC1=CC(N)=CC(=N)O1,0.1689
NC=NC(C=O)C(N)=O,0.1983
CCC1(O)CNC1C=O,0.2076
CC1C(O)C1O,0.2838
CCOC1C2OC(=O)C12,0.2664
CN1C2CC(O)CC12C,0.2839
OC1CC(O)C2OC12,0.3284
CC12OC1C=CC21CN1,0.2366
OCCC1C2C3CC2C13,0.3428
CC1CC(C)(C)C(C)=C1,0.2585
C1C2OC11CCCCC21,0.3079
CC12CN3C1C2C3C#N,0.2645
N#CC1CC2CC1C=C2,0.2566
NC(=O)C1NC1CC=O,0.2218
C1C2OC3CC=CCC123,0.2568
CC12CC(=O)CC1C2O,0.2285
CC12CCC1N2CC#C,0.2863
O=CC12C3C4CN1C2C34,0.2039
NC(=[NH2+])CC#CC([O-])=O,0.232
c1(=O)nc(oc(n1)F)O,0.2352
CCNc1ccc(o1)N,0.2143
CC1OCC2OCC12C,0.3144
CC1C=CC2CCC12O,0.2563
CC12CCC1(N2)C1CN1,0.3073
CC1(C)OC(=N)C1CO,0.281
C(#N)C(C#N)(C(=N)N)O,0.2336
CC1(CO1)C1=NC=CN1,0.2417
CC1(CO1)C1CCC1O,0.3226
OCC1C(=N)OCC1=O,0.2125
OCCC1OC1C1CN1,0.3225
CC1C2C3C1OC23CO,0.298
C#CC1C2OC(C#C)C12,0.2515
CC(=O)C(C)(C)OC,0.2295
CCOC1CC(=O)C=C1,0.1901
c1cc(=O)n(nc1)C=O,0.166
OCC(O)C1CC2CC12,0.3098
OC12C3C1N1C3CC21,0.2835
CC1(COC(=O)C1=O)C,0.1696
CC(=NO)CC(=NO)C,0.2373
CC12CC3CC(C1O)N23,0.2808
COc1c(coc1N)N,0.2201
O=C1CCC1C1CC1,0.2168
CC#CC1CO1,0.276
CC12CC(OC1)C21CO1,0.3114
CCC(C)CC1CN1C,0.2968
NC1=NOC(=N1)C1CO1,0.2154
CC12CC1C1CC2O1,0.3319
OC1CC2(CC2)C=C1,0.246
CCC(=O)C#CC(C)O,0.2093
C1CC23OCCC2CC13,0.3134
C1COC(=N1)COC=O,0.2637
N=COCCCNC=O,0.2765
CC1OC2C3OCC3C12,0.2861
COC1C(O)CC1C=O,0.2203
OC12CC1N(C=O)C=C2,0.2058
OCC1OCOC1=N,0.2783
OC1CC2CCC1OC2,0.307
CC1C(N)C(=O)N1C=O,0.2022
CN1CC2=CC3OC3C12,0.2127
CC1OCC=C1NC=O,0.2114
CCC12CC1C1CC2O1,0.3274
C1C(=NO)CN1,0.2326
ON=C1CC(C#C)C1O,0.244
O=CCC1(CO1)C1CN1,0.2229
C#CC(C#C)(C#C)C#N,0.2877
CCN1CC11COC1=N,0.26
CCC1=NCC(O)CO1,0.2692
CC1(C)CN1C(=N)C#N,0.2064
CC12CN3C1C2(N)C3=O,0.2436
CC1C2CC3(C)C2N13,0.3255
O=CC(C#C)C#N,0.2179
OCC1C2OC=NC12,0.2535
OC(C=O)C1=NOC=N1,0.227
CC(C)(C)C#CC1CC1,0.2828
CC1=NC2C3CC3C2O1,0.2669
CCc1cnc(o1)C,0.2366
CN=COCC1CC1O,0.272
CC#CC#CCC1CO1,0.2255
CC1(CC1N1CC1)C#N,0.2906
CC#CC1(CCC1)CO,0.2918
CC12C3C(CC13O)C2=O,0.2448
CCCC(=O)N(C)CC,0.2687
CC1OCOC(C)C1C,0.3368
C1C2C3CN2C13,0.324
CC1=CCC(O)CC1=O,0.1897
NCC(C#N)C(N)=O,0.2638
OC12CC3OC(C1)C23,0.3075
O=C1CC=C2CCC12,0.2205
O=CC1C2COC=NC12,0.2119
CN=C(CC=O)NC=O,0.2071
C1OC2CC=CC1O2,0.255
CCc1cnn(n1)C=O,0.2159
NC1=NCC(=O)N1C=N,0.2152
O=C1CC2(CO2)C2NC12,0.2185
CCC(CCCO)C=O,0.2264
c1c(nc[nH]1)CC#N,0.255
COCC1OCC=C1,0.2498
CN1C2C(C#N)C2C1=O,0.236
CCN1C2CC1C2C=O,0.1994
NC1C(O)C(O)C1C#N,0.2604
C[NH+](CCO)CC([O-])=O,0.2587
CC(O)C1OC1C#C,0.2778
c1c2n(c(=O)[nH]1)C=CC2,0.185
CC12CC(O1)C2CC#C,0.2936
C1C(=CNC1=O)C#N,0.1898
Cc1c(onc1O)C=O,0.1911
N#CC1CC2OC1C=C2,0.2576
CC12COC1C=CC2O,0.2447
OC1C2C=CC(O)C12,0.2336
CC1C=CCC1C=O,0.2172
C#CC1OCCN=CO1,0.2545
CC(=O)C12CNC1CN2,0.2031
CC1CC11CCCC1=O,0.2229
CCC1OC(=N)C2CC12,0.2783
C1OC1C1COC=N1,0.2686
CC12CC3CC1(CO2)C3,0.3318
CC1C(O)C1(C)O,0.3109
CC12C3CC1C1C3C21O,0.2978
CC(=O)C(CO)C#N,0.2284
O=C1CC2COCC2=C1,0.1944
Cc1c(onn1)OC=O,0.2027
CC1COC2=C1NC=C2,0.2179
Cc1c(n[nH]c(=O)n1)F,0.1696
C1C2CN=C3OC1C23,0.2177
O=CC12CC1C1NC21,0.2049
CC1CN=COC(=O)C1,0.2376
N#CC12CC3OC1C3O2,0.2595
OC1CC2CC3CC12C3,0.325
OC1C2OC1C2=O,0.2281
CCC(=O)C(=O)C(C)O,0.159
C1CC1N2CCC(=O)C2,0.1962
CC#CCCCC(C)O,0.3024
COCC1C2OC(=O)C12,0.2616
C1C(CNC(=O)N1)C=O,0.2051
CN1C=NC2(CC2)C1=N,0.2096
COC1(C)CCC1C,0.3225
NC(C#CC#N)C1CO1,0.2167
CC(O)C12CC(C1)CO2,0.3243
c1cnc-2nocnc12,0.1498
N=C1CCC2(COC2)O1,0.2815
O=C1NC2CC2N=CO1,0.2457
Cc1c(cccn1)F,0.2232
c1cn2c(n1)C3(C2)CC3,0.2505
O=C1CC2CC3CC2C13,0.2166
CCOC(=N)CC1CN1,0.2821
CCC12OC1CC=C2C,0.2451
COC1CCC1(O)C#N,0.2741
CC(=O)CCOC=O,0.2339
OC1CC=CCC1C#C,0.2668
CC1(O)COCCC1=O,0.2257
CC1NC(CC1O)C#N,0.2745
OCC1N2CC(C2)C1=O,0.208
O=C1CC2C3OC3C2=C1,0.1891
CCc1c(cc(o1)C)C,0.2273
CC12CC(O)C3CN1C23,0.2922
CC12COC=NCC1N2,0.2491
C1C(CC1=O)CNC=O,0.222
CC1(C)CC2OC1C2=O,0.235
Cc1c(=O)ccoc1N,0.1977
OC12CC3=CC(=O)C1C23,0.1599
CCCC1C=CCC1O,0.263
Cc1c([nH]cc1CO)C,0.2415
CC(=NC)OCCC=O,0.2248
CCCCC(=O)OC,0.2868
CC1C[C-]2[NH+]1C=CC2=O,0.1437
C#CC12CC3OC1CC23,0.2741
CC(C)C(O)CCC#C,0.311
CC1(O)CC1NC(N)=O,0.2901
CC(C)C1CCC=CC1,0.2682
CN=COC1CC(O)C1,0.2697
OC1CC1C1CCC=C1,0.263
N=C1NC(=[NH2+])N[CH-]C1=O,0.1438
c1cn(c(c1O)N)C=O,0.178
CC1(C)CCCC1C#N,0.3383
CC1COC11COC1,0.3149
CC1CN(C)CC1=O,0.1892
c1c2c(on1)CNC2=O,0.2301
OC1C2CCC12CC=O,0.2181
OC1CC2(C1)NC2C=O,0.22
OC1CC2=CC3CC3C12,0.2356
CC1CC2CC(=N)OC12,0.2833
CCC1CCC1(C)C,0.3562
N=C1C=NOC=C1C=O,0.1735
CC1C2OCC11CCC21,0.3202
Cc1cc(co1)O,0.2243
CC1(CCCC1)CCO,0.3302
C1CC12COCC2=O,0.2182
O=C1C2CN3CC3C1N2,0.2167
CC(C)C12NC1C1NC21,0.2642
Cc1ccc(=O)oc1C,0.1734
OCC12CC3C(O)C1N23,0.3089
CC1COCC(O)CO1,0.3105
CCN1CC1C(F)(F)F,0.3282
N1C2C1C1C3OC1C23,0.3072
COC12C3NC1C(=O)C23,0.2197
CCOC(=O)C#CC=O,0.2032
CCCC1(CC(=O)C1)O,0.2163
N#CC1C2C3CC1CC23,0.3184
C1C(=O)NC(=O)C(=O)O1,0.2043
COC(CCO)C(C)=O,0.2173
COc1nc[nH]c(=O)n1,0.2168
CC1(C)NC(=O)C11CN1,0.2608
CC(=O)N(C=N)C(=N)N,0.2187
C1CC2(O1)C1CC2CC1,0.3225
CC12CC1N=CO2,0.2603
C1CC1C1CCOC=N1,0.2702
OC12C=CCC3C1OC23,0.2415
Cn1cc(oc1=O)C#N,0.1906
CCC1CC2(CC2)C1O,0.3217
CC1CN2N=C(O)C=C12,0.2393
CC12CCC1=CC(=O)C2,0.1932
C(C1CC1)C1COCO1,0.3395
CNc1cc(=O)cno1,0.1777
O=CC12C3CCC1CN23,0.2113
O=C1OC2C(C12)N1CC1,0.2619
CC1C2C3CCC2(O)C13,0.3286
CC1(C)C(C=O)C1C#N,0.2214
C#CC#CC1CC2CN12,0.2109
N=C1OCC2(CC12)C#N,0.265
CN=C1OC(=O)OC=C1,0.2094
OC1=COC(OC=N)=N1,0.2051
C1C2C3C1COCCN23,0.3065
CC1=C(C#N)C(O)CC1,0.2176
OC1CCC(O)C2NC12,0.3118
CC1CN(C=O)C1C,0.2647
CC#CCCC(O)C#C,0.2714
O=C1CNC2CCC2C1,0.2134
ON=C1C2CC1C=C2,0.2366
N=C1NC=NC1CC#N,0.2263
CC(=O)NC1=CCCC1,0.2121
c1coc2c1NCCN2,0.2114
OC1(CC=O)CC2CC12,0.2235
CC(CCO)C(N)C#N,0.2941
OC1COCC2OC2C1,0.3122
C1C(=O)OCC(=O)N1,0.2574
CC1C=CCC1(O)C=O,0.2172
C1C2NCCN=COC12,0.2561
OC1CC2OC1C1CC21,0.3237
OC1C2C3C4C=CC13C24,0.2213
CCCC1CCC1C#C,0.3021
NC(=O)C(O)CC#C,0.2772
C1CC12CCC23COC3,0.3172
CC12CC1(C)NC(=O)C2,0.2628
OC1C2C3C(O)C1CN23,0.2882
C#CC1C2CC3CC2N13,0.2624
N=C1OC=CC(=O)O1,0.2086
CC1(C(=O)OC=N1)C,0.2455
CC1CNC(C)C(=N)O1,0.2493
OC1C2CN3CC3C12O,0.2794
NC1C(O)C(=O)NC1=O,0.2139
CC(=NO)CCCC#N,0.2519
C#CCCN1CC1C#N,0.2699
C#CCCC#N,0.3014
OC12COC(C=C1)C2=O,0.2153
CC1CC2CC1C21CO1,0.3472
OC1=CNC(=N)C(=O)N1,0.1605
CC1=C2CC3C(CC1)C23,0.2161
OC12C3C1C1(C=O)C2N31,0.1853
CC12CC1[NH2+]C2C([O-])=O,0.26
C1CN1C2=NCC(=O)C2,0.2105
COC(C)C(C)(C)O,0.3185
O=C1CCC1OCC#N,0.2037
C1CC23CCCC2OC13,0.3104
CC12CC1(CO)CCO2,0.3033
c1ccc(cc1)C(=O)N,0.2113
Cc1c(c(ncn1)N)F,0.2146
Cc1cc([nH]c1C)C#C,0.1938
N=C1OC2C3CC12OC3,0.2581
CCC12COCC1C2C,0.3229
CC(O)C12CN1C1CC21,0.2784
C#CC12CC1CC21CC1,0.2645
O=C1OCCOC1C#C,0.2523
O1C=CN=CN=CN=C1,0.1979
O=C1CN2CC3CC1C23,0.1913
OC(C#C)C#CCC#C,0.2663
CC1COC(C=O)C1=O,0.1936
C1C2CC11OC=NCC21,0.2724
OC1CC2CC1(O)CO2,0.3
C#CC12OC1CN1CC21,0.2433
CC1C2C3CC1(C#C)C23,0.2825
CC(C)C1CCC(=O)C1,0.2223
CC(C#N)C(C)N1CC1,0.2897
C(COC(=O)CC#N)O,0.2659
FC1=COC(=N)C(=O)O1,0.1729
CC(C#N)C(O)C1CN1,0.2977
CCC1CC(O)C1CO,0.306
CC1C2CCC2=CC1O,0.2436
CCOC(=O)C(=O)C=O,0.1473
O=C1CC=CC11CCO1,0.1926
OCC1OCC2C(O)C12,0.3066
C1C2C3CCC(CN12)O3,0.2917
ON=C1C2CC1OC2,0.2464
COCC1(N)COC1=N,0.265
OC1CN2N=CC=C2C1,0.2605
CC1OC2CCC12CO,0.2956
CC1C(CCC#C)N1C,0.2704
CCC(C)C(=NO)C#C,0.2088
Cn1c2nnnn2nn1,0.2157
O=CC12COCC1O2,0.2134
CN(C)C1(C)COC1=O,0.2289
Cc1coc(c1N)O,0.2197
CC1CCOC(O1)C=O,0.2049
CNc1c(nc[nH]1)OC,0.225
CCC1CCOC=N1,0.2705
O=CC1C2C3CN2C13,0.2063
OC1C2OC(C=O)C12O,0.1921
N=COC1CC11CCO1,0.2464
c1c(cncc1O)C=O,0.1759
CCOCC(=O)CO,0.2342
C1C2C3C4C1N2CCN34,0.2842
CC12CC(C1)C=CC2O,0.2482
C1OC11COC2CC1C2,0.3245
CC1OCCC=CC=C1,0.2047
C1CC12C=CCN2C=O,0.2262
CCC(O)C(=O)NC=O,0.2217
CC(C)(C)C#CC#C,0.2325
CCC1COC(=N)C1O,0.2774
CCC1CC(CO1)OC,0.3278
CCN(CC#C)C=O,0.2708
C#CCC1COCCO1,0.2926
CN1CC(=NO)C12CC2,0.2122
CCOc1ncn(n1)C,0.2377
C1C2CC3OC3CC12,0.3254
C1CC(=O)C2(CC2)NC1,0.1993
CC#CC(C)C1CCC1,0.301
CC1NC1C1NC1C,0.3084
CC1C(CO)C11CCC1,0.3165
c1c2c(n[nH]1)CCC2,0.2502
N=C1OCC2C=CCN12,0.2305
CC12CC3C1OC2C3=O,0.2102
OC12CC1OC(C2)C#N,0.2785
CN=C(C#N)OC=O,0.2154
C1N2CC3C4C=CC13C24,0.2073
OC12COC1C21CCO1,0.2647
FC1=NC=COC1=N,0.1708
O=CC1(CN2CC12)C#C,0.2023
CCc1c(n(nn1)C)N,0.2313
CC(=O)OCCN1CC1,0.2587
CC(C)C(O)C#CC#C,0.2232
CN1CC1C1=NOC=C1,0.2127
CC1(C#N)C(O)CC1O,0.3043
CCOc1noc(=O)o1,0.2832
CC(=NO)C1(CCC1)C,0.2554
O=CC12CC3C(C=C1)C23,0.2052
NC(C#N)C(N)C1CN1,0.2651
CC1COC(=N)C11CN1,0.2689
CN=C1OC=NC=N1,0.1778
COC(=O)C1CNC1=O,0.257
CC12NC3(C#C)C1OC23,0.2573
CC1OC2CNC1C2=O,0.1932
CC1(CNCCO1)C#N,0.2503
CC12CC1C(O2)C1CN1,0.3104
OC12CC3=CCC1C23O,0.1703
CCc1conn1,0.2326
CC1(C2(O1)COC2)C,0.316
C(CO)C(C=O)(C=O)O,0.1857
CC(=N)OC1(C)CCC1,0.2908
CC#CC12CC1C(=O)C2,0.2211
CC(O)C1CC(O)C1=O,0.2166
CC12C(NC1=O)C2C=O,0.2098
NC(=O)C1C=CC2NC12,0.2319
CC1(C)C2OCC2C1=O,0.2135
C1C2CCC=C3CN1C23,0.2288
c1c(cnc(c1O)N)F,0.1858
CC1(NC1CC#C)C=O,0.2261
Cc1c(oc(n1)CO)N,0.2077
CCC(CC)CC=O,0.2279
CC1(NC11CCC1)C#C,0.2677
COC1CC(=O)C11CC1,0.2175
COC1(C)C2CC1CC2,0.3266
OC1(CC1)C1CC1C#C,0.2768
C#CC(=O)C(=O)C#N,0.1538
CC1(CC#N)CC1C=O,0.2259
CC12C3CN1C(=O)NC23,0.2547
CC#CC1CCC1C#N,0.2762
O=C1OCC2OCC=C12,0.2081
OCC1(O)C2CC1C=C2,0.2361
NC1=[NH+]CC(O1)C([O-])=O,0.2595
CC([NH3+])C1CC1C([O-])=O,0.2698
COC1CCOC=NC1,0.2511
CC1CC2=COC=C2C1,0.2355
c1c(c(no1)NC=O)N,0.2279
CC(C)(C1CC1)C2CC2,0.3498
CC(CO)(CCO)C=O,0.2188
CC1(CN1C2CC2)C,0.309
NC(=O)CN1C2CCC12,0.2739
CC(O)C#CC1(C)CO1,0.2697
C1OC11C2OC1C21CO1,0.3115
OC12CC1C(O)(C2)C#N,0.2886
CC#CC1COC(C)C1,0.2979
CN1CC1C#CC1CO1,0.2469
CC(C)(c1cnno1)O,0.2326
CC1(O)CC1(C)C#N,0.312
OC1(CCOC1=N)C#C,0.2694
C1OC11C2NC1C=C2,0.2235
c1c(coc1C=O)N,0.1618
N=C1OCC11NCC=C1,0.2282
CC12CC=CC1OCO2,0.2594
c1c(nn[nH]1)CCCO,0.2518
OC1CC23CC12C=CC3,0.2359
COCC1OCC(C)=C1,0.2502
CCC(=O)c1ncno1,0.1898
CC1=COC(=N)NC1=N,0.2105
Cc1cnc(c(n1)O)C,0.1964
CC(=O)Oc1c[nH]cn1,0.2422
OCC1C2CN1C2,0.3099
CC1CCOC1=O,0.2779
C(C1CO1)C12CN(C1)C2,0.3062
CC(CO)(CCO)C#N,0.3064
CN1C2CC3(CN3)C12C,0.2985
COC1(CCC1N)C#N,0.2617
OCC1(O)C2OC2C1O,0.2984
CC1=CC2CC2(C1)C#N,0.2444
CCC1C2OCC(C)C12,0.3043
COC1(CCC1O)C#N,0.2853
CC12OC3C1C2C3C#N,0.2802
CC1CN2CC1C2C=O,0.2087
NC1C2NCC2OC1=O,0.2438
NC1(C#N)C2OCC12O,0.243
O=CC1CC=CC11CN1,0.2091
CC(=N)OC(=O)NC=N,0.2368
CC1OC2(C)COCC12,0.3272
O=CCC1CC1C#N,0.2249
O=C1CCC11CCOC1,0.2166
CC1C2CC=CC=CC12,0.1928
CN1C2CCCC12C=O,0.2114
CC1C2CC(=O)C1N2C,0.2009
CC1C(O)C(=O)C1CO,0.2202
c1c(c2c([nH]1)CCN2)N,0.2225
Cc1ccc(nc1F)C,0.2187
CC1N=COC1OC=O,0.265
CC#CC1(CCC1)C#C,0.2792
c1c2c(oc1N)OCO2,0.1976
C1C2(CN1CCO)CO2,0.282
CC1=C(C)C2CC1CO2,0.2457
ON=C1CC2(OC12)C#C,0.2329
N#CC12CC3N=CN1C23,0.2328
OCC12CC(C1)C(=N)O2,0.2883
CCC#CC(O)C=O,0.2129
CC(O)CC1=NCCO1,0.2704
N=C1OC2CC(C#C)C12,0.2785
C1C2N1CC21CCCC1,0.2999
OCC1OC1C1CO1,0.3298
CC1(C)OC2C1NC2=O,0.2492
CC1C(O)COC1C=O,0.1987
OC1C2CC1(C2)C=O,0.2151
C#CC1=NCC(=O)CN1,0.2048
CC12CC1C1(CO)CC21,0.2735
CNc1c[nH]c(n1)C=O,0.1481
CCC1C2OC1(C)C2=O,0.2435
C1OC2CC=CCC2=C1,0.2447
c1[nH]c2c(n1)COCO2,0.237
O=C1C2CC3CC1OC23,0.2105
OC1COC(=O)C(=O)C1,0.1793
OC1(CCCC=C1)C#N,0.257
c1c(c(on1)N)CC=O,0.1737
CC1C2C(O)C(C=O)N12,0.2128
N#CC12CC1N=CO2,0.2591
N=C1ON=NC(=C1)C#N,0.1541
C(CC(=O)CO)CO,0.2356
N#CC1C2C1N1CCC21,0.2574
CCC1C2CC3C2CC13,0.3575
CCOC1CC(=O)C1,0.2211
OCC1C=CCC11CN1,0.2491
CC(O)CCO,0.3302
COCC(=N)OCC#C,0.2765
CC(C1CC1)C1(C)CC1,0.348
c1cc(c(c(c1)F)N)N,0.213
CC(=O)NC1(CC1)C#C,0.2649
CC1C2CC1(CO)C2C,0.3359
CC1=CNC(=O)C1(C)O,0.2075
CCOCC(O)CC#N,0.3157
CC1C2CC3(COC3)C12,0.3139
CCC1CN1CC,0.3111
O=C1CC2C3C2N2C3C12,0.2103
C(CO)NC(=O)C=O,0.1757
CC(=O)NC(=N)NC=O,0.2076
OC12COC1C2C#N,0.283
CC12CCC=C3CC1C23,0.2185
CC1(CC#N)C2CC1O2,0.2896
CC(CC#CC#C)C=O,0.2124
NC1=NCCC(O)C1=O,0.1729
C1C2CN=COCCN12,0.2365
OC1CC(C=O)C11CN1,0.2022
O=C1C2OCC2C11CO1,0.1854
CNC(=O)NC(C)C#N,0.2852
N=C1OCCOC1=O,0.22
C1C2NC2C2=C1N=NN2,0.2341
CC1(C)N2CC11OCC21,0.2516
OC1CC2(CC#N)NC12,0.273
CC1=CC(=O)NC=CC1,0.1918
COc1cc(c(o1)N)O,0.2235
CC(=N)NC=O,0.2434
CCC(C)CC#CC=O,0.2055
CC1OCC2OCCC12,0.3085
CC#CC1=CC(C)CC1,0.2056
C1C2COCC3OC2C13,0.3179
CC1C2OC(C)C12O,0.3
Cc1ccc(=O)n(c1)C,0.1738
CC(CCC(C)=O)C#C,0.2342
CC1C(O)CCC2CN12,0.2732
CC#Cc1[nH]c(cn1)C,0.1976
CC1COC11CC1,0.3067
c1c(=O)cn[nH]c(=O)n1,0.1555
CC(O)COCCC=O,0.2281
CC(O)C1C2CC=CC12,0.2476
O=C1C=C2C3C4C3N1C24,0.1691
OC1CC1C1=NCCO1,0.2503
CC12CC1C1(C)CN21,0.2941
c1c([nH]cn1)C=O,0.193
CC1CCC(O)C11CO1,0.3068
O=CCC1=CC2CN2C1,0.1907
OC1CC(=O)C1NC=O,0.2122
C1C2CC1C=CCC2,0.2522
CC(C#N)C12CC1CO2,0.2776
CC(=O)C(=O)CCCO,0.1582
CC12CC(O)C1OCO2,0.3087
OCC12CC(C1)C2C=O,0.2228
CC1OC2(C#N)C(N)C12,0.2339
CCC12NC1CC2C#C,0.2771
CC1CC2C1CC2=O,0.2198
C1N2CC11CC3OC3C21,0.2873
CC1(CCC2NC12)C#C,0.2934
CC1C2OCOCC12C,0.3291
C1C=CC(=NO)CO1,0.1955
OC1CC1C1CCCC1,0.3305
C1C2OCOC3CC3C12,0.3168
OC(C#N)C1CC1C=O,0.2282
CCC1(CCCO1)C#C,0.2972
CCC1=C(C)C2OC2C1,0.2374
OC1CCN=COC1,0.2602
CC1CC2(CC12)C#N,0.289
CN=COCCCC#N,0.2739
C1CC1C12CC3C1OC23,0.3033
FC1=CC=NC(=N)O1,0.1751
CCC12OC1(C)C1OC21,0.3049
CC1C2C1C(C=O)C2C,0.2203
COC1C2CNC(=O)C12,0.2709
NC1CC2NC12C#N,0.2501
OC12CCOC1C2C=O,0.2107
O=CCC1CCCOC1,0.2263
NC1=NNC(=N)N1C=O,0.1825
O=C1COC2C3CC3C12,0.2031
CC1N2CC1(C=O)C2C,0.187
C1CNC(=O)N1,0.3086
CCCOC12CN(C1)C2,0.3219
CC1OC2C(CC=O)C12,0.215
C1CC2(CC2)C(=O)OC1,0.273
CC12COC3C1CCC23,0.3011
N=C1NN=C(N1)OC=O,0.1847
CC12NC1C1CC1C2=O,0.2032
CCOC(=N)C1(C)CC1,0.2887
COCC1CC2OC12,0.3387
CC1C2NC3C1(O)C23O,0.2705
OCC1(CCC=C1)C#N,0.2568
CC12C3CC1(CN23)C#C,0.2619
Cn1cnc2c1CCO2,0.2127
CC1CC(C)=C2CCC12,0.2422
C(=O)Oc1c(non1)O,0.2271
CCC(=O)N1CC1C#N,0.2546
C1CNC(=O)C=C1,0.2079
COC(C(N)=[NH2+])C([O-])=O,0.2243
CC1(C)OC1(C#C)C#N,0.2584
OC(C#C)C1CC2OC12,0.2812
[NH3+]CCCC(O)C([O-])=O,0.2654
COc1c(cc([nH]1)N)O,0.2262
N=C1NC(=N)C=NN=C1,0.1711
N=C1C=CN=CC=N1,0.1491
CC1(C)CC2CCC12,0.3407
O=C1CC2CC2C2NC12,0.2156
OC1C(C#N)C1C1CN1,0.2676
CC1=CCC2(C)NC12C,0.246
CCC(C)(C)OC1CC1,0.3158
CC1CCOCC(=N)O1,0.2768
Cc1nc2cc[nH]c2o1,0.2136
CC(O)(C#C)C(=O)C=O,0.1424
CC1OC(=N)CC1C=O,0.2223
CC(CO)CC1(C)CC1,0.3381
CNC1COC1=N,0.2554
CC1CCC(O)C1(C)C,0.3277
CC1(C)C(O)C1CC=O,0.2039
CC1(CCOC(=O)N1)C,0.305
CC1(O)C(O)C1(C)CO,0.2968
CC1=CC2(CN2)C2OC12,0.2233
CCCC(=NO)CO,0.253
O=C(CC1CC1)C1CN1,0.2269
CC(CCO)C1CO1,0.341
CC(C)(C#N)NCCO,0.2797
N=C1NC(=O)C2OCC12,0.23
C#CC#CC1CC2OC12,0.2232
C(CO)C#CCC=O,0.2195
CCC1CC1C(C)CO,0.3394
c1[nH]c2c(n1)CCCC2,0.2419
C1C2NC3COC3=NC12,0.249
CCN1C2CC(C#N)C12,0.2724
CCOC(=O)C,0.285
OC12C3C4N3C1C24C#N,0.2378
CC(O)C1OC1CC#N,0.306
C1OC1C1=NON=N1,0.2152
CCC#CC(C)(O)C#C,0.2717
CC(CO)(C#C)C(N)=O,0.2581
COC1OC2C3NC1C23,0.2819
CC12CC3C(C1C#C)N23,0.2851
COC(C)C1(CC1)C#N,0.302
CN1C2C=CC(CO)C12,0.23
CC1CC2N1C2(C)CO,0.3187
C1OC2C3OC2C3O1,0.3067
COC1CC2(NC12)C#C,0.2534
C1CCC2(CC1)CC2,0.3429
OC1C2C=CC1C1OC21,0.2355
C1COC(O1)C#N,0.3066
CC12CC1(CO)OC2=N,0.2793
C1COCCOCOC1,0.3405
NC(=O)C12CN1C(=O)C2,0.2337
CC1CC1C(=O)NC=N,0.2213
CC(C)([NH3+])C#CC([O-])=O,0.2219
CC12CC(NC=O)C1O2,0.2746
CC12CC(C1)C21CC1O,0.2944
CCC(C)(CO)C(N)=O,0.2748
OC1CC2(CC2)C11CO1,0.3071
Cc1c(n[nH]c1OC)C,0.2567
c1[nH]c2c(n1)NC=NC2,0.2059
CC(O)CC(C)CC#N,0.3165
C1C2CC3=NNC=C3N12,0.2331
CN=C1OC2CCNC12,0.2611
CN=C(C)OCC1CO1,0.2782
O=C1CC2OCC2N1,0.2733
c1ccc(=O)ncc1,0.1667
CC1(CC1)c2conn2,0.2139
CCC12NC1C1(C)NC21,0.2682
C#CC12CC1CC1OC21,0.2791
CC12C3C(O)C=C1CN23,0.1712
CC(C)C12CC1CC2O,0.3182
COC1CC2(CO2)C1=O,0.1829
CC1C2COCC(=O)N12,0.2336
c1c(c[nH]c1CCO)N,0.2227
CCC1C(C)C1(C)C,0.3299
O=CC1CC2CN1C2,0.2141
N=C1OC2C(NC12)C#C,0.2499
CC12CC(CO1)C2=NO,0.2515
CC1=NCCOC(=O)N1,0.2466
C(C#N)C(CC#N)CO,0.2794
CC12OC(C1O)C2O,0.305
CN1CC11COC(=O)C1,0.2563
c1c(c(=O)oc(n1)N)N,0.1607
CCCC1C(C)C1C,0.3362
CC1OC2CN(C)C12,0.2906
CCc1ccc(cc1)F,0.226
OCC1C2C3CC2C13O,0.3062
O=CC#CC(C=O)C#N,0.1985
CN=COc1ncco1,0.2288
CC1(COCC#C)CO1,0.2882
CC1(NC1CCO)C#N,0.2854
OC12CC(C1)CC2C#C,0.2953
O=C1CC2(CC2)C11CO1,0.203
CCC(=O)CC(C)C=O,0.2275
CCC12OC3C1COC23,0.3093
CC1(O)CC1(C)C#C,0.291
C#CC12CC(C1)OCO2,0.2827
CCC(CC(C)O)C#C,0.309
CC1(C)CC1CC1CO1,0.3415
CC(C)(C=O)C(O)C#N,0.2213
C1C=C(CC1=O)C#N,0.2083
OC(C#C)C(O)C1CC1,0.3003
CC1(O)CC2CCC2=C1,0.2405
Cc1c(c(n[nH]1)N)C#N,0.2098
Cc1cc(no1)N(=O)=O,0.1912
CC12C3CN1C2(C3)C#C,0.2659
CC#CC1(O)CCC1O,0.2697
c1c[nH]c2c1C=CCC2,0.1875
C1C=C2CC=CC3C1C23,0.2203
C1OC11C2CC1CCC2,0.3348
CC1C(=O)C2OC12CO,0.2123
CC(=O)CC#CCC#N,0.2339
CC(C)(O)C(CO)C#C,0.29
C#CCN1C2C3CC2C13,0.2659
C(COC(=O)N)OC=O,0.2861
CC1C2COC(=N)C1N2,0.2641
O=C1OC2C3NC3CC12,0.2761
CC1(CC1C=O)C1CO1,0.2262
CC1CC(C)(C)C1C#C,0.3019
CC1C2OC(C)(C)OC12,0.3232
CC[NH+](C)C(C)C([O-])=O,0.2563
NC(C#N)C#CC1CO1,0.2636
COC(CC1CO1)C#C,0.298
CC12OC1C=CCC=C2,0.2325
C#CC1C=CC=CC=C1,0.1821
CCc1ccoc1NC,0.2152
NC1=C(O)OC(=N)C=C1,0.1499
CC1C2OC1C(=C2)C#C,0.1913
C1OC2C3OC4C3C1C24,0.3093
C(CNC(=O)C=O)CO,0.1775
CCCC12CCC1C2C,0.3236
CCOC1CC1C(C)O,0.3163
C1C2C=CC3OC3CN12,0.2274
CCc1coc(n1)CO,0.242
CCCC1(O)C2CC1O2,0.3291
OC1CC=C(C#C)C1=O,0.1842
CCCN(C=O)C1CC1,0.2658
OC1C2C1C(=O)C2C#C,0.2194
CC1OC(=O)C2(C)NC12,0.2538
CC12C3OC(C13)C2=O,0.2243
CCNCC1(CO1)C#N,0.2435
CC(C)(C1(CC1)C#C)O,0.296
Cc1cc(=O)nc[nH]1,0.2067
O=CN1C=CC2CCC12,0.2077
N#CC1=CC2NC1C=C2,0.1742
C1C2C=CC11C=CCN21,0.2077
CCC(C)OCC#C,0.2874
N=C1NC(=O)C=NO1,0.1885
c1c2c([nH]c1O)NCC2,0.2248
Cc1cc(ccn1)CO,0.2264
N#CC1=CCCC11CN1,0.1977
COC1CC(CO1)C#N,0.3067
OC1C=CC2NC2C1=O,0.1911
CC12CC(CO)(C1)C2=O,0.2482
OC1(CC1NC=O)C=O,0.2037
OCC1CC1C#N,0.2987
N#CC1C2C3CCN2C13,0.2773
C1CC2C3C4C1C4C23,0.289
NC(=O)C(O)C1COC1,0.26
CCC1CC11CC2OC12,0.3375
CN(C=O)c1c[nH]nn1,0.2148
CCC1(C)C2COC12C,0.3073
OCC1C(O)CC1=O,0.2193
N#CCN1CC1C1CC1,0.2663
CC1COC2(CC2)C1C,0.302
CC1(O)C(NC1=N)C#C,0.2588
CCC1CC(O)C1C,0.3249
C1OC2CN=C3OC1C23,0.2382
CC1OC(C)(C)OC1C,0.3268
CCN=c1[nH]nn[nH]1,0.1962
COC1(CO)C2CC1C2,0.3297
CC#Cc1coc(=O)[nH]1,0.193
CC(C=O)C1CCC1,0.2249
CC1(O)CNC1(C)C#N,0.2738
CC12CN1CC2(O)C=O,0.1969
CNC(=O)C(C)CC=O,0.2229
COC1CCC2NC12C,0.3025
OCC1CC11OCC1=O,0.221
OC1C2CC(=O)C12,0.2306
OC12CC(O)(C1)C1NC21,0.3041
CCCOC(=O)N(C)C,0.2996
CNC1(C#N)C2CC1N2,0.2649
CC12CC3(O)C(N1)C23O,0.2711
CN=c1ccnc([nH]1)O,0.1783
CC12CC3C(CC13)C2O,0.3319
O=CC12CC(N1)C2=O,0.2077
O=CC12CCC1CO2,0.2062
CCN(CC#N)C(=O)C,0.2657
C1CC2OCOCCC12,0.323
N#CC1CC2CN3C2C13,0.2755
CC1=CC2(C)COC1C2,0.2491
CCc1nc(co1)C#N,0.2237
CC1CN(C=O)C(=O)N1,0.2391
OC1CN2C=CC=C2C1,0.243
CC(CO)(CC=O)C=O,0.2128
NC12CC(C1)NC2C#N,0.2607
OC12CC3COC1CC23,0.3074
CC(C)(C1COC1)O,0.2911
O=C1CNC2C3NC1C23,0.1855
CCC1(C)OC(C)C=C1,0.2481
Cc1cc(n[nH]1)C(C)C,0.2574
C1COC(O1)(C=O)C#N,0.2198
C1CC11CC2COC2=N1,0.2465
CC(=O)c1ccc([nH]1)N,0.1676
CC1(CCO)C2CCC12,0.3287
C1N2C3C4CC=CC13C24,0.2309
C1NC11C2C3C1CN23,0.3076
CC1=C(N)C(=N)C=NN1,0.1619
C1CC2C3OCOC2C13,0.33
CC12C3CN1CC2C3=O,0.2031
CNc1c(non1)CO,0.2023
Cc1ccn(n1)C,0.2589
CC12OC1C(=N)NC2=N,0.2304
CC(CO)C1CN1C,0.2962
Cn1c(c(oc1=O)N)O,0.2422
c1c(onn1)N,0.2167
CC1=COC(=N)C=C1F,0.1705
c1c(nc(o1)N)N,0.2236
CC1CC11CC2OC2C1,0.3478
C1CC(C1)OCC#N,0.2885
CN(C=O)C1(CC1)CO,0.2648
OC1=NC(O)=NC(=N)O1,0.2203
CC1COCCOC1=N,0.2822
CCC1(C)CC1(O)CO,0.2988
CC1(C)C2NC2C2CN12,0.2918
CC1(O)C2OCC12C,0.2893
COCc1c(cco1)N,0.2117
CCC(C)(CO)C#CC,0.299
CC1CC1C1(CO)CC1,0.3137
CN1CC1(C)C#N,0.2784
CC1(C)NC11CN2CC12,0.2876
N=C1CCC2NC2CO1,0.2739
N#CC1CCC2(CO2)C1,0.3063
CC1CC1(O)COC=N,0.2394
CC1(O)CNC1(C)C=O,0.2095
COC1CC11CCC1O,0.3017
N=C1CNC(=O)N1,0.2575
CC1(C)OCC1OC=N,0.2698
OC1C(C#N)C1(O)C=O,0.2118
c1c(c([nH]c1O)O)C=O,0.1735
N=C1NN=CC(=O)O1,0.1766
C(C=O)NC=NCC#N,0.217
c1cn(c(=O)[nH]1)C(=O)N,0.2082
CC(=O)n1cnoc1=O,0.2222
C1CC23NC2C=CC3O1,0.2301
CC1C2C3OC1C(=O)C23,0.2077
CC#CC1CC(C)(O)C1,0.2906
CC1=CNC(=O)CC1=O,0.1783
CN=c1[nH]c(no1)CN,0.2258
CN1C2(C)C3CC2C13C,0.2935
CCN(C)CC#N,0.2589
CCC(O)CNC(C)=O,0.2777
CCC1(CCC=C1)C=O,0.208
C1C=Cc2c1oc(=O)o2,0.1808
C1C=CC(N1)(C=O)C=O,0.1787
CC1CCC2(CO)CC12,0.3344
CC(C=O)C1CC(O)C1,0.2249
OC1CCCNC1=O,0.2644
COC1CNC(=O)C=C1,0.2063
C1C=C(C(=O)CO1)C#N,0.1713
O=C1OCC2CNC12,0.2431
CN=C1CC2(CN12)C#C,0.2379
C#CC(=NO)CCO,0.2088
OC1C2COCC1C2O,0.3066
CC12OC3(CO)C1CC23,0.3113
CCC1OCC1OC=O,0.26
C1OC2COC1CC=C2,0.2526
C1C2C3OCC4C3C4N12,0.2906
CC1N2CC(=O)C12C#N,0.2172
c1c(nc(o1)N)C(=O)N,0.2079
CC12CC(O)(C1O)C2O,0.3092
CC1C=CC2=CNC=C12,0.1991
CCC1CCC2CCC12,0.3523
O=CC1(C#C)C2CCC12,0.2147
CN1C2CC3NC3C12,0.2722
OC1CC(C#N)C1O,0.2883
COC1C2CC1OC2,0.311
OC12COCC1CC2=O,0.2174
CCCOC(=O)C(C)O,0.2704
CC12CCC1OCC2,0.3207
c1c([nH]cn1)CNC=O,0.2273
COCC1NC1CC#N,0.2975
CN1CCC2CC2C1=O,0.2558
OCC1CC1(O)CC#N,0.2856
OC1C(O)C1C=O,0.2208
CC1CC2C3CC1C23,0.3357
CC1(C(N1)(C=O)C=O)C,0.202
Cc1cn(c(n1)C=O)C,0.1771
CC1CCOC(C)(C)O1,0.3366
CCc1cc(no1)C#N,0.2235
N#CC12NC1CC21CO1,0.2622
N#CC1(CCO1)C1CN1,0.2556
CN1C2C(O)CC12C,0.2952
OCC(=O)C1C2CCC12,0.2264
C1CC23CCC(OC12)O3,0.3238
NC(=O)C1COC11CC1,0.2512
NC1=NCC(=O)CC1O,0.2066
OCC1CC(O)(C1)C=O,0.2302
OC12CC(C1)(C2)C=O,0.2233
c1c(cncc1O)C#N,0.192
OCC1C2OC(CO)C12,0.3022
CC1(CC(CO)O1)C#N,0.2746
CC1CC2NC2C1=O,0.2115
N=C1OC23CC12NCC3,0.2572
N=C1OCC11CNC=N1,0.2445
c1c(c(=O)c(no1)N)N,0.1569
OCC#CC1CC1C#N,0.2625
OC1C2CC3CC1CC23,0.3203
CC1OC2CC2C(=O)O1,0.2636
CC1CC(O)C1(C)O,0.3008
CCC1CC2(CN12)C#C,0.2528
CC1C2CC1(CC=O)C2,0.2261
CC(CO)CCNC=O,0.2833
CC1C2NC2CC1=NO,0.2504
CCC(C)COCC#C,0.2887
CC1CC=C(C)C1=O,0.1962
CCc1cc(n(n1)C)N,0.2434
C1CC(O1)C1CCOC1,0.3168
CC1CC(=O)CC(=O)N1,0.2185
C1NC2COC=NC12,0.2409
C1CC1OCC#CCO,0.2819
OC12CC1CC2,0.3309
CC1C2OC2CC1=O,0.2261
CC1C2COC3CC3N12,0.2902
Cc1c(non1)NC=N,0.2095
CCC(C#C)C1OC1C,0.3065
NC(C1CO1)C(F)(F)F,0.322
O=CC1CC(=O)CCO1,0.2085
CC1C2(O)CC(C)C12C,0.3107
CC(O)C1=CCC(=O)C1,0.2242
N=C1CC2COC(C2)O1,0.2813
CC1C(C=O)C1(C)C#N,0.2184
CC1CN2N=CN=C2O1,0.2564
c1cnn(n1)C2CC2,0.2438
c1c[nH]c(c1CC=O)O,0.1475
O=C1CCC(OC1)C#N,0.2133
N=C1OC2C3CC3C2O1,0.31
O=C1NCC2CN2C1=O,0.1971
C#CCOC1(CC1)CO,0.2824
N=CN1CCCOC1=N,0.2351
OCC1(O)COC(=N)C1,0.2856
CCC(=NO)COC,0.2528
c1cc([nH]c1)OCC=O,0.1597
O=CC1CCC=CCO1,0.2231
CCC1OC(=O)C11CC1,0.279
O=COCC1CC1C#C,0.2666
C[NH+]=C(N)C(O)C([O-])=O,0.2
C#CCc1c(c[nH]n1)O,0.2293
OCC1OC(C=O)C1O,0.2158
COC1C=CC2(O)CC12,0.238
c1c([nH]nc1NC=N)O,0.219
NC(=O)OC(CO)C#N,0.2951
N#CC1OC2C3NC1C23,0.2527
CC1CC(CC1C)C=O,0.2295
OC1C2C3OC3C12O,0.2825
CCC1(CO1)C1CCC1,0.3402
CC1CC(O)C(O1)C#C,0.2906
CC1(C)CC1OCCO,0.3189
N#CCCC1CC1C#N,0.318
CC12CC3OC1C3C2=O,0.2165
CC12C3C4N1C2C34C#N,0.2396
OC1(C=O)C2CC2C1=O,0.186
CN1C2C=CCC12C=O,0.2108
CC1C2C1C1(C)OCC21,0.3144
CCC12NC1CC2CO,0.2923
CC1CC1C1NC1C=O,0.2203
OCCC(O)C(O)C#C,0.2832
CC1=C(CC2OC12)C#C,0.196
C#Cc1cc[nH]n1,0.2274
CC12C3CC4C(CC13)C24,0.3276
NC(=O)C1(CCO)CN1,0.2673
OC(CC=O)C1CCO1,0.2284
C1CC1C1CCOCO1,0.3476
C1C2OCC3(COC3)C12,0.3049
C1NC1C1=COC=C1,0.2381
OCC1C2NC1C2O,0.3043
CC1(CC#N)CCC1O,0.3029
CC12COC1C1CC21,0.3096
CC12CC1(C)C(=O)N2,0.2522
CC12CC3OC1C2(C)O3,0.3161
CC(O)CC12CN1CC2,0.2881
CN(C=N)c1cn[nH]n1,0.2016
CC1C2NC2(C=O)C1C,0.2049
C#Cc1coc(=O)cn1,0.1543
CC(C#N)C1CC(C)C1,0.3355
OC12CC3CC1C2CO3,0.3103
Cc1c(ccnc1F)F,0.2345
CC1C2C3CN3C(=O)C12,0.2341
CC(C#N)N1CC(O)C1,0.2707
CC12CC=CC1CC=C2,0.2631
Cc1c(nn[nH]1)C#C,0.2256
C1C=C(CO1)CCO,0.2473
CC1(CC(O)C=C1)C#N,0.2547
CC1(CO1)C12CCC1N2,0.335
OC12CN3CC(OC1)C23,0.2739
c1c(coc1N)C=O,0.1615
CC1C2NC2C1CO,0.3042
CC1(CC1)C1COC=N1,0.2682
CCCC(C)C(=O)C#C,0.2042
CCC1(CCC1)C(C)O,0.3296
CNc1cccn1C=O,0.1804
N#CCC1CCC2OC12,0.3104
CC1COC(CO)C1=O,0.2142
c1c2n(nn1)CCCC2,0.2498
C1CC2COCC1CO2,0.3018
CC1C(O)CC(=O)C1O,0.2226
COCC12OC1CC2O,0.3196
CC#CC1(CC1)CCO,0.2861
CCC#CC1CC1(C)O,0.2798
CC1OC2(C)CC(O)C12,0.3009
CC(O)C1C2CC1C=C2,0.2384
CC1N=C2NC3C2C13C,0.1724
O=C1CC(=O)N2CCC12,0.1981
O=CC1NC1C#N,0.22
COC1(CCC1=O)C#C,0.1935
C#CC#CC1=NCCN1,0.1715
c1cncc(=NO)cn1,0.1572
CCC1(O)CC(C)C1O,0.3097
CC(O)CC1CC1C#N,0.3002
C1C2OC3(CCOC3)C12,0.3107
CC1CC1C1(O)CC1O,0.3102
Cc1cc(n[nH]1)C=O,0.2004
C1C=CC2C3C=CCC123,0.2225
OC1C2CNC(=O)C12,0.2578
CC1OC1C(O)CC#C,0.3037
C(CC=O)CNC=O,0.2273
ON=C1C2CCC1C2O,0.2603
OCC(O)C1CN2CC12,0.2792
CC1(CC1)c2ccn[nH]2,0.2567
COC1CC2NC2C1O,0.2977
CC(CN1CC1)C(C)=O,0.2191
CC#CCC(=O)C1CN1,0.2181
N=C(C(=O)C#N)N1CC1,0.1634
C#CC12C3OC1C1C3N21,0.2565
C#CC1COC(O1)C#N,0.2838
CC1CCC(=C1)C#C,0.2089
CC1C2C=CC11COC21,0.2263
CCc1cc([nH]n1)N,0.2438
CC1COC2COC12,0.321
C1CC11C2C3C4C2C1N34,0.3065
OCCC1(O)C(O)C1O,0.2793
CC1N2CC2(C)C1(C)O,0.2855
CC#CC#CC(=O)CO,0.1828
CC12CC(C1)OC2(C)C,0.3116
OCC1N=C2OC3C1C23,0.1618
CC1(CCC1)CCC=O,0.229
CCC1CC2(OC12)C#C,0.2627
OC1C2CC3CC1C2O3,0.3131
CC(C#N)C1CC1C#C,0.2887
CC1=CN=C(O)NC1=N,0.1893
CC1=CC=CC2CC2C1,0.185
c1cn(cn1)CCC#N,0.2422
CC#CCCOCC#C,0.2778
O=C1C2CN2C1C1CC1,0.218
Cc1c[nH]c(n1)C,0.2457
COC1=NC2(CC2)CN1,0.2621
OCC12CC1(O)CC2O,0.305
CC12C3CN1CCC2O3,0.2757
CCn1ccoc1=O,0.2358
CNc1coc(c1N)O,0.2267
CC1=CCc2c1[nH]cn2,0.1871
c1c2c(co1)OCCC2,0.2238
Cc1c[nH]c2c1cn[nH]2,0.2227
CCC12COC1CC2=O,0.2155
OC1C2C(C=O)C2C1=O,0.2065
N#CCC1CCOC=N1,0.2728
CC(=NO)CN(C)C=O,0.2406
CC1CC2(CC12)OC=O,0.2683
c1c(nc[nH]1)NC2CC2,0.2209
O=C1CC(=O)N2CC12,0.2076
CC12CN3CC(OC1)C23,0.2852
CCC1(C)CCC1(C)O,0.3205
Cc1nnc2n1cco2,0.221
OC1CC(=O)NC1C#C,0.2571
OC1CN2C1=NC=C2O,0.2277
CC1NC(=O)N(C)C1=N,0.251
N=C1OC2CC3OC2C13,0.2649
CC1OCC2NC(=O)C12,0.2737
OC12CC1CC1OC21,0.327
CCN1C2C(O)CC12C,0.2952
C1C2(N1CC#N)COC2,0.2751
CN=C1N=CON=N1,0.2238
CC1(OCC1N)C#N,0.2673
CC1C=CC(O)C11CN1,0.244
C1CN1c2n[nH]c(=O)o2,0.2429
C1OC2C=CCCCC12,0.2521
COC=O,0.2888
CC(O)C1C2CC1(C)C2,0.334
OC1C2N=COC12C#N,0.2436
O=CC1C(=O)NC11CC1,0.218
O=C1NC2COC=NC12,0.2473
CC1(CCC1)N=COC,0.2645
CC1NC(=N)C1(N)C#N,0.248
O=C(C#N)C1CC(=O)N1,0.1723
CCC1NC1C(=O)C#C,0.1941
C(C1C2CN1C2)N1CC1,0.3146
CNC12C3CN=C1OC23,0.1491
N#CC1CCCC2CC12,0.3278
CC1CC2(C)CC1C2O,0.3123
OC1C2CCN=COC12,0.2557
CC1(C)C2OCOC12C,0.3227
N=C1CC2(CN3CC23)O1,0.2707
C#CC12CC1CC1NC21,0.2794
OC1C2CC3(CC3)C12O,0.3042
CC#CC(=O)C(=O)OC,0.1711
CC1NC1C1=COC=C1,0.2372
C1CC12CNC(=O)C=C2,0.2065
OCC1CCOC1C#C,0.2879
CC12CC1CCOC2,0.3297
CN1C2CC1C2(N)C#N,0.2364
CC12OC(C)(C=C1)C=C2,0.1986
CCC1COCC1C,0.3223
c1c(c(=O)nc([nH]1)N)O,0.199
CC1C(O)C1C1CC1O,0.3107
CC1C2CC3OC2C13C,0.3228
CC(C)C1CC(O)C1=O,0.2198
CCCC12CCC1CC2,0.334
CC1=COC(=N)C(N)=N1,0.1631
CC1(OCC1=NO)C=O,0.2017
OC12COC1C1CC1C2,0.3098
CCC(C)(CCO)C#C,0.3173
CCC1=CNC(=O)C1O,0.2059
COC=NC1C2CCC12,0.2475
O=CC1C2C3CCC2N13,0.2062
COCC(C)C(F)(F)F,0.3474
N=C1CN=COCO1,0.2636
O=C1C2CC1(CC2)C#C,0.2215
Cc1c(c(c([nH]1)O)N)O,0.2065
CC1C2CCCC1C2O,0.3265
C1C2OC3C=CC2C13,0.2463
CC1C2CC1C2CO,0.3371
NC12CN3CC1(C#N)C23,0.254
CC12C(O)C1OC1CC21,0.3108
N=C1OC2CC2N2CC12,0.245
CC(O)C12CC3C(O1)C23,0.2994
O=C1CC2CC(=O)CN12,0.2124
CC1(CO)OC1(C)C#C,0.2799
c1c2c(co1)oc(n2)N,0.21
CC(=NO)C1(C)CCO1,0.2536
CCC12CC=CCC1O2,0.27
CNC(CC#N)C1CO1,0.2736
CC1CC2OC(=O)NC12,0.3131
CC12C3CC3N1C2C#N,0.2427
CCC1(CO1)C#CC#N,0.2283
Cc1c(cc(cn1)O)N,0.196
C(C#N)O,0.3039
OC1CC11OC(=O)C1O,0.2486
CCC(=O)C#N,0.2122
C1C2CCC3CC3OC12,0.3181
OCC12COC1CO2,0.2979
CC1(CO)OC2CC12O,0.299
CCCNc1ncon1,0.2207
CC(CO)C1C2CC1C2,0.3411
O=CC12CN1C(=O)NC2,0.2204
CCC12CC1(C)N1CC21,0.3085
N=C1OCC1C#CC#N,0.2346
OCC#CC1OC1C=O,0.2154
OC12CC(C1)(C2)NC=O,0.2736
CC(OCCC#C)C#N,0.2871
CC1OCC2C(C#N)C12,0.2928
CC1CCC2OCC12,0.3206
COC(C)C1(O)CCC1,0.3157
ON=C1C2CC3C2OC13,0.2459
C1CC1C12CCC1CC2,0.33
CC(C=O)C1NC1CO,0.2247
c1cc2nccnn2c1,0.1456
CC1CCC=CC11CO1,0.2514
c1c(cn[nH]c1=O)F,0.1811
O=C1C2COC1C21CC1,0.2054
CCC#CCOC(=O)C,0.2693
OCC1(CO1)C1CC1,0.3417
OC1CC2CC1CCO2,0.3034
OC1CC2OC(=O)OC12,0.3069
N=COC1C2CCOC12,0.2531
CC1CCC1C1CCC1,0.3507
O=COC1COC2CC12,0.2536
CC1C2CC11CCC1C2,0.3432
CCOC(CO)C(C)O,0.3153
CC1CC=CC2OCC12,0.2473
CN=C(C)OC(C)C#C,0.2681
CC1=CCC2NC12C,0.2493
CCC1(CC1C)N1CC1,0.3063
O=CNC1CCC11CC1,0.2774
CN1CC1C1COC=N1,0.2458
CC1CCOC(C1)C#N,0.2953
FC1=NC(=N)OC=C1,0.1795
OC1C2OC1C2O,0.3034
CCCCC(=NO)C,0.256
CC1C2OC1(C)C21CO1,0.3213
CCC1NCCOC1=N,0.2568
CC(N1CC1)C(C)(C)O,0.3215
[NH2+]=C1NC=C([N-]1)N(=O)=O,0.1672
c1(nnon1)N(=O)=O,0.2004
NC(COCC#N)C#N,0.27
CC1(O)CCC(=O)C1,0.2203
COCC(O)C1(O)CC1,0.3146
CCC12NC1CC=C2,0.2455
C1OC23CN4C(CC24)C13,0.3035
CCC1(OC1C#N)C#N,0.2852
CC1(C)C=C2CC3C2C13,0.1787
OCC1CN=C(CO)N1,0.252
CC1CC23CC(C2)C13O,0.285
OC12CCC1C2N1CC1,0.3164
CC1CC1(O)CC(N)=O,0.2515
CN1C2CC2OC2CC12,0.2902
CC#CC(C)C(N)=O,0.2691
c1cnc(cn1)NC=N,0.1764
CC1CC2OC(C)C=C12,0.2366
Cc1nc(cc(n1)O)O,0.2357
CN(C)C(=O)N(C)C,0.2767
C(C=O)c1[nH]nc(n1)O,0.1984
OC12CN3C4CC(C14)C23,0.2833
CC1OCC2(CC2)C1C,0.3244
CC(CC1CO1)C1CC1,0.3507
Cc1c[nH]c2n1nnn2,0.2238
O=C1COCCC1C#N,0.2029
CC12CC(C1)(CC2)C=O,0.2237
O=CC1CN2N=NC=C12,0.2088
CCC1=CCOC1C=O,0.2008
CC1(CNC(N)=O)CN1,0.2998
CCN1CC1CCC#C,0.2809
CC1(C)OCCC2CC12,0.3218
O=C1CC2CCN=C2N1,0.2465
OC1COCC(=O)C1O,0.2094
N=C1NN=CN1C=O,0.181
C1C2OC22CCCOC12,0.3246
CCC12CCN1C2CO,0.2997
CC1CCCN=COC1,0.2597
COC12CC3C1N3C2=N,0.2532
COC12CN3CC1(C)C23,0.2952
C#CC1OC2CCCC12,0.272
COC1C2OC2C=C1C,0.2383
CC1=CC(=O)CN2CC12,0.1673
C1C2NC22C=CC3C1C23,0.2085
N#CC12C=CC3CN1C23,0.2261
c1ncn(n1)CCC=O,0.2237
CCOC(C)C(O)CO,0.3174
CC(=O)C1COC(=N)C1,0.2255
C1c2c(non2)C(=N1)N,0.1887
O=C1CC2C3CC3C2O1,0.2783
c1cc-2cocnc2c1,0.1479
C1C2CC3C4OC3C4N12,0.2954
CC(O)COC(=N)C=O,0.1941
CC1C2OCC2C1C#C,0.2839
CC1OC11CCC11CN1,0.3008
N#CC12C3CC1C1C3N21,0.2493
COC1C2C(=O)OC12C,0.2697
COC(=O)C1CC(=O)C1,0.2267
OC1C2CC3CC=C1C23,0.2172
C#CC#CC1COC1,0.2255
OC1CC2C(CC12)C=O,0.2221
CC(C)(O)C(C#C)C#N,0.2965
CC1(OC1CC=O)C#C,0.2206
c1c(ocn1)NCCO,0.2182
OCC1C2C3C4C1C2N34,0.2962
CC(=O)Oc1ncon1,0.2556
NC12C=CN3C=NC1C23,0.1987
Cc1ccc(=O)[nH]c1,0.1746
C1NC1C1=CC2CC1O2,0.2225
OC(C=O)C1CC2OC12,0.2193
N#CC1CNC1C#N,0.2618
CC12OC3C1C1OC1C23,0.2992
C1C2OC1C21CCCO1,0.311
c1c(c([nH]c1N)O)N,0.2152
COCC(O)COC=O,0.285
Cn1c(c(nn1)C=O)N,0.2023
O=CC(CC#C)CC#N,0.2248
CC1C2C1C1CC2C1=O,0.2296
CC1(O)CN2N=CC=C12,0.263
CC12C3OC1C1(CO1)C23,0.299
c1c(c[nH]c1N)NC=O,0.203
O=C1C2CC(C=C2)C1=O,0.1482
CCC(C#N)C1(C)CC1,0.3207
CC1CCCCC=CC1,0.2586
COCC1CCCC1O,0.3129
c1cc(=O)ncnc1O,0.1731
C1OC2C=CC3C1OC23,0.2262
C1CC#CCOCC=C1,0.23
COCCC1OCC1=O,0.2244
CN1N=NC(C[NH3+])=C1[O-],0.2356
N=C1OCC1C1CC1,0.2878
Cc1ccc([nH]1)OC,0.2343
OC1=CC(=N)OC(=O)O1,0.218
CC(COC(C)=O)C=O,0.2246
OCC1(C#N)C2CN1C2,0.2568
CC(=O)C#CCC=O,0.2042
CC1=CC2(C)CN2C1=O,0.2008
O=C1CC2CC3(CC3)N12,0.2284
N#CC1N2CC2C11CO1,0.2589
NC(=[NH2+])C1CC1C([O-])=O,0.2359
CCC1(C)C2CC1C=C2,0.2363
CCCCOCC(C)O,0.3307
CCCCC1OC1(C)C,0.3445
O=CCC1(CC1)C1CO1,0.2243
OC1CC11C=CNC1=O,0.2038
OC1CN=C2OCOC12,0.2707
NC(=O)C#CCC1CN1,0.2329
C#CC12C3C4NC1C4N23,0.2455
C1CN2C3C=CC(O1)C23,0.2202
C1CC1(CC#CC=O)O,0.2021
Cn1ccc(c1OC)O,0.2266
CC1C2C1C1C2OC1=N,0.2793
CC(O)CC1=NNC=C1,0.2659
OC1COC1C(F)(F)F,0.3168
Cc1cc(oc1)C,0.2359
CN(C)c1cncnn1,0.164
CCOC12CN3C1CC23,0.3284
OCC1(O)C2OC(=N)C12,0.2618
OC1=NN(C=O)C(=N)N1,0.2035
OC1C2C3C(C#N)N2C13,0.2626
NC1=NCCOC1C#C,0.2454
CC#CC(=O)NCC=O,0.2165
CCC(C)(O)C(C)=NO,0.2549
CN1CC(=N)OCC1=O,0.2589
CCC1C(O)C1NC=O,0.2648
CCCC1CCCC1,0.3809
CC1=CCC2NC2C=C1,0.1886
c1c2c(cn[nH]2)ncn1,0.1912
COC1(C)COC(=O)C1,0.2781
O=C1CNC2CC3C2N13,0.2243
CC1C2NC2C1N1CC1,0.2913
Cc1cc([nH]c1C)NC,0.2277
CC1C(C)C(C#N)C1C,0.3235
CC1N(C)C2C3CC12O3,0.267
CC1C2CCN(C=O)C12,0.2558
CC1NC1C1(C)CO1,0.3169
COC1C2CC1N1CC21,0.3059
CC12CC1C1CC21C#N,0.2463
C1C2C1N1CC3(CO3)C21,0.2841
CC1C2CCC(C#N)C12,0.3208
CC1(C)CC2(CN2)C=C1,0.2454
CC1(CO1)C#N,0.3038
Cc1cnc2n1nno2,0.1754
N#CC12C3CN4C(C13)C24,0.2607
CC(O)C1CC(=O)N1C,0.2805
[O-]C(=O)CC(=[NH2+])N1CC1,0.2416
ON=C1C2CC(C2)C1O,0.2584
C1C2C3C4CC=C(C13)C24,0.171
CN=C(N)C(=O)C1CN1,0.1831
CCC(C)C1=CNC=N1,0.2529
CC1OC1C(=O)C1CC1,0.2184
CNC(=O)C(C)OC,0.2756
CC1CN2C3C4CC13C24,0.2947
CC(C)C1OC1C1CO1,0.3317
CCC12CC1CC(=N)O2,0.2719
C1CN1C1CCC2NC12,0.2878
CC1C2OC(C3CC3)C12,0.3137
CN1CC1CC(O)C#C,0.2529
CC1=CC2CCC1O2,0.2533
COCCCC1CN1C,0.3043
CC1=C(C)C2CC1C2=O,0.2329
OC1C2C=CC1C2C#C,0.2299
CN=C1OC=C(N)C=N1,0.1446
OCC1OC2CC1C2=O,0.2083
N#CC1(CC2NC12)C#N,0.2621
C1CC2(C1)CN2C=O,0.2515
CC(O)CC(=O)C#N,0.2005
CC12CC1CC2NC=O,0.279
CC#CC12NC1CC2=O,0.2104
CC12CCCC1(N2)C#N,0.2896
N#CC1NC2(CC12)C#N,0.2361
CC#CC#CC#CC,0.1848
CNC1(C#N)C2CC1O2,0.2712
OC1COC=NC11CC1,0.2562
CC1=CCOCCC1O,0.2448
CC1C2OC1(CO)C2C,0.3202
CC(C1CC[NH2+]1)C([O-])=O,0.2755
CC1(O)CC(C)(CO)C1,0.318
CC(CCCO)C(N)=O,0.2769
COC1(CC1CO)C#N,0.2835
C1C2N=C3OCCC3C12,0.2501
CN(C=N)c1nnon1,0.1794
C(CC#N)CC(=O)CO,0.2355
CCC12CN1CC21CO1,0.3137
CCOC1OCCC1C,0.3393
CNC1(C)COC1=N,0.256
CC12NC1CC2(C)C,0.2993
NC1=CC=CC(=N)O1,0.1637
CC12NC1CNCC2=O,0.1985
CC1(C)CC11OC2CC12,0.3043
CC(CCC#N)OC=N,0.2845
CC12C3C1C1(C)C3C21O,0.2761
CC1CC(=O)C2(O)CC12,0.2212
NC1=NNC=C1C1CO1,0.2303
C1OC11CN2CC12,0.3132
CC1C2CCC1(C)C2O,0.3312
CCC1=CCOC=NC1,0.2311
CC1=NC(=N)OC(=O)N1,0.2147
C1CC=C(C1)CC(=O)N,0.2448
OC1=NC(F)=CC(=N)O1,0.1918
CCC1C2COC1CO2,0.3206
Cc1cnc(nc1)N,0.1924
O=CC12NC3CC1OC23,0.2035
CC1CCN=C(O1)C#N,0.2309
CCCOc1c[nH]nc1,0.2325
c1conc1C2CCC2,0.2534
C#CC1(CCC=C1)C#C,0.2576
CC1OC2CC(=O)NC12,0.2728
C1OC1C1=CNN=C1,0.2528
CC1C2C3OC1(C)OC23,0.3183
COCCOC(=N)OC,0.3135
CC(=O)C1(CCN1)C=O,0.194
CC1=CC2(C)CC3C1N23,0.2206
CCC(CO)C(F)(F)F,0.3548
CC1CC2N=CNC2=N1,0.2289
CC(C)C1OC2CC2O1,0.3368
CC1CC=C(C1)NC=O,0.2112
c1cc([nH]c1)C(=O)N,0.2033
FC1=NC(F)=NC(=O)O1,0.2189
ON=C1CC2CC2C1O,0.2523
c1c(c(on1)N)C2CC2,0.224
C1CC1C1C2C3OC3C12,0.2861
CCC12OC1C(O)C=C2,0.2395
COC1=CC=COC1=N,0.1682
C1C2CC3C=CC1N23,0.2203
OCC1=CCC(C1)C#N,0.2601
COC12CCC(C1)C=C2,0.2577
CC12OC(=N)C1C1CC21,0.2798
CCCC1C2CCOC12,0.3179
CC1(C)OC2C(O)CC12,0.3088
O=C1OCC2CN3C2C13,0.2466
c1c(c(c[nH]1)C#N)C=O,0.1986
COC1CC1C(=O)OC,0.2635
FC1=C(F)C(=N)NC=N1,0.1783
CC12CC(OC1)C2C=O,0.2089
OCC12CC(C1)OC2=O,0.2718
C1C2C=CCC3CC12C3,0.2533
CC1C=C2CC3N1C23C,0.1657
C1CC(=O)C2(C1)COC2,0.2159
COC1C(C)C(O)C1=O,0.2032
CC1OC2CC3COC123,0.3021
C(CC(=O)C=O)CO,0.1565
CC1N=CN(C)C1=N,0.2217
CC1NC1(C#N)C1CN1,0.2827
CN1CC2C1C2(N)C#N,0.245
OC1C(OC1=N)C#C,0.2699
CCOC(=N)C1CC1O,0.2763
OC1C2OC2C1O,0.3005
N=C1CCNC(=O)N1,0.2571
C1OC2CC3CC12O3,0.3017
C#CC12CCN1C=NC2,0.2406
CC1(C)C2CCOCC12,0.3201
CCC1CC11CC(=N)O1,0.2753
OCCC12C3CC1CC23,0.3161
C1OC2C3CC1C2C=C3,0.2497
CC(O)(C#C)C#CCO,0.2698
O=CC12OCC1CC=C2,0.2063
CC1C2COC11COC21,0.2868
CC12CCC(C#N)C1O2,0.3085
O=C1CCC(C=C1)C#N,0.1855
O=CC1CCC1C#N,0.2182
CC1(CN=CO1)C1CN1,0.2624
CC1C2CNC(=O)C1O2,0.2468
NC1=C(ON=C1)C1CO1,0.1995
O=C1NC2C3COC3C12,0.2713
O=CN1C2CC1(C2)C#N,0.2388
C1OC2CCCC3OC123,0.3236
CCCC1C2CC1C2=O,0.2513
C1C=CCN=C(N1)C=O,0.1769
OC1CC1C1CCC1=O,0.2185
CC1C2OC2C(=O)N1C,0.2475
CC(O)(CC#N)C1CC1,0.3099
OCC1(O)C2CCC1O2,0.2939
CC12CC3CCC(O1)C23,0.3119
CC1C23CCOC12CO3,0.2757
CC(C)C1OCC11CC1,0.3127
OCCC1CCN1C=O,0.2638
O=CN1CC2CC3C2C13,0.2585
N#CCC1C=CC2NC12,0.2447
CCOC12COC1C2O,0.2839
CNc1c(oc(n1)N)N,0.2127
CC1CC2NC12CC#C,0.272
OC12CC3OC1(C#N)C23,0.2362
COCC1CC(=O)CN1,0.2104
CCC1OC(=O)C1(C)C,0.2804
CC1C2C1C(C#C)C2C,0.2953
C1CC=CC(=CC1)CO,0.2061
CN=C(C#C)NC(=O)N,0.2063
CCNC(=O)N1CC1C,0.2908
CC#CC1NC1C1CO1,0.2744
CCC1CC2(NC12)C#C,0.2536
OC1C=CC2CC12,0.2419
NC1=CC(=N)ON=N1,0.1467
CC1C(=O)CNC1=O,0.2102
COc1cccnc1N,0.1954
CCC1CC1C(O)C#C,0.2945
CC(C)n1cnnn1,0.2693
CC1NCCNC1=O,0.2589
O=C1CC(CCC#N)O1,0.2865
CCC(=O)C12CC1CC2,0.2264
O=C1C2NC2C1CC#N,0.2177
CC1(C)C=CC(O)C1O,0.2589
CN(CCC#N)CCO,0.2727
CC12C3C4C3C1(C#C)C24,0.2451
Cn1cc(cn1)CCO,0.2533
CC12CN1C=NCC2=O,0.2
C1C2C3CC2C13,0.3958
CC12OC3CC1C23C#N,0.2601
N=C1OCC2=C1N=CN2,0.2278
Cc1c2c(nco2)on1,0.209
CNC(=O)C(=N)NC=N,0.2069
CC1CNC(=O)C11CN1,0.2576
CC1=C(C)C(=O)NN=N1,0.1798
CNC(=O)C1CC2CC12,0.2693
Cn1ccnc1CC#N,0.241
CC1C2CC1(CO)C2=O,0.2482
CC1CC2(C)NC12C#N,0.2555
CC1CCC=CCC1,0.2584
COC1C2C3C4C2C1N34,0.3016
CC12NC1C(C=O)C=C2,0.2066
CCC12CC1NC(=O)O2,0.2984
N=C(OC(=O)C#C)C#N,0.2188
CCNc1c(nn[nH]1)C,0.2229
CC(CCCC#N)C#N,0.3444
CC1OCCNC1C#N,0.2585
CC1C(N)C(=O)NC1=O,0.2287
CC(O)C(=O)NCC=O,0.2192
N#CC1CCN1,0.267
O=CCC1C2CC1CC2,0.2274
c1c(ncn1C=O)O,0.1718
OC12COC1C2OC=N,0.2692
OCCNC(=O)OC=N,0.2713
CC12NC1C1C(O)C21C,0.2784
COCC(C=O)C#N,0.2206
CC12CC(C)(C1)COC2,0.3252
CN1CC1C#CCO,0.2482
CC12CC3C1C3(O)C2=O,0.2359
CCC1C2NC2C1CO,0.3034
CC12OC(=N)C1C2C#N,0.2665
CCOC(=O)CC(=O)N,0.2436
CC12CC1C(=O)C1CN21,0.2114
OC1CNC1=NC1CC1,0.2424
C1CC(=O)C(=C1)C2CC2,0.1985
CC(CO)(CC#N)C=O,0.2195
OC1CC1C1(CC1)C#C,0.2629
CCc1cc[nH]n1,0.2674
C#CC1=CCC2CCC12,0.2093
N=C1OCC11COC1,0.2702
CC12COC1C1NC21,0.2921
CC12OC=NC1C1CC21,0.2673
C1CN1C(CO)CO,0.3012
CC1(CO)OCC1C=O,0.2169
CC1=C(F)N=CC(=N)O1,0.1443
CN1CC2(O)CC12C,0.2793
c1c(non1)OCC=O,0.2288
CCC(C#N)C(=O)C#C,0.2055
C1C2CC3C=CC2OC13,0.2398
CC1(C)CC(=O)C11CN1,0.2063
CN1C2CC1C1OC21,0.2851
CCOC(C)C(=O)C=O,0.1521
C1OC2OC=NC2C=C1,0.2472
O=CC1CC(O1)C#N,0.2196
CCC(C=O)C1CCC1,0.224
OC12CC1C1CC(C2)O1,0.3114
COC(C)C1=CNC=N1,0.2526
CC1N(C=O)C1(C)C#N,0.2525
CCc1c(onn1)C=O,0.1864
C1C2C=CC3CC2C13,0.2491
O=C1CC2(CC3CN23)C1,0.2162
N#CC1C2CC3OC3C12,0.2971
COC1CN2C=CN=C12,0.252
c1c2c(on1)OCCN2,0.2152
CC1C(CO)C1CC#C,0.3091
Cn1cccc1NC=O,0.2133
Cn1c(cc(n1)N)O,0.2441
COC(=[NH2+])NCC([O-])=O,0.2727
CC1(C)C2CN1C2C=O,0.2097
c1c([nH]cn1)CCC=O,0.194
N=C1OC2C(OC=O)C12,0.269
CC1COC(=O)OC1,0.3191
CCC12CCN1CC2=O,0.2034
[NH3+]C1(CC1)C1=N[N-]N=N1,0.2661
c1c2c([nH]n1)C=CC2,0.192
c1c2c(c(o1)N)CCO2,0.2208
c1ccn(c1)CC(=O)N,0.2154
C1C2OC3OC(C=C3)C12,0.2357
C#CCC(=O)OCC#C,0.2731
C#Cc1c(oc(=O)[nH]1)N,0.1882
C1OC2CC3N=COC123,0.2545
OC1CCN(C=O)C=C1,0.2101
CC1(CCO1)C(=O)C#C,0.1838
C#CC#CCCC=O,0.2118
CC(C)(C=O)C#CC#C,0.2012
CNc1c(nco1)CO,0.2104
C(C#N)c1nc(no1)N,0.2209
CC1OCC11CC1(C)C,0.3096
C1C2CC1C1C3CC1C23,0.3667
CC12COC(C)(O1)C=C2,0.2461
OCC1C2OC3CN1C23,0.2672
C(CN1CC1)C1CCO1,0.3163
CC1CC2=C(O1)N=CN2,0.214
OC(CN1CC1)C1CN1,0.3017
NC1CC1(C#N)C(N)=O,0.2532
CC12CC1(CO)C(=O)C2,0.2309
COC(C#C)(C#C)C#N,0.2591
NC(=O)C1C2CC(=O)N12,0.2265
c1c(c(c(=O)on1)O)N,0.1642
OCC12C3CC1CC23,0.3011
N#CC12C3CN1CC23,0.2516
CC1CN2C(CCO)C12,0.2997
CC12CCC(O1)C2C#C,0.2945
N#CC1CC2CC1CO2,0.2852
OCC1OC2(CC12)C#N,0.2563
O=C1OCC2(OC12)C#N,0.2424
CCN(C)CC(N)C#N,0.26
CC1C2CC(=O)OC12,0.2799
OC1CC(O)C1OC=N,0.268
COC1C(=O)C2NC12C,0.1983
CCC1(CC1C)OC,0.3242
CN=C1CN=C(N1)CN,0.2247
OC1CC2C(OC12)C#C,0.2722
OCC#CC(O)CC#N,0.2836
CCN=COCC1CO1,0.2715
C1c2c([nH]nn2)NC=N1,0.2054
CCn1cnc(=O)cn1,0.1821
CC1(C)CC2CC2C1,0.3446
C1COCCOCCO1,0.3127
C#CC12CC1C(C2)C#N,0.2633
CC1C=CC2(O)CC12C,0.2433
CC(C)CNC(=O)C#C,0.2313
CCC(O)CC(=O)C=O,0.1541
Cc1c[nH]nc1C2CC2,0.246
CN1C2CCNC(=O)C12,0.2426
CN1C2CCCC(=O)C12,0.2096
OC1(C#N)C2C3OC1C23,0.2766
CC1COCCC(=O)C1,0.2239
c1coc(n1)NC=O,0.2117
CC12CC=C3CC1(O)C23,0.1768
CNC(C)C(NC)C#N,0.2564
O=C1C2C3C4CN(C24)C13,0.2167
CCc1c(=O)ncon1,0.1883
CC1COC1=N,0.2899
CCN=C(C(F)(F)F)N,0.2512
O=CC1CC2(COC2)N1,0.2039
COC1C2CC1C21CO1,0.3416
C1CN=COC1=O,0.2506
COCC1(CC=O)CO1,0.2236
O=CC1C2CC1(N2)C=O,0.1936
CN1C2CC=C(C#N)C12,0.1914
C1OC2=NCCC3OC123,0.2504
OC1CCCC1CC#N,0.3213
CN(C)c1c(nco1)N,0.2104
C#CC12CC1N=COC2,0.2368
CN(C1CC1)C(=O)N,0.278
CCC1OCC11CN1,0.3075
COC12CCC1(C)C2O,0.3042
CCC12CC1(O)C(C)O2,0.2946
C1C(=O)C(O1)(C=O)C=O,0.1921
CC1C(O)C2(C)COC12,0.305
CC12CN1C(=NC2)C#N,0.2025
N=COCC1=CN=CN1,0.2407
CCC1(C)C2COCC12,0.3239
CCC1(O)CN2CC12,0.2899
CC1C2OC=NC12C,0.2557
COc1c[nH]c(n1)C#C,0.1811
CCC(OC)C1CCO1,0.3171
CC1(CC1)C1CC(=O)O1,0.2838
CCC1(C)C2CCOC12,0.3145
CCC1CCN=CO1,0.2733
C1NC11CC2COC1C2,0.3145
CCC1(C)COC(=N)O1,0.3078
O=C1CCC2CC(C1)O2,0.2282
CCC12CNC1C(=N)O2,0.2534
c1(=O)c(=O)onc(o1)F,0.1998
C1CC(O1)C1=NNN=C1,0.2441
CC1OC23CCC2OC13,0.2833
O=CC12CN1C1COC21,0.1971
NC(=O)C(CO)N1CC1,0.2675
Cc1cc(oc(=O)c1)O,0.1775
CC1CNC(=N1)C(C)=O,0.1702
CC1COC2=C1NC=N2,0.2135
CN(C)c1nc(no1)N,0.239
CCn1cnc(n1)O,0.2444
NC(=O)C1OC1CC=O,0.2235
C#CC(C#C)C1(CC1)O,0.279
OC1COC2C1OC2=N,0.2719
Cc1cn[nH]c1NC=O,0.2024
COC1C2C=CCC12O,0.2405
CC1OC23CN4C2C1C34,0.3152
N#CC1(CN1)C1CN1,0.2585
COC1CC2(C)CC12,0.3277
CC12OC1(C#N)C1OC21,0.2615
CC12CC(O)(C=C1)C2O,0.2366
N=C1CN=C(CC#C)N1,0.2309
NC(=O)C1(O)CCC1O,0.26
CC12C3C(O)C1C3C2=O,0.248
N#CC12CC1(CC2)C#N,0.2592
COCC1OCC=C1C,0.2515
N1C2C3C1C1N=CN3C21,0.2174
CC#CC1(CO)CC1C,0.2819
ON=C1CC2CN3C2C13,0.2263
CCOc1ccc(o1)C,0.2245
O=CC12CN1CC1NC21,0.201
CCC12CCC1(C)C2O,0.2895
C1C2OC3C=C1C1C2C31,0.1767
c1c(cncn1)CCO,0.2099
CCN(CC)C(=O)C=O,0.1744
CC(C)(C)C(C=O)C=O,0.1938
CCC(CCC=O)C#N,0.2283
CC(C)(O)CC1CC1O,0.3181
CC(CO)C(=O)CCO,0.2301
CC#CC(CO)CO,0.2974
CC(C)C1(C)C2CC1C2,0.3612
CC12CN3C1CC23C#C,0.2544
c1c2c([nH]n1)CNC2=O,0.2427
C1OC11CCC2CCC12,0.3264
CC12C3CC1CC23O,0.3108
C1C2C3N=C4OCC13C24,0.1845
OCC12CC1OC2,0.3025
N=C1OC2CC2O1,0.301
NC(=O)C1CC(C1)C#N,0.2676
N=C1N=COC=CC1=O,0.1842
CC(C#C)C(=O)CC#N,0.2246
CC12OCC1C(O)C=C2,0.2445
CCOC12CCC1C2O,0.3129
CCOc1ccncc1,0.2372
CC(=O)C12C3CC1OC23,0.2168
C1C2C3OCC4C(C23)N14,0.2977
OC1CCCC2OC12,0.3398
CC1CC2C3CC1(C)C23,0.3302
O=C1CCN2CC2C=C1,0.1813
CC1CC23NC4C2OC134,0.2678
CCC(C#C)C#CC=O,0.2044
CC(O)C1(CC1)C1CN1,0.3019
CC(C=O)C(=O)C1CO1,0.1957
CC12CC(O)(CO1)C2=O,0.203
COC1C([NH3+])C1C([O-])=O,0.2713
CCC1(CN=CO1)C#N,0.271
CC(=N)NC(=O)C=O,0.1726
C1OC1C1=NC=CC=C1,0.2253
COC12CC3(O)C1OC23,0.292
OC12C3C1C1NC3C21O,0.2866
Cc1c(=O)oc(cn1)F,0.1699
CC1(O)CC2CC12O,0.2878
CC1C2NC2C11CCO1,0.2984
CCC1OCC2NC12,0.3115
c1nc(on1)C2COC2,0.2278
CCC1NC1C=O,0.2219
C#CC12CCC1(O2)C#N,0.2386
OC12C3C4C1C4(O)C23,0.2908
CC1NC11C(C)CC1O,0.3054
CC1CC(O)C1C#C,0.2916
[NH3+]CC[N-]C(=O)C#N,0.2284
CC12CC1C=CCCC2,0.2497
C1CC2COCC3C1C23,0.3133
C1CC2CCC1CC=C2,0.2612
CC1(O)C2CCCC12O,0.2828
COC(C)C1(O)COC1,0.3132
CC1(C)C=CC2OC12,0.2468
CC12CN3C1C2CC3=O,0.2315
CC(C#C)C1=NOC=C1,0.252
CC1C(NC=O)C1C#N,0.2691
C1CC23CC=CC2C3O1,0.2323
O=C(C#CC#N)C1CN1,0.1659
CCC(NCC=O)C#N,0.224
CCN1C(CO)C1C#N,0.2556
CC1OC1C1=CNC=C1,0.2456
CC1CNCC(=O)C=C1,0.1616
CCCOCC(F)(F)F,0.3492
CC1(CC1)C(C#C)C#C,0.2933
CC1=C2C(O)CC2OC1,0.233
N=C1ON=C2NCCN12,0.2472
CC1C2COC12,0.3148
CC1(O)CC2(OC12)C#C,0.2647
CC1OC2C(O)C2O1,0.3036
CCC12OC1C(=O)C=C2,0.1719
C1C2C3C2N2C4C2C3C14,0.3178
CC1C2CC3CC3CC12,0.3368
CC1NC1C1OC1C#C,0.2684
CC1(CCC(=NO)C1)C,0.2513
C1NC11C2CN3C2CC13,0.3036
OC1(C#C)C2OC1C2=O,0.2315
C1CC2=CCC3NC23C1,0.2363
C(C1CN1)C1=NNN=N1,0.2061
CN1CCc2c1con2,0.1998
COC1OCC2(O)CC12,0.3275
CC1OC11CC(C)(O)C1,0.3174
C#CCc1nnon1,0.2096
CC1CC11CCCC1O,0.3172
CC1(C)OC1C(O)C=O,0.2278
CC(O)C12OC3C1OC23,0.2865
O=CC1(COC1=O)C#N,0.219
CC12OC3(C)CCC1C23,0.3069
C1C2OC1C21CCCC1,0.3124
O=CNCC1(CO1)C=O,0.1985
C#CC1=CC=CCCC1,0.1614
CC(C)C(C#C)C(C)O,0.3026
C(C1CN1)C1=NNC=N1,0.2418
CC12C(O)C1COC2=O,0.2571
CC12CC(CC=O)(C1)C2,0.2262
N=C1N=CC=NC=N1,0.1525
CC1CCC1(CO)C#N,0.3031
CCC1(CNC=O)CO1,0.2821
CCCC1C(O)C1OC,0.2931
CC(=NO)C1=NCCO1,0.2022
CC(C)(O)C1C2CCC12,0.3016
Cc1c(onn1)N(=O)=O,0.1851
CCC1OC=NC1CC,0.2674
C1NC11C2C3C1N=CN23,0.2246
CC1(O)COC(=N)C=C1,0.2087
N=C1OC=C(O1)C=O,0.1712
CC(=O)C(C)(O)C1CN1,0.2204
OCC12CC3OC1C3O2,0.3039
O=C(CN1CC1)C1NC1,0.189
C#CC#CC(=O)C#N,0.1648
CC1(CCCC1)CC#N,0.3426
CC1OC2COCOC12,0.3323
CC1NC11C=CC2OC12,0.2355
CCC(=NCCO)OC,0.2535
CC1C2(C)C3CC2C13O,0.3207
C1CN1C(=O)OCC#N,0.2787
CC1C2C3C4C=CC13N24,0.2116
Cc1[nH]c2c(n1)ocn2,0.2017
CCc1c(nco1)C,0.2375
CC(C#C)C#CCC#C,0.2836
C1CC11OC2CCC2=C1,0.2152
N=C1CCCC2(CC2)O1,0.2688
CC12CC3C1C2C3C#C,0.2984
CC(C)C1OC1CCO,0.3277
OC(C#C)C1CO1,0.2845
CC1=CC(=O)CCC=C1,0.1713
CC12OC(C=C1)C2=O,0.2444
O=C1CN2CC12C#C,0.2175
CN=C1OCC(C)C=C1,0.2075
N#CCC12CN(C1)C2,0.2716
O=C1CC2(CC#N)OC12,0.217
CC1CCC=C(C)C1=O,0.1898
CC(C#C)C(C)C#C,0.3015
O=CC1C2C3C=CC1N23,0.1913
O=C1CN2CC2C11CN1,0.1968
c1(c(nn[nH]1)O)N,0.2215
CCCCC1(CO)CN1,0.312
CC12C3C1N1CC3N=C21,0.1201
CCC1(O)CCC=CC1,0.2686
CC1OCC2C3CN2C13,0.3177
CNc1c(nnn1C)N,0.2083
O=C1NCC2OC2C1=O,0.1775
OC1C2C3OC3CC12O,0.2944
C#CCc1conn1,0.2305
OC12C3CC1OCCC23,0.308
CC(CNC(N)=O)C#C,0.2949
CC#CC1NC11CCC1,0.2707
OCC12OC1C1(O)CC21,0.2877
C#CC#CC1CO1,0.2159
CCC(C)C(C)(C)C=O,0.228
CC1N2CC(O)C12C#N,0.2527
CC1OC2C3C4CC13C24,0.3237
N=C(OC(=O)C#C)C#C,0.2201
CC12C(O)C1COC2=N,0.266
NC(=[NH2+])C([O-])=O,0.1973
COC1C2C3N2CC=C13,0.1671
OC1C2C3COC2C13,0.312
CC1=C2CC3C(C1)C23,0.1738
COc1[nH]cc(n1)N,0.2329
Cc1cn(c(=O)o1)C=O,0.2018
COC1(CC1)C#CC=O,0.1991
COC(C#N)C(O)C#N,0.3038
CC(C#N)C(=O)NC=N,0.2392
CC1CC2(CN3CC23)O1,0.3045
CC1CN1CC#CC=O,0.185
CC1CCC2(O)CC1C2,0.3257
COCC(C)(C)C(C)O,0.3197
Cn1nc(c(n1)O)CO,0.2258
COC1CN2CC12C#C,0.2527
C1CC1(C(=O)N)NC=O,0.2439
CCOc1cn(cn1)C,0.2243
CCC(O)C(C)NC=O,0.2817
CC1(C)N=COC1C#C,0.2691
CC1CC11CCN1C=O,0.2508
CCC#CCC#CCC,0.2818
CC1=CCCOC1,0.2624
C1C2CC3(C4COC34)N12,0.291
CC(O)CC1COC1C,0.2995
CCN1C(C)C1CC=O,0.197
CC1C2CC1(O)CO2,0.2969
C1C2CC3OC=NCC123,0.2775
CC1(CC1)CC(=O)N,0.2701
CC1CC(O)C2OC12C,0.3271
CC1(C)CC11OCC1=O,0.2127
OCCC1CCC1O,0.3302
CCC(=O)C12CC1CO2,0.2186
Cc1cc(no1)CC#C,0.2453
N#CC1NC2CC2C=C1,0.2222
CC(C)N1C2C3NC3C12,0.263
C1C2OC3OC1C2C=C3,0.2446
CC#CCN(C)CC=O,0.2027
CC(C)CCC(=O)NC,0.2794
CCC(C)(C)CC1CC1,0.3441
CC1C2CC=CC1C2O,0.2483
CCC1OCCC2OC12,0.3376
OCC1(CN1)C(=O)C#C,0.1886
OC1(CCC11CO1)C#N,0.2792
Cc1c([nH]nn1)CO,0.2453
CC1CCCOC1=O,0.2689
OC12CC1CC=CCC2,0.2594
COCC1(CC1)OC=O,0.2801
C1C2CN3N=CN=C3C12,0.2551
O=CNC12CC(C1)C2=O,0.2561
CCc1c([nH]nc1N)N,0.2342
CCC12CC1C(C)C2,0.3305
C1CN1C12C3CC1CC23,0.3133
C1C2OCC3OC=NC123,0.2461
COCC1NC1C1CC1,0.3159
CC(=O)C1COC1C=O,0.2016
O=C1CCC(CC#N)C1,0.2233
CC#CCCCC1CO1,0.3028
CCN1C(C=O)C1C=O,0.1829
CC1COCC=C1C,0.2597
CC(C)CC1CCC=C1,0.2627
CC12CC1C1C(CO)N21,0.2804
CCCc1ccnn1C,0.255
CCC12CC1C=CC2=O,0.1853
CC1(C)CC=CC2OC12,0.2401
CC12C3C4C3C1OCC24,0.3261
CC1=NC(=NN1)C1CN1,0.2337
COC1C(C)C1(C)C#N,0.2892
CN1CC(=O)NC1=N,0.2262
OC(C#N)C1(O)CCC1,0.3098
CCN1C2CC3(CC3)C12,0.317
CC(C=O)C1(CN1)C=O,0.204
CCC1C2(C)CC1(C)O2,0.3075
CC12OC3CC(=O)C1C23,0.2229
OC1CCOC1C1CN1,0.3192
CC12CC1CC21COC1,0.3159
N#CCN1CC2CCC12,0.2537
OCC12CC1(O)C(O)C2,0.2869
CC1C2N=CNC12C#N,0.236
OCC12COCC1CO2,0.3105
O=CN1C2CCC1C2=O,0.228
CC12OC1(CC2=O)C#N,0.2121
OC12CN3CC(CC1)C23,0.2769
CC1(C)C(OC1=O)C=O,0.2223
OC12CC1(CC=O)CC2,0.218
CCC(C)(OC)C1CC1,0.325
CC1(O)CC11CN2CC12,0.2908
CC1C(O)C11CC2NC12,0.2922
CNC1C2CC1(O2)C#N,0.2326
ON=C1C2CCC1C=C2,0.2495
CNc1c[nH]c(n1)NC,0.2244
CC1CCOCC2NC12,0.3106
OC1CC1C(=O)NC=O,0.2092
CC1CCCC=C1C#C,0.2113
C1CC2(C1)C1C3OC3C21,0.2771
CCC12OC1C1C2N1C,0.267
OC1CC2(C1)CCC=C2,0.2559
CCC12CC3C(N13)C2=O,0.232
CC1=CC(O)CC1=O,0.1917
CC1=CC2C3CN2C13C,0.2108
O=C1NC2C3C4C3C1C24,0.2528
c1cc(cc(c1)F)F,0.2339
CC1=CC2OC1(C)C2O,0.2349
CC1CCCC1O,0.3287
COC1C2CC2CC1O,0.32
CCC1NC11COC1=O,0.2659
C1OC2CN=COCC12,0.255
CC1C2CC2C=CC1O,0.2379
CN1C2CC11COC1C2,0.2932
CC12CC3COC3C1O2,0.3025
c1(c(nno1)N)C(=O)N,0.1679
CC(C1CC1O)C(C)=O,0.2296
CCc1cc(cnc1)C,0.2247
CC1C2OCOC(C)C12,0.3242
CC12CCC3OCC1C23,0.3206
CC1COC(CO)=N1,0.2748
CCN1C2CC2(O)C1C,0.2737
C1CC12C(=O)C=CN2,0.1867
CC1(O)CN2CC12,0.297
CC#CC(O)C#CC#N,0.2219
Cn1c(cnc1C#N)O,0.1968
O=CC1CCCC2CC12,0.2218
CC12CC1NC(=O)C2=O,0.1718
CC(C)C1(C)CC(=N)O1,0.2876
NC1=NCCOC1C=O,0.1844
COC1C(OC)C1(C)C,0.2899
ON=C1CC=CC1C#N,0.2461
CC1C(OC1C#N)C#C,0.2586
CC#CC1(C)NC1C#N,0.262
CC1(NC2COC12)C#C,0.2663
CC(N)(C#N)C1(C)CC1,0.3027
CC1CC(=O)C1CC#C,0.2182
O=CC(=O)C1OC1C#C,0.1501
CCC(CC)(C#N)C#N,0.3218
COC12CC1C(=O)C2O,0.215
O=CN1CC2OCCC12,0.2664
C1C2CC3=CCOC3C12,0.2468
CCC12CCOC1C2C,0.3133
Cc1c(c[nH]n1)NC=N,0.2192
OCC12C3C1N1CC2C31,0.2734
CCC12CC3C(OC1)C23,0.3054
COCCC1(CCC1)O,0.3223
CC1CC2(C)CC12CO,0.3155
[O-]C(=O)C1CC2CC1[NH2+]2,0.2742
CC1OCOC1(C)C#N,0.2958
C#CCCN=CNC=O,0.2257
C1CC1c2[nH]nc(n2)O,0.2397
OC12CC(O)(C1)CCC2,0.3232
CNc1ccc(nc1)N,0.1705
OCC1CC23CN(C2)C13,0.2589
N=C1OC2CNC2=C1,0.196
COCC(C)C(=O)C=O,0.1546
N#CC1CC2=NC=CN12,0.2273
OCCN1C2C3OC2C13,0.2856
Cc1cc(c(cn1)F)F,0.2276
CCC1(CN1)C1NC1C,0.3117
FC(F)(F)C1CCC=C1,0.2657
OC1CCOC(=O)CC1,0.275
Cc1cc(=O)onc1,0.1855
N=C1CC=CNC(=O)N1,0.231
COC1(C)CC1C1CO1,0.3315
N=C1N=COC=NC1=O,0.193
CC1CC(CC2CO2)C1,0.351
CC1C2COC(=N)C12C,0.2792
CC1=CNC(=N)C1=O,0.1498
c1nn(c(=O)o1)C=O,0.2264
C#CCC1(CN1)C1CN1,0.276
OC12COC11CCC1C2,0.2853
NC(=O)C(CC#C)C#C,0.2618
CC1(CN(C1)CC=O)O,0.2058
NC1=NC=C(N)C(=N)O1,0.1619
c1c(nc(c(n1)N)F)O,0.1691
CCCC1(CN1C)C#C,0.2734
c1nncn1C(=O)N,0.2296
CC1OCCCCC=C1,0.2525
CC1CC(CC(C)=O)C1,0.2331
CC1(CCC=CC=C1)C,0.1921
CC(C1COC1)N1CC1,0.3153
CC12C3CCN=C1OC23,0.2014
N#CC1CNCCOC1,0.2641
N#CC1CC2OCCC12,0.2862
NC1C(C#N)C11CCO1,0.2513
Cn1nc2c(n1)ocn2,0.2115
CC12CCCC1(O2)C#N,0.2861
C1CN1C1C2CCC12,0.3225
CC12CC1CC1(CO1)C2,0.3391
CCC12CN1CC2C#N,0.2733
NC1=NNC=C(F)C1=N,0.1681
CC#CCC1CC1CO,0.3015
CC(CO)C1(CN1)C#N,0.2873
C(C=O)Oc1nnon1,0.2059
COC1CC2(C)CC1C2,0.3324
CC1NC(=O)C11COC1,0.2696
CC#CC(O)C#CC#C,0.2183
C#CCC(C#N)C1CO1,0.3002
COC1CN=C(N)C1=O,0.1665
C#Cc1c(con1)N,0.1882
OC1(CC2OCC12)C=O,0.2068
CC1=CC2CC1C2=O,0.2411
c1c(c(n[nH]1)C2CC2)O,0.2318
CC1C2CC2CC1C=O,0.221
C#CC1(CC=CC1)C#N,0.2635
CCc1cc(n(c1)C)C,0.2399
C1OC2C3NC3CCC12,0.3023
CC1C2CC2(C#N)C1C,0.2889
C1CC11CC2=CCCC12,0.2447
OC1C2CC(O)CC1O2,0.2992
C#CC1NC11CC2NC12,0.2682
CC1OC(=O)C1(C)C#C,0.2622
CC1OC11CC2CC1C2,0.3449
CC(O)CN1CC1,0.2995
OC1CC(O)CC(O)C1,0.3341
CC1C2C=CC1C2O,0.2405
C#CC12CN1CC2C#N,0.2522
CCCC1(COC1)O,0.3121
CC(=O)CN=C(CO)N,0.2048
CC1C(C)N1C,0.293
C(=O)c1c(non1)C#N,0.1836
CC1(O)CC(C#C)C1=O,0.1979
COCC1CC1(C)CO,0.3218
Cc1[nH]nc(n1)NC=O,0.2323
CC1CC11COCCO1,0.3252
CC12CCOC1C2C#C,0.2685
COCC1CC2CC1O2,0.3331
Cc1cccc(c1)O,0.2179
OC1C(O)C2(O)CC12O,0.2925
CC(C)CCC(=O)C,0.2346
CC1C2CC3OCC3C12,0.3174
CC12CC(OCO1)C=C2,0.2458
c1c(n[nH]n1)N2CCC2,0.2095
CCC12CC(O1)C21CC1,0.3202
CC(O)CC(O)C(N)=O,0.2585
C#CCOC12CN(C1)C2,0.2757
c1c(nc(o1)C#N)O,0.1811
CN1CC=CC1C#N,0.2242
OCC1(NCC1O)C=O,0.2002
C1CC2(C1)CC1OC1C2,0.3409
C1C2CN3CC4OC1C234,0.0786
N=C1OCC2=CC=NN12,0.2364
C1CC(O1)C1=CN=NO1,0.2199
OC1C2C3NC2(C#C)C13,0.251
O=C1C2C3C4CC1C4N23,0.2197
CCC(=O)n1cccn1,0.2191
CN=C1OC(C=C1)C#C,0.2091
CC1NC(=O)CC1=O,0.2079
CC#CCC1CN=CO1,0.2662
C#CC(=O)CC(=O)N,0.173
CC1OC2(C)C3NC3C12,0.3007
CC(C)(O)COC=N,0.2791
CCOCc1ncon1,0.2315
N#CC#CC1CC2OC12,0.2302
CC1(O)C2CC1C=CC2,0.2445
CC#CC1OCC2CC12,0.2884
CCC1(CC1C)OC=O,0.2753
CC(CO)C1C2CCN12,0.2997
CC(O)C1CC(CO)O1,0.3117
OCC(O)C12CCC1O2,0.3103
CC1OC(C)C1(C)C=O,0.2174
CN(C)C(=O)C(=N)N,0.2179
CC(CC(O)C#C)C#N,0.2957
NC1=CC(=N)OC(F)=C1,0.1765
CC1=NC2(CC2)C(=O)N1,0.2254
C1C2C3CCOC2C13,0.3325
CCC1C(C)N1CC=O,0.2087
CC1C2CC1(C=C2)C#C,0.2401
c1c[nH]cnc1=O,0.2039
CC1C2C3(C)CC1C23O,0.3014
OC12CC3C1C=CC23,0.2271
CN=C(CO)NCC#N,0.2525
CC1(C)CCC2OC2C1,0.332
C1CC23CC4C(C2)C4C13,0.3448
CC12C3C(N=CN13)C2=O,0.1988
CC12CN1C1COC21C,0.2859
CC1C=CC=CC(C)=C1,0.1785
CC1CC(=O)C=C1N,0.2065
N=C1OCC1C1CCO1,0.2749
C#CC1OC11CCC1,0.2759
O1C2C3C1C1N=C3OC21,0.1028
CC(CC#C)N1CC1C,0.2762
C1CC1(CCO)C=O,0.2328
CC(=O)NCCO,0.2783
CC1OC(C)(C)C1O,0.3044
OC12C3C1C1=NCC2N31,0.1833
CN(C=O)C(=O)C(=N)N,0.1982
CC12CC1(O)C(=O)CC2,0.218
CC(O)C1CCC1O,0.3172
COCC(O)CCO,0.3275
C1CC(N1)C1=NC=NO1,0.2155
CC(=O)N1CCC1CO,0.2585
CC(=O)c1ncco1,0.1945
CC1(C)C2C(O)C1C2=O,0.2396
C(#N)c1c(c([nH]n1)N)N,0.2013
CCC1C2CN3CC1C23,0.2826
CC1CCC2(C)CC1C2,0.3526
C#CC1COC2CCC12,0.2959
O=C1CC2CC(O2)C=C1,0.1809
CC(C)(C)C1COC1=O,0.2795
CCC1CNC(C=O)=N1,0.1632
Cc1ccc(c(n1)C)F,0.2158
CC1=C(C2(CC1)CC2)C,0.2412
NC1C(=O)OC11CCC1,0.2568
CC12CCC=CC1O2,0.2394
C1CC11COC2CN1C2,0.3023
CC1(CO1)C(CO)C#C,0.2959
c1c(nco1)CN2CC2,0.2452
O=CC1C=CC=CC=C1,0.156
N=C1CC(CCO1)C#C,0.2734
N=C1OC2C3OCC3C12,0.2712
C1C2CC1C1C3OC1C23,0.3129
CCC1OC2C(C)C12,0.3078
N#CC1C2C3C1CN23,0.2852
CC1C2CC3C2N13,0.3265
Cc1nc(no1)CC#C,0.2474
O1CC2(C1)C1CC2O1,0.3162
CC(O)C1CCCC1=O,0.2187
CN=C1OC2CCC12O,0.2741
CNC(=O)CC1(CC1)O,0.2718
CC12C3CC3C1N2C=O,0.2321
CC1CC(C(C)=O)C1=O,0.2058
NC1(CC2CC1O2)C#N,0.2884
CCC1(COCO1)C#N,0.2979
CC1=CC2OCC=C2C1,0.2472
OCC12CC(C#N)C1N2,0.2883
CC12CC=C3C4C(C13)N24,0.1618
CC(O)C1C(O)CC1O,0.3027
COCC1C(C)OC1=N,0.2746
OCC12CC1NCC2=O,0.1973
NC(=O)C1(O)COC1=N,0.2513
CC1COC2=NC=CN12,0.2425
CNC(=[NH2+])C([O-])=O,0.1971
CC12CC1OCOC2=O,0.2647
CCc1nccn1C=O,0.1901
CC1C2N1CC2(N)C#N,0.2623
CN1CC2(O)CC12,0.2816
Cn1cnc2c1[nH]cc2,0.2207
CN=C1CC2(O1)CCC2,0.2782
O=CC1CC2C=CCC12,0.2204
CC12CC(C1)C2C(N)=O,0.2664
CC12CC3COC1C3O2,0.3265
OC12COC1CC=C2,0.2508
CC1C2N1C(C)C2(C)O,0.2914
CC1=NCC(=O)O1,0.2496
CC1=NC2CC2(O)CO1,0.2428
CCOC1(CO)CC1O,0.2936
C1C(=O)COCOC1=O,0.2168
CC(C)C1C(O)C2CN12,0.2942
COCC(C)(C=O)C#N,0.2095
OCC1C(CC1=O)C#N,0.2195
OC1C2CC1(O)C1CC21,0.3098
CCC1OC=NC11CC1,0.2514
CCCCC1OC1CO,0.341
CCC12CC1CCCO2,0.3018
CC(O)C1COC(=N)O1,0.3097
NC12C3C(C1O)N3C2=O,0.2483
C#CC1C2C3CC2N1C3,0.2574
ON=C1CC2(CC12)C#N,0.2356
CC1OC2C3CC12CC3,0.3011
NC12C3NC1C3OC2=N,0.2495
c1c[nH]c(c1CO)CO,0.2342
OC1(CC(=O)C=C1)C#C,0.1888
CC1NC2(CC2)C1=O,0.2087
NCC(C#N)C#CC#C,0.2243
O=CC1C2CC1OCC2,0.2159
NC1C(OC1=N)C1CO1,0.2681
NC1=CON=C1OC=N,0.2044
Cc1cc(c[nH]c1=O)F,0.1697
CCCC1CC1C(N)=O,0.273
CC1OC(C)C=CC=C1,0.1888
CC1CC2CC1(O)C2=O,0.2264
OC1C2OC(C=C2)C1O,0.2492
CC1(CO)C2CCCC12,0.3284
C1OC11C2CC3CN2C13,0.3058
CC1OC2(C)C(C)OC12,0.308
Cc1cc(no1)N,0.2348
CC#CC1COC1C#C,0.2677
OC12CC1OCC=C2,0.2316
OC1CC2CC3COC123,0.2923
Cc1coc2n1cnn2,0.2272
O=C1C=CC2CC3C1N23,0.1787
CC(=O)N(CC#N)C=N,0.2403
C#CC12CCC3C1CN23,0.2567
C1C2C3CC1C1OC1C23,0.3373
CC1OC2CC12,0.3204
N=C1NC(C#C)C11CN1,0.2606
OC12CC3NC(=NC1)C23,0.2118
CCCc1c[nH]c(n1)O,0.2529
CC(=N)N1CCC1=O,0.2379
C1CC(C1)OC(=O)CO,0.2733
CC1(CC1)C(=O)CO,0.241
CC1CC(=O)C=C1C#C,0.1698
CN1CCC(C#C)C1=O,0.2587
CC12CN1C1CC21C#C,0.2445
CCCC1C(C)C1(C)C,0.3285
CNc1c(c(no1)N)N,0.2214
NC12C3CC1NC23C#N,0.2502
C#CC1OCC=C1,0.2533
C1C(CO1)CNCC#N,0.2687
N#CC1CC2C3CN1C23,0.2669
Cc1nc2c(o1)cco2,0.1981
COCC1CCC(C)C1,0.3304
O=C1NC2C3C4C3N1C24,0.2608
CNC(=N)n1nnnn1,0.1834
CCC(O)CC(=O)C#N,0.1993
CN(C=N)c1cnoc1,0.2002
CCC1CC1(C)N1CC1,0.3084
CCOC=NC(C)C,0.2715
CCC1C2C3CC3C12C,0.2824
C1C2OC1C21COCO1,0.3173
OC1C2NC2C=C1C#N,0.2034
OC1CNCC(=N)OC1,0.25
NC1=NCC2CC(=O)N12,0.2205
CCN1CC1C(C)=NO,0.223
O=CC1C2CCC12,0.2192
CC(OC(=N)C=O)C#N,0.1941
O=CCNC(=O)C1CO1,0.2198
c1c(c([nH]n1)O)N,0.2508
c1nc(c(o1)C#N)O,0.1997
Cc1cc[nH]c1C(=O)C,0.1858
CCOCC1CCCO1,0.3192
CCC12CC3C(C=C1)N23,0.2174
CC1(OCC(=N)O1)C=O,0.2098
CC1NC1C1(CN1)C=O,0.2227
N=C1COC2CC(C2)O1,0.2654
OC1CCC(O)C=CC1,0.2544
NC12CC1(CO)OC2=O,0.2462
O=C1C=CC2C1C1CN21,0.1715
C1CC2C1C1COC2O1,0.3277
c1nc(=O)nc(o1)F,0.2179
CC1CC2CC1(C)O2,0.3223
OC12CC(C1)(C2)C#N,0.3064
CCc1cc(n(n1)C)O,0.2538
CC1NCC(=O)C2CC12,0.2016
Cc1cccnc1N,0.2022
C1C(=O)CN=CNC1=O,0.2087
CN=C1OC2COCC12,0.2777
CC(CN)(C#N)N1CC1,0.2716
CC1C=C(C)COC1=N,0.2606
CCC12NC3C1OC23C,0.2983
OC1C2COCCOC12,0.3018
NC1=NOC(=N)C(=N)O1,0.1876
C1CC12CN=C(O2)C#N,0.2054
CC1C=CCC11CC1,0.2632
ON=C1C=CC2CCC12,0.1914
CC1CCC2C(CO)C12,0.3281
CC1CCC(C)(C1)C#C,0.3148
CC1C2(C)CC(=O)C12O,0.2233
CNC(=O)CCC1CO1,0.2796
CC1(C)C2C3CC2C13C,0.3591
COCCOC(C)CO,0.3322
N=COC12CC3C(C1)C23,0.2678
CC(O)CCCCCO,0.334
CC1C2N1C(=N)C21CO1,0.2408
CC(C#N)C1C2CCC12,0.3071
ON=C1CCC2CC12,0.2446
OC1C2OC1C2N1CC1,0.2998
CCOCC1(CC1)C,0.3344
NC1=NC(F)=COC1=N,0.1572
CC1COC1(CO)C=O,0.2095
C1NC1C12NC3C1NC23,0.286
CC(CO)(CO)O,0.3115
C#Cc1cc([nH]c1)C#N,0.1994
CCC1NC(=O)C=C1N,0.2193
CCOC(C=O)C(C)O,0.2134
CC1(N)CC1(N)C#N,0.2645
OCC1C2CC(CO)N12,0.2893
[NH3+]C(CCC#N)C([O-])=O,0.2639
OC(C1CC1)C1COC1,0.3053
CCCC#CC1CO1,0.275
CCC1OC2CCC12O,0.2993
CNc1ccc(o1)N,0.2143
C#Cc1cnc(o1)N,0.1905
c1c(c([nH]n1)C=O)C=O,0.1709
C#CCCC1CCO1,0.3067
C(=O)c1c(c([nH]n1)O)O,0.1754
CCC1CC(=O)C=C1N,0.2065
OC12CN=C3OC1C23O,0.1697
C1C2N1C1(CC1)C21CN1,0.2956
c1coc(n1)OC=O,0.2208
COC1(C)C2CC(C)C12,0.3267
C#CC#CCCOC=O,0.2297
CC1OCC2CCC2=C1,0.255
CC(CCC1CO1)C#N,0.3112
CC1(CC#N)CO1,0.31
CCCCC1NC1C#N,0.2909
Cc1cnn(c1)C(=O)C,0.2111
C1C2C3C4OC4CC1N23,0.3004
CC1(COC11CC1)C=O,0.2084
O=CN1C2CCC12C#C,0.2301
O=CN1CC1CCC#C,0.2529
CCCn1cc(nn1)C,0.2491
OC12C3C4OC1C2(O)C34,0.279
CC12CC3C1N(C=O)C23,0.2521
COC1COC1(C)C#C,0.2783
CCCC1CC2CC1C2,0.3758
O=C1C2CC1N=COC2,0.2078
CC1(CC=CCC=C1)C,0.2555
O=C1C2OC3C=CC2C13,0.204
CC12C3C4C1C4(C#C)N23,0.2366
O=CCC1CCC2CN12,0.2179
OC1CC1C1=CC=CO1,0.2203
N=COC(=O)NCC#C,0.2706
CCn1c(nc(n1)C)O,0.2639
CCN1C2CC(OC)C12,0.3064
CC12C3CC1C1CC3N21,0.2802
N#CC12CC1CC1CN21,0.2809
ON=C1C2OC2C11CO1,0.2341
C1C2C3N4CCOC13C24,0.2962
CC(C)c1nc(no1)O,0.2456
OC12C3OC4C(OC13)C24,0.264
CC1NC11CC(C)C=C1,0.2347
c1c([nH]c(nc1=O)N)N,0.2166
CC1OCC=C1C,0.25
CC1OC11COCOC1,0.331
CC1C2C3C(C)N2C13,0.3085
COC(C)(C#N)C(C)O,0.3052
CC1OC(C=C1)C1CC1,0.2506
C(CCCO)CCC=O,0.229
O=C1CNC2CNC2=C1,0.1956
CC1CC(C)(O)C2NC12,0.3067
OC1CCCC2CC12,0.3304
c1c[nH]nc1CNC=O,0.2635
C1NC1C12CCCC1N2,0.3079
N=C1OCC11CC2NC12,0.2576
N#CC1C2OC1C2C#N,0.2791
O=C1CC23COC2CN13,0.2393
CC(C)(CC#CC=O)O,0.2053
COc1cc(oc1)N,0.2272
C(C(=O)C(=O)CO)O,0.1576
CNC1=CC(OC1)=NC,0.2056
CCC1=CC(C)C2CC12,0.244
CC1(CN=COCO1)C,0.2534
O=C1NCC2N=CNC12,0.2413
OC1CCCCC(=O)C1,0.2223
CCOC(=NCC#N)N,0.2762
CC1CN2C(CO)C12,0.3019
CC#Cc1c[nH]nc1N,0.2073
CC1CCC1OCC#C,0.2838
CC1OC(C1[NH3+])C([O-])=O,0.2664
OCC1CC2(CC2O)O1,0.2915
CC1CC1COC(N)=O,0.3214
CC1OC2C1C21COC1,0.3059
OC1C2CC3CC3OC12,0.3141
O=C1CNCCC11CO1,0.1921
C1C2C1C1=NC=NN21,0.2389
COC(C)CNC(C)=O,0.2788
C1C2CCCOCCN12,0.3035
CC(=O)CC1NC1C=O,0.2205
OC1C2CCC2C1C#N,0.2905
c1c(cn[nH]1)CCCO,0.2591
COCC1C(CO)N1C,0.2869
CC12CC=CC1C(=O)N2,0.2415
C1NC11C2OC2C11CO1,0.3114
OC1CC2C(OC12)C=O,0.2133
OCC1CC(=O)C(=N)O1,0.1888
O=C1NC2CN3CC2C13,0.2395
CC(O)C(CCO)C#C,0.3005
CC(C)(CO)OC,0.3178
CC12CC3C(CO1)OC23,0.2995
CCC(C)OC1(C)CC1,0.3264
CC1CC2C3C2C2C3N12,0.2823
C1C2C1C13COC1C2C3,0.3117
C1C2OC3C=CCC3C12,0.2455
Cc1c[nH]ccc1=O,0.2039
CCC(C#C)C1(C)CO1,0.306
N=C1OC2C3CC1C2N3,0.2708
N#CCC12CC3C1CC23,0.3362
CC#CC(C)CN1CC1,0.2971
OC1CCCNC1C#N,0.2627
CNC12C(O)C1NC2=O,0.2222
CC(O)C#CCN1CC1,0.2713
CCN1C2CCC2C1=O,0.269
CN1CCC(C=O)C1=O,0.2146
CC12CN1C(=O)C(=O)C2,0.1549
CC12C3C(CN13)C2O,0.2956
C1NC11CC2C3OC1C23,0.2945
c1cn(cc1C=O)C=O,0.185
Cc1cc2c([nH]1)[nH]cn2,0.2164
NC1=CC(=O)CC11CN1,0.1991
CC1CCCOC(=N)O1,0.2934
CC1(C(=O)CN=CO1)C,0.2029
CC(=O)C1C2CN2C1=O,0.2163
OC1C2CC2(O)C11CN1,0.3106
OCC(C#C)C#CC=O,0.2029
OC1C2CCC1C21CO1,0.306
OC1CCC2(NC12)C=O,0.221
CC1=CCC(=O)NC=C1,0.1929
CC1(COC(=N)C1)C#C,0.2835
CC1(CC1)C2=CCCC2,0.2543
CC(O)C1=NC(N)=NN1,0.2292
OC12CC1C(OC2)C=O,0.2165
O=C1CC2OC1C21CC1,0.2127
Cc1cc[nH]c(=O)n1,0.1853
CC(CCC#C)CC#N,0.2997
CNC(=O)n1cccc1,0.2128
COCC1(CC1)C#N,0.3041
CC(C)Cc1cnno1,0.2327
CC1=NC(CCO1)(C)C,0.2726
CCOC12C3C4C1N4C23,0.277
CC1(C)C(O)CC1=O,0.2166
CC(C#C)C(C)(O)CO,0.3053
CNC(C)(C#N)C1CC1,0.2814
COCC1OC1CC=O,0.2244
CC#CCN1CC(=O)C1,0.2084
CCC1C2CC(=O)CN12,0.2019
CC1CC1N(C=O)C=O,0.2143
OCCC1(CCO1)C=O,0.211
CCC1(OCC=C1)C#N,0.2515
CCC1(O)COC1C#C,0.2703
N#CC#CC1C2CCC12,0.2268
N#CC12OC1CC21CO1,0.2685
N=C1OC2COC(=N)C12,0.2664
COC1C(N)C1(O)C#N,0.2543
CC1(C)CC1(C)C1CC1,0.3315
N#CC1CC2CC12C#N,0.2856
CC1C2CC1(O)C1NC21,0.2944
COC1C=CCCC=C1,0.2343
CC(O)CCCO,0.3304
C#CC(C#C)OC=O,0.2702
CCC(C)OC(C)C=O,0.2127
CC(C(N)C#N)C1CO1,0.29
CC1(C)NC11CCC1=O,0.2139
CC1C2CC2(C#C)C1=O,0.2216
Cc1c(cccn1)CO,0.2298
OCC12CC(C1)(N2)C=O,0.2134
CC(=O)C12CC1COC2,0.2293
C1C2OC3C4OC1C2C34,0.2974
CC1C(C)C11CC=CC1,0.2631
OCC(CNC=O)C=O,0.2118
CCC1CC(O)(C1)C=O,0.2298
CC1CC(=O)CCC=C1,0.2227
CC12CC(=O)N1C1CC21,0.2325
CC(=O)C1(CN1)C1CO1,0.2219
CCn1cc(cc1O)C,0.2399
CN1CC(=NO)C1C=O,0.1987
Cn1c(=O)ncoc1=O,0.2286
OCC1CC=CCCO1,0.2536
O=COC1C2NC(=O)C12,0.2466
OC1CNCC(=O)C1,0.2004
OC1C2CC1(O)C(=O)N2,0.2666
N=C1C=CNC(=O)N=C1,0.1568
CC12CC1C(=O)C2C#C,0.2214
CCC1C2COC(=O)N12,0.2811
CCC1COCC(C)C1,0.3241
CC1(CO)C(O)C1C#N,0.2931
CC1(O)C=CC2OC12,0.2409
CN1C=C2CCC2C1=O,0.1972
C#CC1CC(O1)C1CO1,0.2729
C1C2CC=CC1C1OC21,0.2566
N=C1CC2(CCOC2)O1,0.2794
CCC12CC(=O)C1(C)O2,0.2157
c1c([nH]c(=O)[nH]1)O,0.2345
O=CC1OCC2(CC2)O1,0.2059
CCNc1n[nH]nn1,0.2062
OC(COC=O)C#C,0.2843
C#CCNc1cc[nH]c1,0.2245
N#CC12CC=C3CC1C23,0.1785
CC1NC(=O)C2CC12,0.2657
CC1C(O)C1(O)CO,0.2922
Cc1c[nH]c2c1NCC2,0.2206
CN1CC=CCC(=O)C1,0.2014
C#CC(=O)n1nccn1,0.2062
C(CO)C#CCO,0.2802
NC(=O)NCC(O)CO,0.2982
CCC1CC(CC)C1O,0.3202
CCCCN=CNC=O,0.2317
CC(C=O)N(C)CCO,0.2041
N=C1CC2COCC2O1,0.2825
CC1C2OC(=O)C1C2C,0.2738
OCC1CCOCC1=O,0.2049
CCC12CC3OC1C23C,0.2992
COC(C=O)C#CC#N,0.2035
CC(N)(CO)C#N,0.2988
CCN1CC=CCC1=O,0.248
CC1N2CC1(C2)NC=O,0.2568
CCC1CC2C(CO)N12,0.2944
N=C1OC2C3CC(=C1)C23,0.1922
O=COC1COC=NC1,0.2596
OC1C2OC2C1OC=N,0.2733
C1CC2C3OC4C3C1C24,0.3156
OC1C(CCC1=O)C#N,0.2238
CC12CC3C(O)CC1N23,0.2948
CC1C2C3CC1CC23,0.3508
CC12OCC1=CNC2=O,0.1917
CC1C2C=CC(O)C12O,0.2303
C#CCN1C2C3NC3C12,0.2642
CC1(CC#N)CN1,0.2946
CC1CN2C1=CNC2=O,0.2269
NC(=[NH2+])CCC([O-])=O,0.2423
CC(O)CC(=O)CCO,0.2305
c1c(nc([nH]1)C#N)C=O,0.1999
C1CC11CC2OC3C2C13,0.305
CC12CC(C1)CC21CO1,0.346
OCC1CCOCO1,0.349
CC12C=CC3C4C(C14)C23,0.2477
CCC1NC2CC12C#N,0.2528
CC12CC1C(=O)CC=C2,0.215
CC1C=CN(C=N)C1=O,0.2051
CCOCC1OC1C#N,0.2626
C1C2C3OC4CCC13C24,0.3272
CCC1C2C1C1CC2C1,0.3441
CC1(O)CC2COC12,0.3143
CC#CC1(O)CC1(C)C,0.2684
COC1CC2C1OC2=N,0.2852
CCC1NC1C(F)(F)F,0.3286
CC1(C)C2C3CC2(C)C13,0.3709
OCC1C2OC1C2=O,0.2471
COCC(O)C1CN1C,0.2913
Cc1c2c(no1)ocn2,0.2026
OC12CC1C1CC1CC2,0.3164
CCCC1(CO1)C1CO1,0.3418
CC(CO)C(C)C(N)=O,0.2767
O=C1NC=CC2OC12,0.2061
CC1(NCC1N)C#N,0.2748
OC(C#N)C1COC1,0.2653
[O-]C(=O)C1C[NH+]2CCC12,0.1773
CC1N2C3C2C2C3C12O,0.2879
CCOC(=O)NC=O,0.2456
Cc1c(c(on1)C)N,0.2151
CC(O)C(=O)C(N)=O,0.1782
CC(=N)OCCOC=O,0.2801
CN1C=CC=C1C1CO1,0.2352
CCCCc1ccoc1,0.2421
N#CCC1C2C3C1CN23,0.2827
CN=C1OC2(CC2)C=C1,0.1881
CC1C=CC2(CN12)C#N,0.2323
CC1CC2NC(C#N)C12,0.2604
CC1NC2(COC12)C#C,0.2513
CC12CC1N(C=N)C2=O,0.2237
Cc1ccc(nc1O)F,0.2105
O=C(C#C)C1CN=CO1,0.187
CCC1(NC2CC12)C#N,0.2559
N#CC1(C#N)C2CC1N2,0.2559
COC1OCC2OCC12,0.3246
N#CC1C2C3CCC2C13,0.3299
N=C1NC=CC=CC1=O,0.1501
CC(=O)NC1C2COC12,0.2667
CC(C)C(CCO)C#C,0.3087
CCC1CC1(C)C(C)C,0.3348
CN(C=O)C(=O)CC=O,0.2163
CCC12OC1CC(C)=C2,0.2423
CCC1(C)OC1CCO,0.3356
CN1Cc2c[nH]nc2C1,0.2234
c1c(con1)C(=O)C=O,0.156
OC1(C#N)C2CC1OC2,0.2666
OCC1OC1C1CCC1,0.3381
c1nc2c(o1)CC=C2,0.196
CC(=O)C1C2CC(O)C12,0.2129
CC12OC3C(NC13)C2O,0.2811
N#CC1COC2CNC12,0.2766
CC12CCC1C1CC2O1,0.3274
Cc1cnc(=O)n(c1)C,0.1743
C#CC#CC1(CCC1)O,0.2192
c1cc-2nccoc2c1,0.1249
OC12COC1C1CN1C2,0.2887
OC1CCC=CC1O,0.2539
OCC1=NC(=N)C=CO1,0.2114
C#CC1CC(C=C1)C#C,0.2565
CC1(C)CCC(O1)C=O,0.2119
CC1CCOC1C1CO1,0.3253
CC(N(C)C)C(=O)C=O,0.1246
c1c(oc(n1)N)CC=O,0.1818
CC12OC1C1NC2C1O,0.2944
C#Cc1nc(on1)N,0.2142
Cc1coc(c1N)N,0.22
OC12CC1COC1CC21,0.3125
CC1OC1C1(C)CCC1,0.3382
C1C2COC3CCCC123,0.3249
CC1CC(OCO1)C#N,0.2912
CCC(=O)N(C)CC=O,0.2128
CC1CN=COCO1,0.2594
OC1=NC=C(OC=N)O1,0.2324
CN1C(=N)C=NOC1=O,0.1983
CC1CC=CN1C(C)=O,0.2082
C1CC23OCCC2C3O1,0.3013
Cn1cc(nc1CO)O,0.2112
CC1(COCCN1)C#N,0.2673
OCC12OCC(O1)C=C2,0.246
O=C1OC2C3CC3OC12,0.2463
ON=C1CCC1(O)C#C,0.2383
CC(C)C12CC3CN1C23,0.3164
CCC1C(C)CC11CC1,0.3383
O=CC(C#N)C1CCC1,0.2228
CC(C#N)C1NCC1=O,0.2211
C1C=C(CC1=NO)C#N,0.2085
OCC(=O)C(C=O)C#C,0.2118
CC#CCCC1CCC1,0.3037
C1CC(=O)C(=C1N)C#N,0.2016
CC1NC1C(CO)C#C,0.2879
C(C1OCC=C1)N1CC1,0.2452
O=C1NCC2C3CC12C3,0.2565
CC1CC(C)(C)C1C,0.3444
c1c(c(c[nH]c1=O)F)F,0.1767
O=CCC1CC(O1)C=O,0.2109
c1c(nc(nc1F)O)F,0.2364
O=C1OCC2C=CCN12,0.2544
CC#CC(CO)N1CC1,0.2861
C1CC1C1CC2OCC12,0.3125
N=C1NCC1(C#C)C#N,0.2591
CN(C)C1CNCC1=O,0.1897
c1cc(oc1)NC2CC2,0.2184
C1CC23CC(CC2)C13,0.3155
CC12CC=CC1(O)C2O,0.2321
C1C=C(CC1=O)NC=O,0.2098
CC1OC11CN(C)C1=O,0.2597
CCC12CC1(OC2)C=O,0.2092
c1c(n2c(n1)OCC2)N,0.2348
C1CC1OC1CC2CC12,0.3184
O=C1CC(C#C)C2NC12,0.2155
CCC(C=O)C(C)CO,0.2256
C1CC1(CC(F)(F)F)O,0.3263
OCC1C2C3C(C2O)N13,0.3041
O=COC1CC2(CN2)C1,0.2602
OC1CNC2=C1NN=C2,0.2076
CC(C)CCC1(CC1)C,0.3432
COC1OCC2NC12C,0.3097
N=COC12CCC1CC2,0.274
OC1C=CCOC1=N,0.2559
OC1CC(C#N)C1C#C,0.287
OC1COC2=NNC=C12,0.2319
CC1(O)C2CCC1C2O,0.2943
C[NH2+]CCCC([O-])=O,0.2726
C#CC1CC2CC(C2)C1,0.3123
CC#CC12C3CC1CC23,0.2557
CC1CC2(CN2)C2CN12,0.3055
CC1=NNC(F)=NC1=N,0.1943
CC(=O)OC(C#C)C#C,0.2694
CC12CC(CO1)C21CC1,0.3208
OCC12CC1OC2=O,0.2714
CC#CC1CCC1=O,0.2094
C1CC2(C1)C1CC2O1,0.3153
CC12C3NC3C1OC2=O,0.257
CC1CC11CC2CC12,0.3351
CC#CC(=O)CNC=O,0.1852
CC1C(C)C1C1(O)CC1,0.3044
CNC(=O)C1CCC1=O,0.2077
C1C2C1C1CC3C(C1)C23,0.3257
NC1(CC1[NH3+])C([O-])=O,0.2693
CC12C3C=C4CC1C4N23,0.1717
CC1C2C1C1C2CC1=O,0.2069
O=C1CC23CC(OC2)C13,0.2208
C#CCNC(=N)C=O,0.1732
CNC1(CC1O)C#N,0.258
OC1COC(=N)CC1=O,0.2234
CC1N2CC2(CO)C1=O,0.2186
CC1C2OC(CO)=NC12,0.2595
CCCC(C)C1(C)CC1,0.3446
CC1(C)C2CC2C1CO,0.3241
CC1CC2(CO2)C(=N)O1,0.2632
C1CC2C3COC2C13,0.3203
CC1CC1C1NC1CO,0.3111
CC1(C#N)C2CCC1N2,0.2806
CCCN=C1OC2CC12,0.27
ON=C1C2CC1C1CC21,0.261
Cn1ccc(cc1=O)N,0.1866
CC1OC(=O)C2C1N2C,0.2452
CC1OC2(COC12)C#N,0.2603
CN1CC1(C)C1CCC1,0.301
OCC1(O)CC2CN2C1,0.2952
OC1CCOC(C1)C#C,0.2924
OC1(CNC1C=O)C#C,0.2017
NC1=CNN=C(O)C1=N,0.1575
CC12CC3(O)C(CC1)C23,0.3237
CC1OCC(=O)C1CO,0.2171
C[NH+](C)CC(CO)=N[O-],0.1567
CCC1=NOC(=N)C=C1,0.1673
CN1C2CC(C)(O)C12,0.294
O=C1CNC11CC1C#C,0.2008
CC12NC3(C=O)C1NC23,0.1884
NC(=O)C12NC3C1OC23,0.243
CC12NC(C=C1)C2O,0.2286
O=CCC1CC1N1CC1,0.2262
CC1OC(C)(C)C1C#N,0.2824
CN=C(C=O)NCC=O,0.1552
CC1(CC1)C,0.3526
CC1OC2(CC2)C1=NO,0.2246
CC(C)(C)C(C)(C)O,0.3239
C1C2C1C1=CCOC21,0.2319
CC1OC2CC12CCO,0.3043
CCc1c(cn(n1)C)N,0.2204
CC(=O)C1NC1CC#N,0.2222
OCC1(CO)COC1=N,0.2733
N#CC12NC1C1OC21,0.2423
O=CC(=O)C1(CO1)C=O,0.1488
CC1C2CC1C2CC#C,0.3157
COc1c[nH]cc1C#C,0.2188
CCc1c([nH]cc1N)C,0.2247
CCC1COC(=O)N1C,0.3031
CC#CC1(N)COC1=N,0.2596
CC1(CC1CCO)C=O,0.2331
c1c2n(cn1)C3(C2)CC3,0.2548
CC(=O)C12CC(O)C1N2,0.2217
CC1C(O)C2OCC12C,0.3002
CCC(C)(CO)CC#N,0.3143
OC1CC=CCC1C#N,0.2663
OCC1CCC11CO1,0.3305
CC1(C)C2OC(C=O)C12,0.2167
Cn1c(ncn1)CO,0.2543
COC1C2NC1C1OC21,0.3057
OC1C2C3OC(=O)C1C23,0.266
CC1(C)C(O)C1O,0.2832
CCCC1C2OC2C1O,0.3224
CC1OCC2NC12C,0.3067
O=CC(NC1CC1)C#C,0.1849
CC1=CCn2c1cnc2,0.1865
CC1=CC2C(C1)C2(C)C,0.2399
C1OC1C1=CCC2NC12,0.2338
CC12CCN1C1COC21,0.2704
C1C2C1C1=NC=CN21,0.2246
CCCC1NC1C#N,0.2914
COC12CC1COC2=N,0.2736
CC(=O)COCCC#C,0.2345
CC(COCCO)C#C,0.3131
C1CNC(=C1C=O)C=O,0.1305
CN1C2CCC2(O)C1=O,0.2558
CC(O)C1CC(O)C1C,0.3141
Cc1c[nH]c(nc1=O)C,0.2116
OC1C2(O)CC(=O)C12O,0.1626
CC12C3C(CN13)CC2=O,0.2143
[O-]C(=O)C1CC[NH2+]CC1,0.1283
CCc1c(c(n[nH]1)O)O,0.2291
NC1COCC1C#N,0.2845
CCc1ncn(n1)C,0.2636
CNC1C2NC(=N)C12O,0.2287
CCC(C)(CO)CC=O,0.2103
CCCC(=O)N(C)C=O,0.227
CCC(C#C)(C#C)O,0.2785
COC(=O)c1nc[nH]n1,0.2382
Cc1cc(c(=O)[nH]c1)F,0.1764
O=CC12OC1C1CC2C1,0.2226
CC1CNC(=O)C11CC1,0.2711
CC(C=O)C12CN(C1)C2,0.205
CC(O)CC1=CC=NN1,0.2568
CC(CO)(NC=O)C#N,0.2719
CC1(O)C(O)C2CCC12,0.2934
CC1OC2CN(C=O)C12,0.2664
CC(=O)N(C)C(=N)C#C,0.2079
OC1CC1CC1CC1O,0.3275
C1CC23OC2CC=CC13,0.266
Cc1cc[nH]c1CCO,0.2415
CC12CC(O1)(C#N)C2N,0.2472
CC12OC1CC2=O,0.217
CC#CC(=N)OC(C)C,0.2371
c1c(n2c(n1)CC=C2)N,0.1903
CC#Cc1cc(oc1)C,0.2098
CC#CC1(C)OC1(C)C,0.2778
CC(=O)C1CC1(C)CO,0.2293
OC12C3OC3C1NC2=O,0.2503
COC1(CCC1)C=O,0.2113
CNc1c(cncn1)F,0.2068
CC1CC(=O)CC(=O)O1,0.2235
OC1=CC(=N)OC=C1,0.1696
CC1CC(CC=O)C1,0.2273
CC1CC(=O)C11CCC1,0.2147
N=C1OC(OC1=O)C#C,0.2281
Cc1c(cnc(n1)C)N,0.1928
CCCC1=CCC(O)C1,0.2594
CC(O)C(C)NC(N)=O,0.2986
CC12CCC(=O)C1N2,0.2194
CCC12OC1COC2C,0.3253
OCC1C2OC1C1CC21,0.3163
CC#Cc1nc(on1)N,0.2141
CC1NC11CC(C)C1O,0.299
COc1c(cncn1)F,0.222
CCOC(=O)C(O)C#N,0.2811
CCC(C)C1NC1C=O,0.2211
CC1=CC(O)CC2NC12,0.2439
C1C2C3CC4C1C2OC34,0.3325
CC1(COC=O)CC1O,0.2783
O=C1C=C2CC3CN1C23,0.1724
c1cn[nH]c1COC=O,0.2446
CC1CC(C=O)=CC1=O,0.1529
OCCN1C=NOC1=N,0.2269
C1C2C=C3CC4C2C1C34,0.1785
COC12CC3C1CCC23,0.3401
CC(O)C1C2C3C1CN23,0.2922
CCC(O)COC=O,0.2853
CC1CCCC(O)CC1,0.3346
CCCC(CC)C1CO1,0.345
OC1CC(CC1O)C#N,0.3069
CC1CN=C(N)NC1=O,0.2331
CC(=O)C(CC#C)C#C,0.2237
CC(C)OCC#CCO,0.2876
O=CC12CC3(CO3)C1O2,0.2154
C1C2C=CC3CCC12O3,0.2278
ON=C1COC1C1CN1,0.2375
N#CC12CN(C1)C21CC1,0.2734
CC1OC11CN2C(C)C12,0.3031
CC1=CC2C(CO)N2C1,0.2258
CC1CC1CC(N)C#N,0.2837
CC12C=CC3CC1CC23,0.2468
O=CC12CC1C=CC2=O,0.1811
CC1CC2(C#N)C(O)C12,0.2774
CCC1(CC1O)C1CN1,0.3114
CCC(=O)CC(=O)OC,0.2253
CCC1C(OC)C1C=O,0.2215
C1C2N1CC21COC1,0.2997
Cc1c(nc(cn1)O)F,0.1942
N=C1N=CN=NNC1=O,0.1607
CC1=CCC2C1C2(C)O,0.2381
CC1=NC(CC#N)CO1,0.271
CC(C)CC1OCC=C1,0.2479
CC1=NCC(O1)C(N)=O,0.262
OC12CC1C(=O)OC2=N,0.2329
CCC1CC2(C)OC12C,0.323
C#CC1NC1CC#N,0.2816
OC1C(O)C1C1CO1,0.2839
CC1C2C3C4N3C1C24O,0.2718
CCCC1COC(=O)C1,0.2781
CC12OC3C1N(C=O)C23,0.2526
Cc1coc2c1nc[nH]2,0.2224
OC1CC2N3CC3C=C12,0.2288
CC12CN1CC2OC=N,0.2655
COC12CC1C(C)CC2,0.3294
CC1=CC2CC1C2CO,0.2375
CC1CC(C=C1)C(N)=O,0.2396
CC1C2OCC2(C)C1=O,0.2131
CC1(COC1=O)C(N)=O,0.2503
CC(C)CC(C=O)C=O,0.2029
NC(=[NH2+])CC(C=O)=N[O-],0.1572
C1CNC=C1C(=O)CO,0.1746
CC1(CC(O)C1O)C#C,0.2892
OCCC(O)C#CC=O,0.2047
O=C1OC2C3CC3C2=C1,0.216
COC1CC2OC12CO,0.3127
N=C1OC2CNC12,0.2553
CC1(C)C2C=CC1C=C2,0.2117
CC(C#C)C1NC1CO,0.3015
OCC1COCOC=N1,0.2527
OC1CCNC(=O)NC1,0.2963
C#Cc1nnn(n1)C=O,0.1865
N=C1OC2C(CC12)C=O,0.2229
Cn1cc(n(c1=O)C)N,0.2267
CN1C2C3C(O)C1C23C,0.2714
CC1(O)C2OC11CNC21,0.2562
CN(C)CC(=O)OC=N,0.1967
N=C1NC(=O)CC11CN1,0.2386
CC1C=CC=CC2OC12,0.1873
OCC1=CC2OCC1O2,0.2431
C#CCN1CCC1C#C,0.2513
OC1CC2CC1(C2)C#C,0.3007
C#CC12CC1OCCO2,0.2584
C1CC2(C1)CN2CCO,0.3154
CC(C)CN1CC1C=O,0.2097
c1c(nno1)NCCO,0.189
CC(C)CC(O)C(C)C,0.3268
Cc1coc(n1)C#C,0.1973
O=CNC1C2OC=NC12,0.2449
c1c(nco1)N(=O)=O,0.2008
OC1CC(O)(C1)C1CC1,0.3065
CC(C)C1C2OC1C2O,0.3007
OCCC12OC3CC1C23,0.3068
CC1=CCCC2(O)CC12,0.2426
CCc1c(n[nH]n1)C#N,0.2336
CC(=NCC=O)NC=O,0.2116
C1C2OC3CN1CC2O3,0.2991
CNC(=O)NC(=N)CO,0.2584
CC(C)C(O)CCCO,0.3313
O=CNCC12CCC1O2,0.2795
Cn1ccc(=O)c(n1)F,0.1886
CC12NC1CC(CO)=C2,0.2428
CC1OC2(C)C(C#C)C12,0.275
c1cc(cc(c1)O)N,0.2102
CC(CC=O)(C=O)C=O,0.196
CCC1(O)CCCOC1,0.3204
CC1(C)NCC(=O)C1O,0.2002
CC(C)(COCC#C)O,0.2834
CC(O)C1CCC11CC1,0.3221
C1C2C3CN2CCN13,0.2838
O=C1CCC2(NC12)C#N,0.2097
OC1C2C1C1(CC1)C2O,0.3125
OCC1CN1CCC#N,0.2782
N#CC1NCCC=C1,0.2466
NC1C(=N)OC11COC1,0.2655
Cc1cc(n(n1)C)N,0.2452
N#CC1C2COC1CN2,0.2751
CC12CN1CC(O)C=C2,0.2283
N=C1OCC11C2CC1C2,0.2793
COC(C)(CO)C(C)O,0.315
c1c(c(n[nH]c1=O)O)O,0.1764
CC1CCC11COC=N1,0.2631
N=C1NCC2(CC2)C1=O,0.1865
CC(=O)CCCCC#N,0.2351
C#Cc1cc(oc1)CO,0.2119
C1CC2N=COC2CO1,0.2642
C(CC(=O)NC=N)C=O,0.2279
CC1C=CC(=O)C1(C)O,0.1874
COC1CC11CC=CC1,0.2584
CC1OC(C)(C=O)C1=O,0.192
O=CCC12CC1C1CC21,0.1956
CC1OCC1(C)C1CC1,0.3221
c1c2c(no1)OCC=C2,0.1978
CC(C)C12CC1C(=O)C2,0.2328
OC12CC(C3CC13)C2=O,0.2283
CC12OC1C1OC21CO,0.292
C#CC1C2C3C4C1C2N34,0.2745
C1C2C3C4C=CCC13N24,0.2315
CNC(C)C#N,0.2711
CC(COC=O)OC=N,0.2802
CC1OCC=CNC1=O,0.2133
CCC(C1CO1)C(N)=O,0.273
OCC12CC1CCC2=O,0.2263
O=CC1(CO1)C#N,0.2141
CC12OCOC1C2CO,0.3225
OCCC12CC1C=CC2,0.2482
CC1(CO1)C1=CC=CO1,0.2251
CC1C2CC2(O)C11CN1,0.3075
OC12CC(CC1)C21CN1,0.2999
C(COC=O)OCC#N,0.2767
C#CC12CNC1C2C#N,0.2419
CC12CCC1OCC=C2,0.2596
COC(CN1CC1)C#C,0.2702
CC1CC2(O1)C1CCC21,0.2991
C1C2C3C4C3C3C4N3C12,0.281
O=C1C=CC2(OC12)C#N,0.1709
O=CC1=CC(CC1)C#C,0.1923
C1C2CC3=C(NN=C3)C12,0.2423
OCC12NC1CC1OC21,0.3029
CC1(CN1CC=O)C#N,0.2236
OC1CC2NCC1C2=O,0.1995
C1C(CN1C=O)C#N,0.2667
CCC1(NC1C#N)C#C,0.259
CN(C)C(=O)N,0.2909
CC1CC2OC(=N)C=C12,0.2068
CCC1CCCC(C)=C1,0.2577
C1C2OC34CC(C3)N1C24,0.2462
CC12C3CC3C1CC2O,0.2983
C1OC1C1COCOC1,0.345
O=C1OC2COC12C#C,0.2333
c1conc(c1=O)F,0.191
C#Cc1nc(no1)C#N,0.2072
OC1CNC(=O)NC=C1,0.2245
CC1(CC(=CC1=O)N)C,0.2055
CC1CC1C(=O)CO,0.2389
O=CC12CCCC1CO2,0.2119
NC1=C(CO)OC(=N)O1,0.2241
C(CN=CNC=O)C=O,0.2187
CC12C3CC1(O)CN23,0.2917
CC1(NC1C=O)C=O,0.2061
CC(C)(c1ccn[nH]1)O,0.2562
CC12CC(CO1)CC=C2,0.2491
C1C2C1C1CCC3C2C13,0.3096
CC#Cc1cncn1C,0.203
CCC12C3OC1COC23,0.2836
NC(=O)C1=CC(O)CC1,0.2141
OC12CC3OC1C(=O)C23,0.207
CC1(CN=C(O1)C=O)C,0.1914
CC(C=O)C1CN1,0.2077
CC1(CO1)C(C=O)C=O,0.2112
c1cnc([nH]1)OCC#N,0.2241
CC1C2CC1(C)C(C)C2,0.3571
c1ccc2c(c1)n[nH]n2,0.1807
O=CC1=CN2CC2CC1,0.1889
CC1CCC=C(C1)C#C,0.2126
O=CC1CC(=O)C11CN1,0.2063
C(c1nc(c(o1)N)O)O,0.1953
N=C1CC2C3C(CN23)O1,0.2709
CN=C1OC2(C)C(C)C12,0.2702
CCN1CC1C(C)CO,0.2954
CN1C(C#C)C1C#C,0.2428
CCCC(OC=N)C#N,0.2834
C1CC1C1C2C3CC2C13,0.3583
CN1C2CC1C2(C)O,0.2782
CC12CCC3C1C(O)C23,0.3346
N=C1OCCCC1C#C,0.2709
C1C2CC3CCOC2C13,0.3217
CC(O)C(O)CCO,0.3194
CCC1C(O)CC1O,0.3058
O=C1C2CC2C2CN12,0.2351
CCN1CC1(C)C#N,0.2781
OCC12OC1C1CC21O,0.282
CCC12CN1CCC2O,0.2912
C[NH2+]CCC(C=O)=N[O-],0.1544
CC1(C=CCO1)C,0.2492
CC1=COC(=N)C=C1O,0.1718
CC1=CCC2C(O)CC12,0.255
COC1C=CC2CC12O,0.2387
C#CC1(CNC=N1)C#C,0.2479
CC1C(CO)CC1CO,0.3306
CC(=NO)C(CO)C#C,0.2549
CCC(C)C1=NC=CN1,0.2516
CC12CC1OCO2,0.3193
CC1(CC=O)CC1O,0.2236
N=C1NC(=CC1=O)C#C,0.1385
CC#CC1(C)OCC1O,0.2774
CCN=C1CC(O1)C#N,0.2574
OCC12CN1CC1CC21,0.301
CCOCCC(F)(F)F,0.3472
CC1C2C(O)C(C)C12C,0.3084
CC1CC1(C)CNC=O,0.2803
N#CC1CC2NC2C=C1,0.2453
CN1C2C(=O)C1C21CN1,0.2318
Cc1cc(c(o1)NC)O,0.206
CC1=CC2NC2C11CO1,0.2367
CC1(C)CNC(=N1)C#N,0.1991
CC(O)C1(C)C(O)C1O,0.2749
OC1C2COC12C=O,0.2129
CC1(CCO)CCC1=O,0.2161
CC1=CC2CC1N=CO2,0.2384
OC12CC1(O)C1OCC21,0.2973
CC1CC1(O)C1CCO1,0.3104
CC#CCOC1CC1O,0.265
C1C2C3C4COC(C13)C24,0.3291
CC(C)(CO)C(=O)C#N,0.2009
OC12COC1C1COC21,0.2875
CC#CC(=O)CN1CC1,0.1942
c1[nH]c2c(n1)C(=O)NC2,0.2355
O=CCCC1COC=N1,0.2287
C1OC2C3COCC12O3,0.2652
CC(=NO)C1CC(=O)C1,0.222
Cn1c(=O)oc(n1)C=O,0.1678
CC12CC3C1OCC23O,0.2985
CC1C(=O)OCC11CN1,0.2656
COC12C3C1C1C3OC21,0.309
CC1CC1OC1CC1C,0.3159
CC1(CC1(O)CO)C=O,0.2235
CC1(CN1)C(=O)NC=N,0.222
CC1CC1C#CC=O,0.2037
O=C1C2C=CC11COC21,0.2338
CCN1CC2(CO2)C1=O,0.259
O=C1CC2CC3(CN3)C12,0.2124
OC(CC#N)C1COC1,0.2856
OC1CCCC11CO1,0.3181
N=C1NC(=O)CCO1,0.2447
O=C1NC(C#C)C11CO1,0.2517
O=C1COCC11CN1,0.2111
CC(O)(C=O)C#C,0.2158
CC1C2C1(O)CC2(C)O,0.3135
CC1(CN=C(O1)CO)C,0.2765
C1C(CC1=O)CC=O,0.2186
C(=O)C#CC(=O)NC=N,0.1743
O=C1N2CC2CC11CN1,0.2322
CC(O)C1(O)C(C)C1C,0.3102
O=CC1C2C3N2C1C3=O,0.2117
CCc1ncc(n1C)O,0.2356
CCC1CC(CO)C=C1,0.2612
N#CC1OC2CC3C2C13,0.2894
CCC1C2CC1N1CC21,0.3143
OC1(C#C)C2C3CN2C13,0.264
CC1=CN=C(F)C(=N)O1,0.1659
CC12OC1C(N)C2C#N,0.2699
O=CC1CNC(=O)O1,0.2213
CCC#CCNCC#N,0.2664
CC1(C)OCC1NC=O,0.2721
N#CC12NC3C1CC23,0.2548
CC1C2N1CCNC2=O,0.249
CNC(=NC)NC=O,0.1993
CN=C(C)OC1CC1O,0.2567
CC1OC2C3C2C2C3C12,0.2886
CC1C(O)C(C)C1O,0.2951
C(CO)c1[nH]nc(n1)O,0.2437
CC12C3C4C(C1C3=O)N24,0.2206
OC1CN=C(C1)NC=O,0.2298
OC12CC1OCCC2=O,0.218
CC1(CC2(C1)CCC2)C,0.3411
CC1(COC1=N)C(N)=O,0.2575
C1C2CC11C3OC3CN21,0.2859
COC1COC1(C)CO,0.3148
C1NC11CN2CC12,0.295
COC(C#N)C(C)C=O,0.2225
OC1C2C3CC1COC23,0.2954
CC1CC2=NNC=C2O1,0.2245
CC1N2C3C=CC2C13O,0.2183
OCC(CC#C)CC#N,0.2807
COc1c(c(no1)N)N,0.2387
c1c2ncnnn2nn1,0.1536
NC=[NH+]CC(N)C([O-])=O,0.2553
C#Cc1ncc(o1)C#N,0.1822
CCc1cc(cn1C)C,0.2369
CN=C1CC2(CO2)CO1,0.2721
CNc1[nH]cc(n1)C=O,0.1794
CC1(CCO)CC(=O)N1,0.2832
OCC1COC(CO)O1,0.3226
CN(CC(=O)N)C=O,0.2542
CC1C(C)N1CCC=O,0.2033
OC1C2C3CC3C12,0.2773
O=CC1CC2CC(C2)O1,0.2121
NC1C=CCCOC1=O,0.2319
CCCC1C2CC1C2,0.3795
CC1C2OC2C1=NO,0.2478
C1OC=NC2C3OC1C23,0.2542
OCC1CCCCC=C1,0.2571
CC1(CCOC=NC1)C,0.2544
CC#CCOCC#C,0.2658
C1CC23NC2COC3O1,0.3365
N=C1NC=C(C=O)C1=O,0.1449
CCCC(C)OCC#N,0.2939
OC12CNC11COC1C2,0.2861
CC#CCC12CC1CO2,0.2854
CN=C1OCC1(O)C#N,0.2546
CC1=CC2CCC1(O)C2,0.2541
Cc1cc(c(nc1)F)O,0.2079
O=C1C=CCC2CCN12,0.2039
CN1CC2=CC(=O)CC12,0.1878
CC(=N)OC1=NC=NO1,0.2653
CC1CC(C#C)C1C#C,0.2885
Cn1cc(nn1)NC=O,0.2242
CC#CC(O)CCCO,0.2897
CC(=O)C1CC1(O)C#C,0.2034
CN=C1COCO1,0.2776
C#CC1(CC(=O)C1)CO,0.2211
CC1C(O)CC(O)C1C,0.315
CN=C1N=NNN=C1C,0.17
C(C(CO)(C=O)O)O,0.2073
OCC1OC2C3OC1C23,0.2894
C#CC1C2COC1CO2,0.2905
CCOC(=O)C#C,0.2379
N#CC1C2NC1C1NC21,0.2898
CCCn1cc(cn1)N,0.2205
CC(C1CC1)N(C)C=O,0.2718
C1C(=CC(=O)C1=O)CO,0.1427
CC(NCC#N)C1CN1,0.2695
CNc1c(cco1)CO,0.2109
FC(F)(F)C1CC(=O)O1,0.2878
CC(O)C1(CO)CC1C,0.3087
CCC1=NC2CC(C2)O1,0.2663
CC1=CC=CCNC1=O,0.186
CCC1CC=CC1(C)O,0.2656
NC1CCN=COC1=O,0.2344
OC1CCC(CC#N)=C1,0.2536
COCC(C#C)N1CC1,0.281
CC1OCC11CO1,0.3285
[O-]C(=O)C[NH+]1CCC1,0.2654
CC#CC(O)C(O)C#C,0.2685
CC1(CO)COC(=O)C1,0.2781
CNC12COC1CC2=O,0.1865
CCC1CCC(=N)OC1,0.2765
OC12CCC3C1C1C2N31,0.2936
C(C1CO1)C1=CN=CO1,0.2413
NC(=O)C(=O)C1CC1O,0.1764
CCC12CCC=C1CO2,0.2405
CC(C)(O)CC(O)CO,0.3094
c1c(c(on1)NC=O)N,0.2064
CCC(C)OCC(C)O,0.327
CCC1(CO)CC1O,0.3192
C#Cc1cocn1,0.2184
OCC1OC11C2CC1C2,0.3343
N=COCC1=CC=NO1,0.2437
OCC1=NC=COC1=N,0.1665
N=C1OCC1N1CC1,0.2545
CC1=NC(N)=NOC1=N,0.1507
N=COCC(C=O)C=O,0.2076
OC(C=O)C1=NC=CN1,0.1819
CCc1coc(c1N)N,0.2197
C1C(=O)CC1(CCO)O,0.2181
O=CN1C2CC3(CO3)C12,0.2442
C#CC12OC3C(C=C1)C23,0.219
O=C1N=NOC=C1C#N,0.1126
CCC12CC1CC=CC2,0.2659
CC1C(C#C)N1C(N)=O,0.2611
CC1C2C1C(C)(O)C2O,0.3069
CC1CN2CCC12C=O,0.192
N#CC12CC1C1NC1C2,0.2831
N#CC1C2CC1C2,0.3299
c1c[nH]c2c1CC(=O)O2,0.1956
CCCC1(CC1)CCO,0.3387
CCOC1=NCCN1,0.2765
COC(=O)C1(CN1)C=O,0.2153
C1CC(=O)OCC1=O,0.2227
CCC(CC=O)CC#N,0.2266
CCC1C2CC1(O)C2=O,0.2463
Cn1c(nc(n1)O)CO,0.2279
Cc1coc2c1[nH]cc2,0.205
CC12CC1CN2CC#N,0.2575
O=CC1CC2C3CC3C12,0.2195
CC(C)(O)C12CCC1O2,0.3338
O=CC1CC(=O)CN1,0.1989
CCCc1cnc(o1)N,0.2306
c1c(nc(nn1)O)N,0.1819
OC12CC3(COC13)CC2,0.3024
CC1CC=C2CN3C1C23,0.2134
CC(CC=O)C1CN1C,0.2076
CC1=C(F)NC(=N)C=N1,0.1536
c1c(nc(cn1)O)CO,0.1976
CCc1cncc(=O)o1,0.1687
CC1C(O)C(=O)C=C1N,0.209
NC1C2NC=NC12C#C,0.2267
COCc1ccoc1,0.2436
Cc1c(ncnc1F)F,0.2408
CC(C)CC(=O)NC=N,0.2412
CC1(CO)NC1(C)C=O,0.2153
CC1CN(C(N)=O)C1=N,0.2466
C1C=C2C3C4C1C2N34,0.1608
CC1C2CC(C)(C#C)N12,0.2634
Cc1cccc(c1N)N,0.2059
CCC1C(C)C1CCO,0.3342
CC1(C)C2OC2C11CO1,0.3222
CC1CC(O)C(O)C1,0.3168
CC1(CO1)C12CCC1O2,0.3167
CC(=O)N1CCOC1=N,0.2487
C1OC11CC2C3OC3C12,0.3114
COC1(CCOC1)C#N,0.2768
CC1CC(C2CC2)C1O,0.3139
O=CN1C2CC1C2=O,0.2355
CCOC(C)C#CC,0.2894
CC1OC1C1(C)CC1O,0.3203
CC(C#C)C1COC1=O,0.2713
CCC#CC1CN1C,0.2582
OC1(CC1C#C)C#C,0.26
O=C1C2COC1C=CC2,0.2075
CC1(CC(=O)CNC1)C,0.1976
OCC12CC1C1(CN1)C2,0.3126
CCN1C2C3NC3C12,0.2637
N=C1CCCC(=O)N1,0.2448
Cc1cnnn1C(C)C,0.2499
C#CC12CC1(CO2)C#N,0.2302
Cc1[nH]nc(n1)C(=N)N,0.2137
CC1CCC2=C1N=NN2,0.2379
CN1C=CC2(C1=O)CC2,0.2006
CN=c1cccc(o1)F,0.1678
CC1OCCOC2CC12,0.3144
CC(OC(=O)CO)C=O,0.2288
COC1=CNN=CC1=N,0.1705
O=C1NN=C(N1)C1CN1,0.2272
CC(=O)CCC(O)CO,0.2347
C1C2OC3CC2C1O3,0.3396
CC1C2OC(C)OC12,0.3348
OC1C(O)C2=CCOC12,0.2369
OC1CC2(O)CC12C#C,0.257
CC1OC(=N)C11CC1,0.2816
c1c[nH]c(=O)nc1N,0.1974
OCC1=COC(=N)C=C1,0.1651
CC1(CO1)C1(C)CC1O,0.3146
CC1C(=O)CNCC1=O,0.2035
c1c(n(nn1)C=O)CO,0.2006
OC1C2C(=O)C1C21CC1,0.2542
CC1OC11C2CC1(C)O2,0.3203
OC1C2CC1C2C#N,0.3021
CCCC1OC2CC12O,0.301
CC1CC23CC4C2CC134,0.2824
C#CC1=C(CCC1)CO,0.2054
CCOCC12CC1CO2,0.3058
CC(C)OCC(=O)OC,0.2745
CC1C=CC(C)C2OC12,0.2656
Cc1ccoc1CO,0.2292
CC12N=CN3C1C2C3=O,0.2075
CC1C2OC3C2C(O)C13,0.3073
OC1C2CCOC(=N)C12,0.254
CNC1=C(COC1)C=O,0.1772
COC1=NCC=CCN1,0.2216
N=C1OC2COCC12,0.2868
COC(=O)CC#C,0.2776
c1c(nc(o1)N)CCO,0.2354
O=CC12CC1C(C2)C#C,0.2252
OCC1CC(O)CCO1,0.3325
CC12CC1CC2(C)C=O,0.2254
CC1C2C3NC1C(=O)C23,0.202
CC(=O)C(C)(C)CO,0.2294
C1C2CCC3CCC3C12,0.3291
CC12CC3CCC1OC23,0.3131
N#CC12NCC3CC1C23,0.2482
NC1=C([O-])C=CNC1=[NH2+],0.1849
CC1=CC(=O)OC(=N)C1,0.2162
c1ccn(c1)CCC=O,0.1755
CCC1NC(=O)CC1=O,0.2079
NC=[NH+]C[C-](C#N)C#N,0.1134
C1CN1CC#N,0.281
c1nc(on1)CC(=O)N,0.2194
CN(C=O)C1CCC1O,0.2665
CCC1OC(=O)CC1O,0.274
OC1C(O)C11OC2CC12,0.268
OC12CC(O)(C1)C21CC1,0.3137
OCC12CN1CC(O)C2,0.2937
O=CN1CC2C3C1CN23,0.2705
NC1=CC2=NCC3C1N23,0.1866
CCC1(C)C2C3CC1C23,0.327
CCC1CCOC(C)=N1,0.2689
CC12CN3C1C3(C2)C#N,0.2749
CCC1C2C3C(C2O)N13,0.2985
CC(C)N1CC1C=O,0.2094
CN1C=NC(=O)OC1=N,0.2093
CCC1=CCC=CC=C1,0.1855
CCC#CCC(=O)CO,0.2273
O=C1C2C3OC2C3C1=O,0.1518
CCC12CC=CC1(C)O2,0.2471
CC1(NC=O)C(O)C1O,0.2637
C(COC(=O)CN)C#N,0.2556
CCn1ccnc1C,0.2458
CC12OC=NC1C2C=O,0.2191
CCC(C)C(=O)C1CC1,0.2287
O=C1OC2C3C2C2C3C12,0.2504
OCC1CCNC1C#N,0.2677
OC1CC(C=O)C2CC12,0.2215
O=C1C2OCC22CCN12,0.2175
CC1C2CC1C1(CC1)O2,0.3098
CC(O)CC#CC1CC1,0.2843
CC1C2CC2OC11CC1,0.3028
c1nc2c(o1)oc(n2)N,0.2071
CC1=CNC(=O)OC1,0.2236
C1C=CC2C3C4OC13C24,0.2375
CC1C2CC2C1(C)CO,0.3239
CC1C(C)C11CN=CO1,0.2568
CC12CC1(N)C(N2)C#N,0.2392
OC(CC1CCC1)C=O,0.2321
N=C1NCC2=C1N=CN2,0.2249
C(C1CO1)C1=CNN=N1,0.2505
COC=Nc1[nH]ccn1,0.1833
CN1C2C(C=O)C1C2=O,0.2106
Cn1ncc(=O)nn1,0.159
C(CNC(=O)CO)CO,0.2717
CC(O)C#CC(=O)C#N,0.1874
CCC1(NC1C=O)C=O,0.2049
CC1OC(C)C1OC=N,0.2724
CCN1CC23CC(O2)C13,0.2711
Cc1nc(c(o1)C#C)N,0.1808
OC1C2CC1C1CC2O1,0.3077
N#CC12CNCC1O2,0.242
C#CC1COC1CC#N,0.2841
C[NH2+]C1CC1CC([O-])=O,0.2738
COC1CC2(CO)CC12,0.3202
OCC12CC1C(=O)OC2,0.2718
CC#CC1C2C(C)CN12,0.2594
CC12CC(O1)C1NC1C2,0.3057
CC1(OCC1O)C1CO1,0.311
CC12CC=C3CC(O1)C23,0.2124
C1CC1C1OCC11CO1,0.3216
c1c2c(c[nH]1)CC=CC2,0.2367
Cc1c(onc1N)C,0.2376
O=C1COC2CC(C2)C1,0.2086
CCC1(C)OCC=C1C,0.2503
CC(C#C)C(O)CO,0.3019
CC1C2NC2C2OC12C,0.307
OC1CCCC(C1)C#C,0.3082
CC1(CCCC#C)CO1,0.314
OCC1(CO1)C(O)C#N,0.283
C#CC12CC(C1)O2,0.2553
CC1=C2C3CC3N2C=C1,0.2187
CCC1(C)CCCCO1,0.3178
CC1OC(CC#N)C=C1,0.2475
OC1C2CCC11COC21,0.3107
C1CC23CCC(C2)OC13,0.3193
OCC1C2C=CCC12O,0.2377
CC(C=O)C1(CC1)C=O,0.2276
CC1OCC1(C)C=O,0.2234
CC1(CCC(=O)N1)C#C,0.2649
C#CC(=N)NC=O,0.2037
CCC1C=CC(C)C1=O,0.2212
CCC1C2C3C(N13)C2=O,0.2276
COC1(CC1)C1CN1C,0.2938
NC(=[NH2+])[C-]1OC(=O)C=C1,0.1471
CC1(C)C=CC2C(O)C12,0.2323
CC1C2CC1OC2,0.3262
C1C2C3OC4C3C1=CC24,0.1145
CC1CCOC(=O)OC1,0.2987
CCC1=CCOC1=NC,0.2106
OC1CC11OC2CC12O,0.2937
CCC1CC(=O)C1CO,0.219
CC1=C2CN3C(C1)C23,0.1681
C1CC2(CC2)N=COC1,0.2557
O=C1C2C3C(C2C#C)N13,0.2384
CC(OC=O)C1(C)CC1,0.2846
C(#CC(=O)C(=O)N)C#N,0.146
O=C1C=CC23CC12CC3,0.1809
C#CCC12CC3C(C1)C23,0.299
OC1(C=O)C2CC1C2,0.2185
OC1(CC#C)CN2CC12,0.2713
CC12C3CN1CC23C#C,0.2581
CC(N=COC=O)C#C,0.2436
ON=C1CCC2COC12,0.2412
CNc1c([nH]nn1)C=O,0.1592
CC1CC2(C1)CN1CC21,0.304
COC1CCC1(O)C=O,0.2136
OCC1CC(O)C1=O,0.2172
CC1CC(OC=N1)C=O,0.2148
OC12C3OC3C3C1NC23,0.3094
CC1OC2C3CN3C12,0.2851
CC1CC2C3CC3C12O,0.295
CC12CC(O)C1CC2O,0.3011
OCC12C3C4C1C4(O)C23,0.286
CC12CN1C=NC2C#N,0.2423
CN1CC1COCCO,0.3031
O1N=NC=C2N=CC=C12,0.1133
CC1OC2C1CC21CC1,0.311
ON=C1C2CCC1CC2,0.2608
OC(CC#C)C1CO1,0.3096
C1NC2C1N1N=NC=C21,0.2419
CC1C2C3OC2(C#N)C13,0.2481
OC1CC2CCC(O)C12,0.2972
CC1=C(C)C(O)C(=O)C1,0.2159
CCC1OC2C1OC2=O,0.2479
CCOC1CCN=CO1,0.2769
OC12CCC34CN(C13)C24,0.2926
CNc1cnn(c1)C,0.2136
CNC(C#C)C(=N)OC,0.2369
CCC12C3C1N1C3CC21,0.2956
O=C1CNC11C2CC1N2,0.1905
CC1C2CCCCC12O,0.3175
CCC(=NO)CC,0.2545
CCN1C2COC(C)C12,0.3015
CC12CN1C(CC=O)C2,0.2144
COCC1CNC(=O)N1,0.3071
CN=C1N=NOC(O)=N1,0.2438
CC#CCOC(C)(C)C,0.2838
OC12CC1C1NC1C=C2,0.2427
CC(O)C1CC1,0.3376
CC(C)CC(C)CC#N,0.3455
CC1C(C)C1(C)O,0.3152
CC12CC(C)(C1)CC2,0.3641
CC1(CC(N)C#N)CN1,0.2804
O=COC12C3CC1OC23,0.243
CC1COC2CC2(O)C1,0.2915
CCOC(C)C#CC#N,0.2282
CC1CC2OC2C(=O)N1,0.2453
C1CC12CCOCOC2,0.3228
O=CN1C2CC1CC2,0.2556
CC1C2CC=C(C#C)C12,0.2012
C1OCC2OC2CO1,0.3311
C1CC1C1OC11CCC1,0.3324
COCCC1(C)CC1O,0.3288
N=C1CC2COC(=N)N12,0.2566
C1OC23CC=CC2CC13,0.2528
OC1C2CC1(C=C2)C#C,0.2418
O=C1C2CC2C11CC1,0.2293
CC(C)c1c(cc[nH]1)O,0.2289
C1C(=C(C(=O)O1)C#N)N,0.2047
O=CNCC1C2CCC12,0.2805
CC12CC3CC1CC3C2,0.367
CCC1CN2C(C=O)C12,0.2026
CC1=NCCC=CCO1,0.251
CC1C(O)CC1C1CO1,0.3127
COCc1ccon1,0.2525
CN1C2CC(CO)CC12,0.2891
CC1(CCC1)CC#N,0.3349
CC12COC1C1OC1C2,0.3036
CN1CC2(CO2)C1(C)C,0.2853
COCCC(O)COC,0.3273
CCN1CC2(CN2)C1=O,0.263
CC12COCC11CN2C1,0.2965
Cc1cc(co1)COC,0.2361
C#CC(=O)CCCCO,0.2083
CC1=CCCOC(=O)C1,0.241
CC12CC1(C)OCO2,0.3085
OCC(CC#N)N1CC1,0.2826
CC12CC3OC(C1)C3C2,0.313
OC12CC3(CCC13)CC2,0.309
CC1C2CC1C(O)CC2,0.3247
CC(CO)C1=CN=NN1,0.2548
CC(=O)N(C)CC1CC1,0.2649
Cc1[nH]c(=NC)on1,0.224
C#CCN1CC2OC2C1,0.2579
CC1(COC11CC1)C#C,0.2733
CC12CC1C1CN21,0.2921
OC1C2C1C(=O)C1CN21,0.2095
CC(C)OCCC1CC1,0.3335
CC12C3C1C1(O)C2C31O,0.2613
CC1CC1C1(CN1)C#N,0.2902
N=C1OCC(=O)C11CN1,0.203
O=C1C2OC2CC2CN12,0.2332
CC(C)C1C(O)CC1O,0.306
CN1C(=N)OC=C1C=O,0.1462
CNC(C#N)C(F)(F)F,0.2784
OCC12CCC(O1)C=C2,0.2583
CC1=CCC2CC12C,0.2481
C1CC2C=CCCCC12,0.2531
COC=NC1CC1,0.2512
NCC(=O)OC=N,0.2313
Cc1c([nH]nn1)NC=O,0.2049
C#CC1(CCCC1)CO,0.3062
CCNC1=CC(=N)OC1,0.2107
CC1(O)C2OC1C21CN1,0.2985
COC1CCCC1OC,0.3144
CC1NC11COCC1C,0.313
C1OC23CCN4C(C24)C13,0.3063
Cc1c(cncc1N)N,0.1961
OC1=COC(=N1)C1CN1,0.2088
CC1(CN2CC12)C=O,0.2121
CC1N=CNC(=N)C1O,0.2271
CC1C(N2CC2)C1(C)C,0.3154
C(C(=O)C=O)C(F)(F)F,0.158
CC1(CCC(O)C1)C=O,0.2313
N#CC12CN(C1)CC2,0.2695
CN1CC2(O)C(O)CC12,0.2949
CN1C(=O)C2CC12C#N,0.2355
N#CC1CCC(N1)C#N,0.2753
CN=c1ncoc(n1)F,0.2043
CC1C2OCC1(O)C=C2,0.2476
CC1C(O)C2CC(=O)C12,0.2177
CC(O)CC12CCC1O2,0.3248
CC1NCC(=N)NC1=O,0.2277
CC12OC1C1CC(=O)C21,0.213
C#Cc1c(c[nH]n1)C#N,0.2218
CC1(CC=O)CN1C=O,0.219
OCC1(CC1C=O)C#N,0.2175
C#CC1COC=NC1,0.2684
CCC(NC=O)C1CO1,0.2811
CC1C2C3C2C2(CC2)C13,0.3306
c1cc(ncc1C#N)O,0.2056
CC1OC2C(O)CC12C,0.3069
C(CC(=O)C(=N)N)CO,0.183
c12c(nn[nH]1)oc(=O)[nH]2,0.2118
CC1NC11CC2(O)CC12,0.3086
OCC12CC(C#N)C1O2,0.2996
CCC1OCC2CCC12,0.3238
OC1C2OCOC1C=C2,0.2246
C1OCC2C3C4C(C13)N24,0.3234
c1c2c(c[nH]1)NCCC2,0.2223
CC1CC11CC(=O)O1,0.281
CC(O)C12CC1OCO2,0.2976
C#CCc1c(ocn1)N,0.2178
CCCOC(CC)C=O,0.2134
O=C1OC2COC(C2)O1,0.315
CC(CCCO)OC=O,0.2756
c1c(nc(c(n1)O)F)F,0.1888
CC1CNC(=O)C=C1,0.2069
NC(=O)OC(C=O)C#N,0.2296
OC1(CCCC=C1)C=O,0.2064
c1c(=O)cc([nH]c1N)N,0.206
OCC1CCCN2CC12,0.291
C1CCC(CC1)(CO)O,0.3137
OCCN1C2CC1C2=O,0.2511
CN1C=NCCOC1=N,0.2299
OC1CCOC(=N)C1=O,0.1956
N#CC1C=CC2CCC12,0.2594
CC(CO)(OC=N)C#N,0.2774
CN1C(C#C)C1C1CC1,0.2546
C1CC(C1)COCC#N,0.2918
C(C#N)n1nc(nn1)O,0.2299
C(CO)c1nc(no1)O,0.2436
C1NC23CCN=C2OC13,0.2396
CC12COC(CN1)C2=O,0.2018
CC12CC3C1N(C2)C3=O,0.2246
CCOc1cc(co1)N,0.2275
OCCC1COC(=N)O1,0.3094
CC1C2C3OC(=O)C1C23,0.2689
C(CO)C(C#N)(C#N)O,0.2926
CC1NC(=O)C11CC1,0.277
N#CC1NC2CCC2=C1,0.2248
CC(C)(C)C12CC1CC2,0.3197
CC1(O)C(CC1=O)C#C,0.2051
Cc1c(oc(n1)C=O)N,0.1568
CC1OCC(C=O)C1C,0.2227
CN1CC1COCC#N,0.2429
COC(=O)CCC(C)O,0.2872
Cc1cnc(nc1F)O,0.2153
CC1CCC2OC2C=C1,0.2552
CC1CC2CC2(C)C1C,0.3251
C1C2C1C1CCCCC21,0.3239
C#CCCC12CC1OC2,0.2866
CC(C)CC1C(C)C1C,0.3348
CC1=NC(CO1)C(N)=O,0.2525
c1c(cnc(=O)[nH]1)F,0.1671
CC(C)(O)C1CC1(C)O,0.3042
COC1C2OC(=N)C12C,0.2714
OC(C#N)C1(CC1)C#C,0.2787
Cc1c[nH]c2c1occ2,0.2032
c1c(ocn1)CC2CC2,0.2416
Cc1ccc(nc1)NC,0.1872
O=C1OC2CCCOC12,0.2505
CC12CC(C3OC13)C2O,0.3156
CCC1CCC1(C)C#N,0.3278
OC(CN1CC1)C#C,0.2667
C1C2CC3CC2C1C=C3,0.2537
O=C1OCCC(O1)C#C,0.2908
CC1OC2C3OC3(C)C12,0.3235
C1NC11CCN=COC1,0.2578
CC(=NO)C1(CC1)CO,0.2434
Cc1cnc([nH]c1=O)N,0.1931
c1c(c(c(nn1)N)O)O,0.2061
COCC1NC1C(C)=O,0.2221
O=C1NC2CC3C1N3C2,0.2579
CC1=CC2CC3C(C1)C23,0.2509
CCN1CC(N)C1C#N,0.2544
OC1C2CC(CC12)C#C,0.3091
C1C2CC11OCCC1C2,0.3221
CC(CC1CN1C)C=O,0.2019
N#CC1CCCC=CC1,0.257
CC1(CO)CC2CN12,0.3011
CN1C(=N)NN=C1O,0.2407
O=C1CC2CC2OC1=O,0.1815
CC12CC3C4CC3N1C24,0.3278
CC1(C=CC(=O)N1)C,0.2149
C1C2OC2C=CC2OC12,0.2521
CC(O)CC(=O)C(C)=O,0.1561
c1nnn(n1)C(=O)CO,0.2132
CC(C#N)C1CN1C,0.2702
OC1CC2=NNN=C2C1,0.2436
CC(CO)C(=O)CC#N,0.2246
C#Cc1c(onn1)CN,0.2035
CC1OC=NCC(=O)O1,0.2553
N=C1OC=NC(C=O)=C1,0.1524
CC1COCC11CC1O,0.3155
CC#CC(C)OC1CC1,0.2821
CC(C)(CO)C=O,0.2251
COC1C(C#C)C1(C)C,0.2755
CCC12NC1CC21CN1,0.2887
O=CN1C2CC1C21CN1,0.2504
CCC1NC1(C#C)C#N,0.2586
OC1CC2C=CC1C2=O,0.2375
NC1=CC(OC=N)=NO1,0.2235
CNC(=O)NC=O,0.2438
Cc1[nH]c(cn1)C#N,0.2113
Cn1cccc1CC#C,0.2365
c1cnc(nc1)N,0.1989
CC1N2CC1(CO)C2C,0.2863
CC1=CCCOC1=NC,0.2111
C1CC23COCC2(C1)N3,0.3024
CC12CN1C(=O)CC2,0.2418
CC1(C)CC2OC2CO1,0.3289
OC1C=CC2OC12C#N,0.2349
CC12CC3C4NC4C1N23,0.2904
CC(=O)CCOCC#N,0.2355
CC([NH3+])(CC#C)C([O-])=O,0.2621
O=CC12CC3OC(C1)C23,0.2136
CC1C2(C)CC1(O)C2C,0.327
O=C1C2CN3CCC2C13,0.2258
CC12OCC1C1CCC21,0.3088
CC(C#C)C(=O)NC=O,0.2157
c1cnoc(=O)c1C=O,0.1479
CCOC(=O)C(C)C,0.2814
N=C1CN=C2OCC2O1,0.255
OC1C2C=CC3C2C13O,0.2189
C(C1CO1)C1COC1,0.3215
C#CC1=NC2CC2O1,0.2096
Cc1cnc(nc1)C=O,0.1786
CC1CC1(O)C1CO1,0.3239
C1CC12CCOCC=C2,0.2491
Cc1c(cc([nH]1)C#N)N,0.1824
c1[nH]c(c(n1)O)CC#N,0.2265
CCNc1c(nco1)C,0.2157
CCC(CC)OC,0.3265
CC1CCC2(O)CC2O1,0.3156
c1c(c(c[nH]1)O)C=O,0.1878
CC1(CN1C(=O)OC)C,0.2887
CC1=C(F)C(=N)C=NN1,0.1741
CC1=C(C)C(=N)N=NN1,0.1698
C1CC23CC=CC2CC13,0.2584
O=CC(CC#C)N1CC1,0.2138
CC12NC1C1C2N1C=O,0.2599
CCN=C1OC2C(C)C12,0.2681
N=C1NC(=O)CNC1=O,0.2148
OC1C2CC(CC12)C=O,0.2261
CC(C)(C=O)C(=O)NC,0.2154
C1CC=CC2OC2C=C1,0.216
CC(C=O)C1(C)CC1C,0.218
CCN1CC2OC(C)C12,0.2911
CC(C)CC1COC1,0.3141
CNc1cnn(c1O)C,0.2472
CC12NCC1C2(N)C#N,0.2661
OC1CCC1OCC#N,0.2651
CC(CC=O)C1CC1,0.2278
O=CC(C#C)C1CCC1,0.2187
c1c(cnc(c1F)N)N,0.1754
C1C2CCCC3CC12O3,0.2943
COC1C2CN2C1C=O,0.2098
CC(C)c1cnco1,0.2429
COC1=NCC2CN12,0.2701
CC12CN1C1CC21C=O,0.2021
CC1(CNC(=O)O1)C#C,0.2813
CC1CC(O)(CO)CO1,0.3027
CC1C(O)CN1CC#C,0.2599
CCNC(=O)C(=NC)N,0.2153
OC(C#C)C#CCC=O,0.2211
C1COCCC1N2CC2,0.319
[NH2+]=C1NCC2=C1[N-]N=N2,0.1845
C1C2C3OCC=C3CN12,0.2397
O=COC1COC1C=O,0.2137
OC1CC2=C(C1)C=CN2,0.2384
O=C1CC=C(N1)C1CO1,0.2075
C1COC(OC1)C=O,0.2243
CC1NC11C2CN2C1=O,0.2277
CC12CC1(C)C(C)(C)C2,0.3127
[NH3+]C1CC1(O)CC([O-])=O,0.2714
NC1=NC(=N)C(F)=NO1,0.201
CC(C)N1CC(O)C1=O,0.2629
N=C1C=NNC(=N)N=C1,0.1518
CN(C=N)c1[nH]ncn1,0.2232
CC1CC2(CC2)CC1=O,0.2183
Cn1cc(nc1)CCO,0.2471
COC12CC1CC2C,0.3253
CC12OC1(C)C(=O)C2O,0.2147
c1c(c[nH]c1N2CC2)N,0.2201
Cc1nc(on1)NC=O,0.2256
CC12CC3C4CC1C4N23,0.2843
CC1(CN1C=[NH2+])C([O-])=O,0.2628
COC1CC1(O)CC#C,0.2784
OC12CNC(C=C1)C2=O,0.2083
CC1(C)CC2OC1C=C2,0.254
OCC1OCC2CCC12,0.3261
ON=C1C2CN2C11CC1,0.2285
CN1CC2(C1=O)CCC2,0.2769
CC1NC1C1NC1CO,0.3075
CCC1C2OC2CC1=O,0.2228
C#CC1OCCCO1,0.3009
C#CC1C=C2CC3C1C23,0.1763
C1CC2OC2COCO1,0.3364
C1C(=O)NC=CC(=O)O1,0.1968
CC1(NCC2CC12)C#N,0.2786
CCC1C2OC1C2OC,0.3122
O=C1CCN=C2CCN12,0.2291
CC1(CO1)C12CC1CO2,0.3077
CC1OC2CC2(C)C=C1,0.2453
CC(=O)C12CC3C1CC23,0.2176
CC1(CC#C)NC1CO,0.2868
C1CC11CC2CC3C2C13,0.3324
COCC1C2C3OC2C13,0.3083
CC1CCC(=C1)C1CO1,0.2433
CC1(C=O)C2CCC12O,0.2274
CCC(C#C)(C#C)C#C,0.2893
C#CCC1(CC(=O)C1)O,0.2195
CC1C2C(CO)CC12O,0.3183
CCC1C(C)C1(C)CO,0.328
CNC1(C)CNC1C#N,0.2445
CC1OCC2(OC12)C=O,0.2133
CC12CC1C1CC1CO2,0.2915
O=C1NC2CCC1OC2,0.2587
Cc1ccnc(c1C)O,0.2099
CNC(=O)c1cnc[nH]1,0.214
CC(O)C1=CC=CN1,0.2386
CC(O)C1(CN1)C(N)=O,0.2646
COC1CC=CCCO1,0.2571
CCC1N2CC(=O)C12C,0.217
CC12CC(O1)C=CC2,0.2416
CC1CC1(O)C1(C)CC1,0.3091
CC12CN3C1C3(C2)C=O,0.22
c1[nH]c(c(n1)N)C2CC2,0.216
CC#Cc1cc(on1)N,0.2048
OCC1CCC(O)CO1,0.3248
CNC1(COC1)C#C,0.2674
CC1CC2OC2C(C)C1,0.3366
Cc1c(cn[nH]1)C2CC2,0.2408
Cc1c(oc(n1)C)OC,0.2273
CC1C2C3C(O)C2(O)C13,0.3082
N=C1OCCC2CC1C2,0.273
O=C1NC(CCO1)C#C,0.2839
CC12C3CN1C1CN3C21,0.2619
c1coc(n1)C2(CC2)O,0.234
CC1C2N1CC2(C)C,0.2969
C1CC1(C=O)OCC#N,0.2258
CC(CCO)C#CCO,0.2828
CC1CC11NCC1=O,0.2097
C1CCC(=NO)C=CC1,0.1978
OC1C2OCC1C(=O)O2,0.2678
CC1C=CC2C(O)C12O,0.2268
CC1C=CC2=C1NC=N2,0.1926
OC12C3OC11COC2C31,0.2893
CC1CC2(CC12)C1CO1,0.3263
c1coc2n1cc(n2)N,0.1969
CC#CC(O)C1CN1C,0.2581
O=CC1COC(=O)N1,0.2161
C1COc2c1c(n[nH]2)O,0.2541
CC12CC(O1)C(=O)C2=O,0.1418
OC12CC(C1)C21CC1,0.3323
C#CCCCCC1CO1,0.316
FC1=CNC(=O)NC1=N,0.1961
CNC(CC([O-])=O)=[NH+]C,0.2369
CC1(CN1C=O)C#C,0.2512
CC1NC(=O)C1(O)C#C,0.2471
CCN=COC=O,0.2403
CC(C)(C)C(C)(O)CO,0.3142
CC1(C2CN2)C(O)C1O,0.2834
OC12CCOC1C=CC2,0.2615
CC1C2C3OC3(C#N)C12,0.2707
O=CC12OC3C1NC23,0.2036
CC1CC2(OC12)C1CC1,0.3222
CN1CC(=NO)C1C#C,0.2285
CC(O)C1(CO)CC1O,0.3114
CC1=CC=CC=CC=C1,0.161
C#CC1C2COCOC12,0.2823
CC1OC(=N)CC1C#N,0.2803
O=CC(C#C)N1CCC1,0.198
CC1C2CC(=NO)C12O,0.2409
CC(C=O)C#CCCO,0.2173
C[NH2+]C(C#CC)C([O-])=O,0.254
CC(=O)c1[nH]nc(n1)N,0.1628
COCc1coc(n1)N,0.2377
C1OC2COC1C2,0.3354
CC1(O)C2CC1OC2,0.3203
COC1=NNC(=N)N1C,0.2408
C(=O)c1nnon1,0.1836
CNc1cc([nH]n1)N,0.2286
CN(CCC#N)C=O,0.271
CC1COC(CO)C1,0.3312
NC1=COC(=N)C=N1,0.1345
C(#N)C(=O)C#N,0.1977
CCCCOC(=O)NC,0.3159
OCC1C2CC1N=CO2,0.2627
CC1(CC=CC1)C1CC1,0.2651
N#CC1NCC1C1CC1,0.2666
CCC(CO)C(O)C#N,0.2948
CC(O)C1C(O)CN1C,0.2998
CN=CNc1ncco1,0.2104
CC1(C)C2C3CC1C23,0.3367
C(C(=O)N)N(C=O)C=O,0.2167
NC1(CO)CNC1C#N,0.2528
O=C1CC2(C1)OC1CC21,0.2121
C1C2C3CCC=CC1C23,0.2554
CN1C=CCCOC1=O,0.2269
c1c(nc([nH]1)C=O)C#N,0.1871
CC(O)C#CCCCO,0.2904
CCC(CO)C(C)C,0.3384
c1nc(c(o1)CC#N)O,0.2198
CC1CC(O1)=NC1CC1,0.2525
CC1C(CC1=O)C(C)=O,0.2196
NC1=NNN=CC1=N,0.1651
OCC1=NCC(O1)C#N,0.2656
CC(C)COC(=N)C#C,0.2384
OC1CC1C1(CN1)C#N,0.2826
CC1(C)C2CN=COC12,0.2732
N=C1N=NOC(C=O)=N1,0.1622
C(CCC=O)CCO,0.2291
CC1(O)C2NC1C2O,0.3003
c1coc2c1CCO2,0.2214
O=C1NC=CC2CC2O1,0.2107
CCC(CC=O)C(N)=O,0.2253
CC([NH3+])C1=CN=C([O-])O1,0.1686
CC1=C2CC3C2C3(O)C1,0.1779
CCC1=CC(=O)C2NC12,0.1798
CC1OC(=O)N(C)C1=N,0.2587
CCCC1NCC1=O,0.2184
O=CC1CCCC1C=O,0.2152
CC12OC3C(C13)C2=O,0.2255
NC(=O)C12CC(C1)O2,0.2682
Cn1c(cnc1O)OC,0.2467
CC1=NNC(=N)C=C1F,0.1609
N=C1OC2CCOC2O1,0.3116
CC1(CN1)C(C=O)C#C,0.2179
CC(O)C1=CNC=N1,0.2517
COC1CC(O)C11CC1,0.323
CCC12CC3N(C1)C23C,0.3007
C1OC1C12CC3CC1C23,0.3313
OC1CC2OC3CC12C3,0.3051
CC12NC1(CO)C1CC21,0.3373
CC(OCC#N)C=O,0.2266
NC(C#N)C1CCO1,0.2888
CCC1=CC(=N)N=CO1,0.2062
CC1=CC2OCC2C1O,0.249
CC1(CC#N)COCO1,0.2998
C1CNc2c1nc(o2)N,0.2117
CC1CCC(C#N)C1C,0.3349
CC1=NNC=C1C1CO1,0.2528
Cn1cnc2c1cno2,0.2089
OCC12CCC1(O2)C=O,0.2179
CCC#CC12CCC1N2,0.2667
c1c2c(n[nH]1)OCC2,0.2328
C#CC1C2CN1CCO2,0.2519
CC1(C)CC2(CO2)CO1,0.3276
CC12OCC3C4C1C2N34,0.2738
CC12CC3C(C13)C21CC1,0.3254
N#CC1CC11COC1,0.2792
O=CC1=NCC2CC2N1,0.1676
OC(C#C)C(=O)CC=O,0.2065
c1c(nc(c(n1)N)O)O,0.1674
c1c(cncc1N)C#N,0.1778
[NH3+]C1(CCC([O-])=O)CC1,0.2719
C#CC1N=CNC1C#N,0.2471
C1C2CC1C1OCC2O1,0.3342
CC#CCC(C)(O)C#N,0.2756
OCC1NC11CCCC1,0.3134
CC(CC=O)C(O)C#C,0.2266
OC1C(C#C)C(O)C1=O,0.2004
CCOC1C(C)NC1=O,0.2566
O=C1C=CC2OC2C=C1,0.1772
CCC1CC(=O)OC1C,0.2782
CC1(CCC(O)C1)C#N,0.3258
CCC1=NC2CCC2O1,0.2618
c1c(c(no1)CN)C#N,0.2141
N=C1OC2CCC1CO2,0.287
OC12CC(NC1=O)C=C2,0.2233
OC1C2CC1(CC=O)O2,0.2208
C(#CC(=O)C(=N)N)C#N,0.1536
OC1C2CC(O)C(=O)C12,0.2101
CC1CC1(C=O)C#N,0.2258
COC1(CO)COC1=N,0.2523
COC1CC2CC3C1N23,0.3086
CCOC1COC2CC12,0.3113
O=C1OC2C(CC#C)C12,0.2631
CC(C#N)C1OC1CO,0.3028
CCC(C)CC(C)C#N,0.3458
CC1CC(C)(CC#N)C1,0.3286
O=CN1CCCC1C#C,0.2668
CC(CO)C1(C)CO1,0.3329
CCCNc1cnco1,0.2188
Cc1ncncn1,0.2184
OC1C2NC3(CC3)C12O,0.2922
OCCC1NC11CCC1,0.3174
OC12CC3C1C2C31CN1,0.3092
C1CC(=O)OCCC1=O,0.2242
O=C1NCC2CC=CC12,0.2415
O=C1CCCCC2CN12,0.2496
C1C=CC23CC=CC2C13,0.2277
OCC1CCCO1,0.3242
ON=C1CNC1C1CC1,0.2324
COCC(C)CC#C,0.3094
CCC(C)N1CC(=O)C1,0.2064
CC1N2C3CC1(C)CC23,0.3094
Cn1ccc2c1OCO2,0.2104
C1CC1(CCO)CO,0.3294
C1CC1CC(=O)CO,0.2353
Cn1ccc(c1)C(=O)N,0.2211
OC1CC1C1=CC=NN1,0.247
CC12OC1C1CCCC21,0.3286
C1Cc2c(non2)NC1,0.2043
CC#CC(CO)C1CC1,0.2991
CC1C2OC(=N)OC12,0.3011
CN1C2CC(O)CC12,0.2844
CC1(O)C2CC(C=O)C12,0.2189
O=C(C#C)C12CN(C1)C2,0.1631
CC(CO)NC(N)=O,0.3001
CC12OC3C1C2OC3=O,0.2395
OCC1CC2(CO)NC12,0.2757
CCC1OC(=O)CC1=O,0.2105
CC1CC11CCC(C)O1,0.3103
CC12CN=CN1CC2=O,0.2071
CN=C1OC(C)(C)C1C,0.2774
CCC1OC(=O)C1C=O,0.2245
O=CC1OC(=O)NC=C1,0.1924
CC1(C)CC(=O)C2NC12,0.2155
CC1C(=O)C2CC12C,0.2268
C1CC2(C1)CN2C(=O)N,0.2862
COC1CCC(C)=CC1,0.2617
CC1OC2CC3C(O2)C13,0.3141
CN1CCC(=C1)C(=O)N,0.1862
c1nc(c2n1CC2)N,0.2234
CC1CC2NC2C11CN1,0.2993
CC12OC3CC1C2C3=O,0.2073
CCC12COC(=O)C1O2,0.2492
CC12COCC1C2C#C,0.2889
CNC(C#N)C1(C)CC1,0.2771
CCOC1C(O)C1C#N,0.28
OC1(C2CC1[NH2+]2)C([O-])=O,0.2737
c1cc(oc1)C(F)(F)F,0.2357
OCC1(CC1)C1CC1O,0.314
N=COC1=COC(=O)N1,0.21
N=C1OC(C=O)=CC=N1,0.1369
CC1(C)C2C3OC3C12O,0.2834
CC1OC2C=CCC12,0.2498
CC12CC3C(C1)C(O)C23,0.331
CCN1CC(C1)C#N,0.2583
CC(C)OC=NCC#N,0.2709
OC12C3CC1CC23C=O,0.2247
CC1C2CC3CC2CC13,0.3645
CC1C2C(N2C)C1(C)C,0.2997
COCC(C)(O)C1CC1,0.3246
Cc1c(n[nH]c1N)C,0.2432
CCC1C(C)OC11CC1,0.3006
CC12CC3C1C1C2CN31,0.2807
C1C2NC3=NNN=C3C12,0.2075
CC1C=CC(=O)CC1O,0.1849
CC12C(O)C1CC1NC21,0.2797
CC12NC1C1(CO1)C=C2,0.2289
CC1C2C3CC(=O)N1C23,0.2294
c1c(onc1NC=N)N,0.2126
CC(C)(CCC#N)C#N,0.3408
CCC(O)C1=NOC=C1,0.248
C1CC11C=CC2COC12,0.2442
CC12OC1C1COC2C1,0.3246
C#CCc1nc([nH]n1)N,0.2524
ON=C1CCC(O)C=C1,0.1929
O=CCC1C2CC3C2N13,0.2202
CC1CC(O)C2CC2O1,0.3133
CC(C)C(O)C=O,0.2321
NC1=CC(=O)C2CC2C1,0.1979
COC1(CO)CCC1=O,0.211
C1C=CC(=CCO1)CO,0.206
CC(NCC#N)C1CC1,0.268
O=C1OCCCC1C#N,0.261
Cc1ccnc(n1)OC,0.2122
C#CC12CC1C=CCC2,0.2375
CC12CC3(OC1C23)C#N,0.2477
CC12CC(C1)C2CC#C,0.3153
C1CC2C3OCCC23C1,0.308
CCOC(C)(C)CC#N,0.2979
CC1OC11CCOCC1,0.3294
CC1CC2(C)OC1C=C2,0.2554
CC#CC1CCC11CO1,0.286
CC12CC3CC(C1)OC23,0.3317
C1OC11CN2C=CC=C12,0.2404
CC1(O)CC(C1)=NO,0.2494
O=CC(=O)CC1CCO1,0.1546
CCC1=CC(C)C(=O)N1,0.2138
c1cc(oc1)C(=O)CO,0.1912
CNC(=O)NC(=O)CO,0.2393
CC1CC(C)C(=O)CN1,0.1966
C1OC23C1NC1C2NC31,0.2793
CC1=NC(=N)C(O)=CN1,0.1878
OC1C2CC(=O)OC12,0.278
CC#CC(C)OC=N,0.2799
CNc1cncoc1=O,0.1655
c1cn2c(n1)ocn2,0.2115
N=C1NC=NN1CC#C,0.2131
CCCC#CC(=O)C#C,0.1879
CNC(C#N)C(N)C#N,0.2729
CC12NC3C1OCC23O,0.2814
OCC1CC=C(C1)C=O,0.1948
C(#N)C#N,0.277
CC1OC2CCC12,0.3186
CCC(C)(O)C(C)=O,0.2292
OCC1CCCOCC1,0.3169
N=C1OC=NC=C1C=O,0.1591
CC12CC3CC1OC23C,0.3222
CC12CC(C)(O1)C1CC21,0.3383
O=CC1OC2COC12,0.2144
N=C1C=NC(=O)NN=N1,0.1707
COC12CC3OCC1C23,0.3294
CC1(O)CC2(NC12)C#C,0.2558
CC1(OC(=O)C1O)C=O,0.2187
O=C1CC23CC4C2OC134,0.1905
CC1N2CCC3C2C13O,0.2838
C#CCCC1CC1,0.3155
[NH3+]CC1=NC(=N[N-]1)C#N,0.2215
Cc1ccoc(=NC)c1,0.1663
CC12CCC(O)(C1)C=C2,0.2577
COC1C=CCC11CO1,0.2552
c1cncc(=O)cn1,0.1577
CCOCC#CC1CN1,0.2616
OC1CC(NC=O)C1O,0.2773
OCC1(O)C2C3CC3C12,0.2811
N=C1N2CC2C=CC1=O,0.1564
CC1C2OC3C2NC13C,0.3037
CNCC([NH2+]C)C([O-])=O,0.2643
C1CC2(C1)CC(C2)C=O,0.2224
CC1(CCC=C1)C#N,0.2612
CC(C)C(O)C(O)CO,0.3197
c1coc(c1N)N(=O)=O,0.1614
Cc1c(cco1)OC=O,0.2196
CC12OC1CC(CO)=C2,0.2415
CC1C2CC2OCC1=O,0.2119
O=C1C2C3CN4C3C1C24,0.2269
c1cocc1OC=O,0.2351
CC12CC3(O)C1C=CC23,0.2266
CC1C2C3NC(=O)N1C23,0.251
CC12NC1C1OC(=N)C21,0.2653
CC12OC1(C)C1CC2O1,0.3108
OCC1CC2NC12C=O,0.2028
OCC12CCC1(O)CO2,0.2942
CC12CCC1(O2)C#N,0.2694
C1C2CC3=C(NN=N3)C12,0.2328
C1C2C3C=CC4C1N2C34,0.222
CCC1(O)CCC1=O,0.2176
OCCC1CC1C1CC1,0.3252
C1C2OCC3=CCOC123,0.2142
CC1(C)C(C=O)C1C=O,0.2108
CC1CC(C#N)C2CN12,0.2813
CC1C(CCO)N1C,0.2899
CN1CC(C1)C#CC#N,0.194
CC#CCCC(=O)C,0.2254
CC12NC1CC2CC#N,0.2812
CC(O)CO,0.3228
N=COC1C2NC1C2=O,0.2445
C[NH2+]CC1NC1C([O-])=O,0.2602
CC1(C)CC2NC2C1O,0.3072
CC1OC(C#C)C1=O,0.2127
CCC1CC11CC(C)C1,0.3404
CC(C)(CC=O)O,0.2242
CC(=O)C1CN1CC#C,0.2032
CC1C2C1C1C2NC1=O,0.2607
ON=C1C(O)CCC1O,0.2417
CNC1=CC=NNC1=N,0.1679
Cc1ncc(nn1)CO,0.1633
CN(C=O)C(C#C)C#C,0.2615
N#CC1C2CC=CCC12,0.2663
C1CC1C1OC2CCC12,0.3153
O=C1OC2CC1CO2,0.2751
OC1CC23COC2C1C3,0.2968
CNC(C#C)C(=O)C#C,0.1657
COC1C2CC3OC1C23,0.2953
CC12C=CCC3C1CN23,0.2279
c1c[nH]c2c1nccn2,0.183
CCN(C=O)C1(CC1)C,0.2696
CC12CC(O1)C(=O)C=C2,0.1703
CC1=CCCC1(O)C#N,0.2521
Cc1cnc(cn1)C#C,0.1882
CCNc1ccoc1,0.2208
CCc1ncc(=O)on1,0.1598
OC1(C2CO2)C2CC1O2,0.313
CC12OC1(CC2O)C#C,0.2585
CNC(=NCC#C)C=O,0.1561
CC1CN2C=C(N)N=C12,0.2157
C1C2C3C1N2C31COC1,0.311
CC12NC1CCC2=O,0.2147
OC1CC2(O)C3OC2C13,0.3048
CCC1=NCC(O1)(C)C,0.2705
OC1(C2CC2)C2CC1C2,0.3277
OCC(CO)C1CC1O,0.3086
CC1(C)C2OC3CN1C23,0.2791
Cc1coc(=O)[nH]c1=O,0.2181
N=C1OCCC1C#N,0.2745
O=CC1CC1(C=O)C#N,0.1927
N=COC(C#N)C1CO1,0.2772
CCC1C2C(C)C2C1C,0.3229
O=CC1C=CCC2CC12,0.2133
CC12C3C4C1CC2C34O,0.3099
CC(C)c1nc([nH]n1)N,0.2551
CN=C1C=C(N)NN=N1,0.1545
COCC1OC1C#C,0.2743
Cc1c2c(c[nH]1)nc[nH]2,0.1913
c1nc(nnn1)CC#N,0.1617
CC1C2C3N(C)C1C23C,0.283
C1CC11OCC11CO1,0.3041
c1c[nH]c(c1N(=O)=O)N,0.1564
CC12CC1N=CNC=N2,0.2041
N#CC1C2C3CC1N23,0.2826
C#CC(C(=O)N)C(=O)N,0.2549
OC1C2OC1C2C#N,0.2878
C1C2OC1C1C3OC1C23,0.2937
c1cn2c(n1)OC(=O)C2,0.1995
CC12CC3CC(CC1)C23,0.3435
C1C2CC11C=CC3C2N13,0.1879
CN1CC=CC1CC#N,0.2196
OCC1(CC2CC2)CN1,0.2988
CC1CC(N)C1(N)C#N,0.2713
CCn1ccc(c1C)C,0.2371
CCC12CC3C4C3N1C24,0.2956
CCC1CCC(O1)=NC,0.2733
CC1COCC2CC1C2,0.3254
C1CC23NC12CC1NC31,0.2925
CC1C2COC2C1=O,0.1985
c1c([nH]c(=O)nc1N)N,0.2048
C1NC11CC2CN2C1,0.3057
N#CCC12C3C4C3N1C24,0.2588
O=C1CCC2C3CC2C13,0.2197
CCC12CN3C1C(O)C23,0.2884
CN1C=NC=C1OC=N,0.2194
C1CC2=C(C1)NC(=O)C2,0.2069
OC1COC(=O)C1O,0.2753
CC(CC1CC1)C(N)=O,0.2766
Cc1cnoc(=O)c1C,0.1812
COC1C2NC1C2OC,0.3187
OCCC1CCC1C#N,0.2984
CC1CN1C(=O)OC=N,0.2596
OC1CC2=C(C1)C=CO2,0.2307
CC(NC=O)C=O,0.219
c1[nH]c(c(n1)C#N)N,0.2189
COC1C2CN3CC1C23,0.28
CNc1c[nH]cc1C#C,0.1971
CC(O)C(O)C(C)C#N,0.2965
CCc1c(=O)nnon1,0.1531
NC1=C(N)C(=N)ON=C1,0.1529
c1cnc2nccn2c1,0.1711
CC#CC1C2CC(=O)C12,0.2257
OCC1(O)CC(C1)=NO,0.2494
CC1(CO)COCO1,0.3367
OC1C2C=CC1C1NC21,0.2352
c1cc(=O)nc[nH]c1=O,0.1827
NC1COC2=C1OC=N2,0.2048
CC1C2C(C)CCC12O,0.3196
CCCc1ncnn1C,0.2627
COC1CC(C1)OC,0.3223
CC1CC1(CCO)C#C,0.2916
ON=C1CC2C=CCC12,0.2483
N#CCOCC1CN1,0.2633
OC1C2CN3C2CC13,0.2974
c1c(noc(=O)n1)CO,0.1666
CC(C#N)N(C=N)C=N,0.225
O=C1C=CCC1C#N,0.1945
OC12CC1NC2C#N,0.2518
C1OC2C1N1N=CC=C21,0.252
C(CC(F)(F)F)CO,0.3446
ON=C1C2C3CC1N23,0.2396
c1coc(=O)c(n1)N,0.165
OCC(C#C)C(=O)C=O,0.15
CCC1CC(=O)C11CC1,0.2186
CC(C)C(C)(N)C#N,0.2893
CN1CCOCC1CO,0.3114
CNC1(C[NH2+]C1)C([O-])=O,0.2484
COC12COC(C1)C=C2,0.2459
N#CC1NC=NC1C#N,0.247
N=C1OC2CC3NC3C12,0.2838
OCCCC1CN=CO1,0.2718
CC1C2C3CN3C12C=O,0.2033
CC1OC11CC2(CN2)C1,0.3071
CC1OCC11CC2CC12,0.322
CN1C2CC2(O)C1CO,0.266
NC(=O)N1CC2NC2C1,0.2897
COCCC(C)C=O,0.2272
CC(C)C1NC1(C)C#C,0.2742
CC(C)CC(CO)CO,0.3042
CC#CC1C=CCC1C,0.2575
c1(c(c([nH]c1N)N)O)O,0.2169
CC(C)C(O)C#CCO,0.2852
CC1C2C3C4CN4C2C13,0.3209
CC1CCC1(CO)CO,0.2994
C1C2C3C4C1CC2N34,0.3206
C1OC1C12CC3C(C1)N23,0.3239
CC12NC(=O)C1CC2O,0.2675
OC1C2C3COC1C23,0.3346
CCC1CCC(C=O)=C1,0.1934
CC1NC1C1=CON=N1,0.2179
CC#CC1(CO)CO1,0.2765
CC1(CC1)C(=N)OC=O,0.2495
OCC12CC3C1CCC23,0.3362
CC12OC1C(=N)N1CC21,0.2329
CC1OC(C)(C)CC1=O,0.2194
Cc1cnc(nn1)C#N,0.1663
C1C=C(C(=O)N1)CC=O,0.2052
C1C2CCCOC1C=C2,0.2483
N=C1OC2COC12,0.2649
CCC1CCC1C,0.3635
CNc1cnc(nc1)F,0.1745
CC1OCOC1C(C)=O,0.2171
CC12CC1CC(=O)N2,0.2645
CC1=C(CCC1=O)N,0.2042
CC1CC(O)C(C)=C1C,0.2526
c1nc2c(o1)N=COC2,0.1827
CC1CC1C(=O)NC=O,0.2174
Cc1cc(no1)OC=O,0.2413
N=C1OC2CC12,0.2804
OC1CC2(C1)OC1CC21,0.2989
CC#CC1CCC1C,0.2922
CC12COC1C(C2)C=O,0.2177
CC1(CN1)C(=O)C#C,0.1887
OC1CC=CC(C1)C#C,0.2631
CC1(OCC2CC12)C#N,0.3035
CC12NC1C(O)C1OC21,0.2993
COC1(C)CC(=O)C1C,0.2221
CC1CC2(OC12C)C#N,0.2689
C#CC1=CCCCCC1,0.2043
C#CCC1OC1CC#N,0.2987
CC1=NC(O)=CC(=N)N1,0.1768
Cn1nc2c(n1)OCC2,0.2142
C#Cc1c[nH]nc1C#N,0.2123
CC12CCC1CC1OC21,0.3407
O=C1NC23CC4C2OC134,0.2402
C1OC2CC1C=CCO2,0.257
CC(=O)C1=CC2CC1C2,0.1877
O=CC1NC1CC#N,0.2201
COCC12C3C4C3N1C24,0.2765
OC1CC2(C1)CC(=O)O2,0.2827
CC(=O)C1CNC(=O)C1,0.2157
Cc1ncc(=O)n(n1)C,0.1648
CC1NC(=O)C=C1C#C,0.1894
OC1CC2C3OC2C3C1,0.2989
CC1=CCC2C3OC3C12,0.2596
CCC1OC=NC1(C)C,0.2707
FC1=CC=CNC1=N,0.164
N#CC12CN1CC1OC21,0.2606
COC1C2CC1C2O,0.3208
[NH3+]CC#CC1=NC=N[N-]1,0.1251
OCC(O)CC(=O)C#C,0.1958
CCC1OC(=N)OC1C,0.3077
OC1(CC2(CO2)C1)C#N,0.2807
O=C1OC2CC12N1CC1,0.2413
CC1CCC=C1C(N)=O,0.2204
N#CC1CCN=CO1,0.2661
CC1(O)C2CC1C=C2,0.2398
O=C1C=CC2(CC12)C#N,0.1855
O=CC1CC11CCC1,0.2275
CC(NC=O)C(C)C=O,0.2242
OC1C2CC1C2N1CC1,0.3034
CC1C2C1C1=CC=CN21,0.2207
CCC1C(C=O)C1C=O,0.2119
c1c(c(no1)N)N,0.2268
Cc1cccc(c1F)C,0.2346
CC1C(=O)C2NC12CO,0.2168
CC12CCC1NC(=O)O2,0.315
CCCN1CC2(O)CC12,0.2811
CC(CN(C)C=O)C#N,0.266
C1C2CN3C4COC12C34,0.3099
CCCC1NC(=O)C1C,0.2795
O=C1CC2C3OC1C23,0.2129
CC1(C)CC2(CO)NC12,0.288
CCC1(CC)CC1CO,0.3337
CCC12OC(C1C)C2=O,0.242
c1nc2n(n1)C(=O)OC2,0.2442
CCC12CC3C(C1)C3O2,0.3119
N#CC12NCC1C1CC21,0.2468
CCC(=NO)C1CO1,0.2465
OCC12CCCC1CO2,0.3126
OCC1C2CN3CC3C12,0.2836
CC1N2CC3(C)C2C13O,0.2765
CNc1cc(=O)onc1,0.1676
c1c[nH]c2c1ccnc2,0.1964
NCC1=NNC(=N)C=N1,0.148
CC1OC(=O)N(C)C1=O,0.2565
CC1C2C3CC2C2C3N12,0.3286
CC1C(=O)CCC1(C)C,0.2222
NC1=NC2CCCC2O1,0.2791
CC1CC2CC2C(=N)O1,0.2727
OCC1CC2(O)CC2O1,0.3059
COc1c(c(c[nH]1)O)N,0.2298
OCC1CC2COC1C2,0.3181
C1C2C3C4C5OC5C13C24,0.3178
CC12CC1C1C(C#N)N21,0.242
Cc1cc(n(c1C)C)C,0.2317
C1C(COC(=O)O1)O,0.3172
O=CC12OC3C(C=C1)C23,0.1962
CC1C(O)C2CC3C2N13,0.2885
OC1COCC2CCC12,0.307
N=COC12CC1NC2=O,0.2431
CC12CC3COC1CN23,0.3041
COC(C)C(O)C#N,0.2982
O=C1OC(C#N)C1C#C,0.2617
CC1OC(C)(C)C1=NO,0.2452
OC1C2CCC1C(=N)O2,0.2829
CN=C1OC2C(C#N)C12,0.2587
OCC1CN2CC(C2)O1,0.2956
CC1C(CO)OC11CC1,0.3007
CCC1CC(=O)C2OC12,0.2129
C1C=CC=C(CO1)C=O,0.1624
CCC1(O)C(C)C1O,0.3107
CCOC1C2CC2C1O,0.3162
CC1C2C3CC(=O)C1C23,0.222
O=CC12CC3C4C1C2N34,0.2118
CCC(COC)COC,0.3346
CCCC(CO)CC#N,0.2899
CC(CC#N)OC=O,0.2848
OC(C1CC1)C1CCC1,0.33
CC1CC2(CC2C#C)C1,0.285
CCC1(O)CC1(N)C#N,0.29
OC1C2COC12C1CN1,0.2808
CC1=CC(=O)ON=N1,0.1725
N=C1OC2C3CC2C13,0.2752
C#CC12CC(C1)C2C#N,0.2818
CC1C2CN1CC2=NO,0.2439
N=C1OC2CC1(C2)C#C,0.2844
COCC1OC2(C)CC12,0.3049
CC1(CC2(CO2)C1)C#C,0.3052
CCNC(=O)OCCO,0.3116
CC(=NC)N(C)C=O,0.225
CCC(C)N1C=NN=C1,0.2689
NC1=NNC(=N)C(O)=C1,0.1664
C#CC1(CN1)C#N,0.2584
CC12CC1(O)CC2=O,0.2285
CN1C(=N)OC(O)=C1N,0.22
CC(=O)CC#N,0.237
COC1(C)C=CC2OC12,0.2412
CC1(CO)CN2CC12,0.2977
CC(C)C1COC(C)O1,0.3352
CNC(=O)OC1COC1,0.304
CC(O)C12CCC1(C)O2,0.3321
CCC12CC1CNC2=O,0.268
CC1CC(=O)CN1C,0.1936
OCC12COC(=O)C1N2,0.2614
CNC(CO)C(O)C#N,0.2649
c1c(nno1)OC2CC2,0.2013
CCC(C)(C)C(C)CO,0.3376
CC12CC1C1(O)CC21,0.2864
N1C2C3OC3C1C1OC21,0.3085
CNC(=O)OCC(=O)N,0.2618
Cc1[nH]nc(n1)COC,0.2592
NC1C(CC#C)OC1=N,0.2651
COCc1[nH]c(=O)[nH]n1,0.234
NC1=NC(CO1)C=O,0.2031
C1C2C3C2C2C4OC12C34,0.3027
CCC12N(C)C3C1OC23,0.2867
OCC1C2CCC(O)C12,0.2995
OC1C2CN2CC1C#N,0.2621
CC#CCC1(CCC1)O,0.2913
OC1CN=CNC1=N,0.2291
N#CC12COC1=NCC2,0.2573
CCC1(C)C=CNC1=O,0.2161
OC1CN(CC1=O)C=O,0.2
CC1CCC2CC(=O)N12,0.2513
CC1=NNC(C[NH3+])=C1[O-],0.1349
CC12COCC1OC=N2,0.275
CC12OCC3C1C1C2N31,0.3077
CC12CC1CC1OCC21,0.3274
CC(=O)C1COC(C)=N1,0.2193
COC12CC1(CO)CC2,0.3278
OCC(C#C)C1CC1O,0.3029
c1cc(nc(c1O)O)O,0.1883
CC1(COC1)CC#C,0.291
CC12NC3(C#N)C1OC23,0.2569
CCc1cc(oc1)C#N,0.2024
CC1(C=O)C=CCC1O,0.2107
CC12COC3CC1C3O2,0.3005
CC1CCOCOC1=N,0.2867
O=C1NC23CC(CC2)C13,0.2506
CC1CC2OC3CC1C23,0.3107
O=C1CC=C2C3CC3C12,0.2146
CC12CC1CCCC2,0.337
Cc1c(c(no1)C=O)N,0.1513
CN1C(=O)CC1(C)C#C,0.274
OC12CC1CC2(O)C=O,0.215
Cc1nc(on1)CC#N,0.2593
CC1(O)CC(O)CC=C1,0.2598
CN1C(CO)C1CO,0.2905
O=C1C2CC(C2)C1C#N,0.2259
CC(C)C(C=O)C(C)=O,0.1972
CC1(C)C=CCC1CO,0.2645
CC[NH2+]CC#CC([O-])=O,0.2076
OC1CCC23CC12CC3,0.2958
CC1C2C3CC2C3C1C,0.3668
CC1OCC2(OC12)C#N,0.273
CC12CCC=C1C1CC21,0.2262
c1c([nH]c(n1)CO)C=O,0.1888
CC12CC(C=O)=CC1N2,0.1777
CCC12CC1C(=O)CC2,0.2257
CCC1CC1C(=O)C#N,0.2054
CC(=O)C1CC2COC12,0.231
OC1CCC1CCC=O,0.2285
OC1CCC=CC2NC12,0.2345
OCC12CC(CC1=O)O2,0.2105
C1Oc2c([nH]nc2O)O1,0.2325
CC1=CC(CCC1)C#N,0.2575
CC1CCC2=NON=C12,0.2455
C#CC1CC(C=C1)C#N,0.2568
CC1CC1OCCCO,0.319
CC(CC=O)C(C)(C)C,0.2288
CC(C)C1(C)CC1CO,0.3335
COC(=O)C1CC(C)O1,0.2482
O=C1CC2C=CCC12,0.2201
C1C2COCC=CC1O2,0.2384
O=CC12CN1C1(CC1)C2,0.2121
OC12CC(C1)(OC2)C#N,0.272
N#CCN1CC2CC1C2,0.2563
O=CNC1CCC2NC12,0.2738
O=CC1OC2C3OC2C13,0.2102
CNc1ccoc1C#N,0.1828
c1c[nH]c(=O)nc1,0.1806
CC1CN2CC(O)C12,0.2628
CN=C1C=CC(=O)O1,0.1869
OC12CC1C1CC1OC2,0.3063
C#CCN=COC(=O)N,0.2677
CN(C=N)C(=O)OC=N,0.2368
CCC1(COC)CC1O,0.3237
CNc1cnc(nn1)F,0.1585
C#CC1NC=NC1C#N,0.2471
c1c[nH]nc1CC2CC2,0.2668
C(=N)(N)n1nnnn1,0.1956
CCn1c(ncn1)OC,0.2599
CCC12CC3CC1C3O2,0.3224
c1c2c(n[nH]1)OCCO2,0.2327
CC1CCC(C)=CC1C,0.2616
CCC#Cc1cnon1,0.2059
NC1=CNC(F)=NC1=N,0.1878
N#CC12CC1C=CCN2,0.2251
CC12OCCC1CCO2,0.3134
CC#CC(O)C1NC1C,0.2767
[NH3+]C1(C2CC1O2)C([O-])=O,0.2469
CC(C)c1[nH]ncn1,0.2697
CC1=CCNC1C#N,0.2402
CCC1OCCC1O,0.3026
CNc1[nH]cc(n1)CO,0.2372
CC12CC3(COC3)C1N2,0.3063
CN(CCCO)C=O,0.2729
CC1C2C3C4N1C2C34C,0.3003
OC1CCC2CCC2=C1,0.2524
c1cn[nH]c1CC#N,0.261
CC1(CC2OC2C1)C=O,0.2292
CC12CCC1(C)C2C=O,0.2248
OC1C2C3C=CC2C13,0.2259
CC([NH2+]CC#C)C([O-])=O,0.2604
CC(O)C1=C(C)COC1,0.2425
CC1CC2C(O)C2(C)C1,0.3173
CC#CC1C(C=O)N1C,0.1917
CC1COC2CC3C2N13,0.2996
O=CC12CC3NC1C3N2,0.2104
C1C2C3C4C5OC14C5N23,0.2842
COC(=O)NC=O,0.2458
N=C1OC2C(CC#N)C12,0.2753
CC12CCCC(O1)C2=O,0.2264
CCc1c[nH]c(c1N)O,0.2345
O=C1CN2CC2(C1)C#C,0.2066
OCC12CC1(O)C(=O)N2,0.2429
C(C1CO1)C1=CC=CO1,0.2347
O=C1CC2COCC1N2,0.2054
c1cocc1C2CCC2,0.2418
CC(C)(CO)C1CCO1,0.3105
CC(CCO)CCC=O,0.2291
OC1CCCC11CC1,0.323
COC1=NCCC2CN12,0.2581
CC(C)C(O)C1CN1C,0.2922
OC1CC11C2OC2C1O,0.321
FC(F)(F)C1CC2OC12,0.3406
O=CC12CC1CC1NC21,0.2286
OC1(CNC11CC1)C#N,0.2394
C1CN(C1)C(=O)CC#N,0.258
CC12OC3C1NC23CO,0.2827
CC1CC1C(=O)N(C)C,0.2607
O=CC1NC1C1CN1,0.2155
CCC(=O)C1(C)CC1O,0.2153
c1cc(oc1CO)C#N,0.1986
Cc1ccc([nH]1)C#C,0.196
CC(C)(O)C1CN=CO1,0.2731
OC12C3CC1COC23,0.2916
c1conc(c1=O)O,0.1917
OC1C2COC1C(=O)N2,0.2519
CC1C2CC2(C)C1C,0.3244
CC1=C(C=CCOC1)C,0.1925
OC1C2C(C=O)N2C1=N,0.18
CC1CCCC(C)=C1C,0.2509
CN(C=N)c1conn1,0.1795
CC1CC2OCC1(C)O2,0.324
CC#CCC(=O)N,0.269
CN1C2CC2OCC1=O,0.2512
CCn1c(ccc1C)C,0.2306
CCc1cnoc1C#C,0.2002
CCC(CC=O)CC=O,0.2131
CCCC(=O)C1CN1,0.2338
CC#CC1(C)CCO1,0.2788
NC12CC1(C#N)C1NC21,0.2466
N#CC1COCC2CC12,0.301
CC(C)n1c(ccn1)N,0.2442
C#Cc1cccc(n1)F,0.194
OCC1=CCC(=O)C1O,0.2233
CC(C)(CCOC=O)O,0.2843
O=CNC1CC(C1)C#N,0.2768
CCC12CC(C)CC1O2,0.3353
CC1(C#N)C2CCC1O2,0.3037
COC1CCC(O)CC1,0.3131
CC12CC(O)CC1(C)O2,0.3227
C1OC2C3CC12N=CO3,0.2427
c1c(noc1OC=O)N,0.2143
Cc1c(c[nH]n1)C#C,0.2258
CC1=NC(CO1)C1CC1,0.2686
C#CCc1cnc(o1)N,0.2289
O=CC#CC1CC2NC12,0.1907
C#CCC1=NCC(=O)O1,0.2502
COCCC#CC#C,0.2306
C1C2CC=C3CC=CC123,0.2276
N=C1CC(C#N)N1C=O,0.2304
CC1(CC1)N1CC1C=O,0.2001
CN1C(=N)NN=C1C=O,0.1368
CC(=O)C1CCC(O)C1,0.233
c1coc2c1C=CC2=O,0.1303
CC1OC11C=CCC1C,0.2469
CC1C(CO)CC1(C)C,0.3329
OC1C(OC=N)C1C=O,0.2244
O=C1CNC1C1CO1,0.2208
CN1CC(C1)(C#N)N,0.252
OC1C(C#N)C1C1CC1,0.2896
CC12CCN1C2(C)C#N,0.274
CC(O)C(C)CCO,0.3337
CCC1CC1CC(C)=O,0.2283
C1COC(O1)C=O,0.2119
C#Cc1cn[nH]n1,0.2239
CC1C2CCC1(C)C2C,0.3582
CCc1coc(n1)C,0.2419
C(#N)c1nc([nH]n1)O,0.2285
CC(=O)N1CC(=O)C1,0.2083
CC1C=CC2COC12,0.2592
CC12CN3C4CN1C2C34,0.2952
C1OC1C12CNC1CO2,0.2828
CC1=CC2C3CCC2C13,0.2304
CC(=O)C(C)(O)C1CO1,0.2184
C#CCn1cnoc1=O,0.2482
C(OC1CCC1)C1CN1,0.3216
CCN(C=N)C(=N)C#N,0.1853
CC1(O)CC(=O)N2CC12,0.2404
c1c2n(nn1)CC=CC2,0.2465
CC(N)(C#N)C1(C)CN1,0.271
Cc1coc(c1NC)N,0.2214
CCCC(=O)CCCO,0.2349
CCC12COC1C2OC,0.2893
CC1C(O)C2=NC=CN12,0.2456
CC1=C(N)OC(=N)O1,0.2372
OC(C=O)C#C,0.2216
Cc1ccoc(=O)n1,0.1896
O=CC1OC2(CC12)C=O,0.205
CN1C2C3OC2C3C1=O,0.2456
C(C=O)OCC#CC=O,0.199
CC(OC=N)C(C)C=O,0.2238
OCC1OC1C#CC#N,0.2197
CCc1n[nH]nn1,0.2625
Cc1c(n[nH]c1O)CO,0.2452
OC(C#N)C1(O)CNC1,0.2456
CC1OC1(C)C1CC1O,0.3123
CCCC1(CN(C1)C)O,0.2746
CCCC1CN1CCO,0.3131
C1OC23CC4OC(C12)C34,0.299
CC12CN1C1CC21C#N,0.2493
c1c(c(on1)CO)C#N,0.2293
CCC1(CC)NC1C#C,0.2764
OCC(O)C1C(O)C1O,0.287
COCC12CN1CC2O,0.2949
CC12CC1CC(=O)CN2,0.2001
CCNc1cnn(c1)C,0.2137
CC1(C=CCC12CC2)C,0.2632
CC12CC3CN1CC2O3,0.2957
CCC1CC2(CC2)C1C,0.3432
OC1CC=CCC1C=O,0.2202
CC(C)CC1OC1(C)C,0.3362
COc1cc(co1)C=O,0.1666
c1c(con1)CC2CC2,0.2453
CC1(CC#N)CCC1=O,0.2171
CC12NC1CCC2C#N,0.2887
C1C2CN1C1=COC=C21,0.2511
[NH3+]CCN=C1[N-]N=CO1,0.2181
c1c[nH]c(c1N)C#N,0.1941
COCC1C2C3OC3C12,0.289
CC1COC=NC1C#C,0.2661
OC(COC1CC1)C#C,0.272
CCCOC(=O)CC,0.2862
CC(C)CCCN1CC1,0.3144
OC(C#N)C1C2CC1C2,0.3062
ON=C1CC2OCCC12,0.2447
CC1C(O)CC2CN12,0.29
CN(C=N)c1nc[nH]n1,0.2167
CC1OCC2CC1CO2,0.3169
C1C=CC(=NO)C1=NO,0.17
COCCC1OC1C#N,0.2593
C1C=CC(=O)C(=O)CO1,0.1541
Cn1c(ncn1)C#N,0.2243
CC1CCC(O1)C=O,0.2187
OCCC(CO)CC#N,0.29
CN=C1OC2CC3C2C13,0.2658
CC1CN1C1=CNN=C1,0.2227
CC(C#N)C1(O)CC1O,0.2963
CC1(CC1OC=O)C#C,0.2485
CCC1=C(C)C2NC2C1,0.2404
C#Cc1ccoc(=O)c1,0.1616
CCCN1CC1C,0.3107
CC(C)OC(=O)COC,0.2806
CC12OC3CC1C2CO3,0.3121
OC1CN=CNC1=O,0.2268
CCC1(C)CC1C(C)=O,0.2283
OC1C2C3C4=CCC13C24,0.1512
C1CC1C12CC3C1CN23,0.3122
Cn1c2c(cn[nH]2)cn1,0.2264
O=CC1=CCC2OCC12,0.1908
CC(C)(CC#C)C#C,0.2952
CCCC12OC3C1OC23,0.2969
CC12CC3C4OC3C1C24,0.3261
c1cnc(cc1F)C=O,0.1815
Cc1coc2c1nco2,0.2184
CC12C3N1CC3(C)C2=O,0.2263
CC(C)C(=O)C(O)C=O,0.1997
N#CC1C2OC1C=C2,0.2283
CN=C1OC2C(O)C12,0.2609
CN1C2C3OC3C(=O)C12,0.1815
CC1C2NC2C1C#C,0.2806
O=C1CN2C3C4C3C1C24,0.1922
CC12C3C=CC(N13)C2=O,0.191
O=C1NCC2=C1N=NO2,0.1772
c1c(nc[nH]1)NC(=O)N,0.2285
CC(CO)C(N)C#N,0.2938
CC(=N)N(CC#N)C=O,0.2438
O=C1C2CC2CC1C#C,0.2177
C(C=O)N=COCC#N,0.2234
Cc1c(ncc(n1)F)N,0.1779
O=CC1C2CC1C1OC21,0.228
CCC(CO)(NC)C#N,0.2754
COCC(=O)C(C)C=O,0.2055
O=C1OC2C3NC(=C1)C23,0.1693
CN1C(C=O)C1C(C)=O,0.1815
Cc1ccnc(c1)C,0.2293
CC1C2C3NC2C13C#N,0.2645
CC(C)C12CC1C(C)O2,0.3142
N=C1OC23CC(OC2)C13,0.2596
OC(CC#C)C1CN1,0.2783
NC(=O)NC(=O)C1CN1,0.2403
N=C1OC2CN3CC3C12,0.2608
NC1=CON=CC1=N,0.1582
Cc1c(cncc1O)O,0.2041
CC12CC(C1)OC2C#N,0.2811
C(C(F)(F)F)(F)(F)F,0.4802
O=C1OC23CC12OCC3,0.2545
NC1C(CNC1=O)C#N,0.2546
COC(C)CCC=O,0.2301
CC(COC)(C#C)C#C,0.2935
c1cnn2c1NCC2=O,0.1895
CC12OC3C4C(C14)C3O2,0.3501
Cc1cc(nn1C)C=O,0.201
C#Cc1ccc([nH]1)C#N,0.1809
CN1C2C1C1(C)CC21C,0.2774
C#CCC1(CC1)N2CC2,0.2785
c1coc(c1CO)N,0.2159
CC1COCC1OC=N,0.2719
N=C1OC2(CC2)C=C1,0.1958
COCC(C)NC(N)=O,0.3023
O=C1C2CC1C=CC2,0.2174
OC12C3C1C1C3CC21,0.3101
N#CC1=CC2CCC1O2,0.2133
CC12NC1C1CC1C=C2,0.2448
CC(O)CC1=CN=CN1,0.2502
[O-]C(=O)C1COCC[NH2+]1,0.272
NC(C#N)C1NC1CO,0.277
C1OC2CC3OC3CC12,0.3228
CN1C2CC1C(=C2)C#N,0.1779
C#CC1CN=CO1,0.2688
CC1=CCNC(=O)C1=O,0.167
O=C1C2CC2C1CC#N,0.2261
C#CCC(=O)CCC=O,0.2225
OCC1(O)CC(O)C1,0.3121
CC1CCC2OC3C2C13,0.3036
C1C=CC(=O)NC(=N1)N,0.1986
CC1=CC2OC1C2=O,0.2478
O=CCOC1CC2CC12,0.2274
CN(C=N)C(=O)C1CN1,0.2301
CC1CC(=N)NC1=O,0.2499
COc1[nH]c(c(n1)O)O,0.2296
CC1CCCCC1C=O,0.2207
ON=C1C2NC2C2OC12,0.2238
C1OC1C1=NC2CC2N1,0.2217
C1CN2C(=C1)COC2=O,0.222
OC1(CC=O)COC1=N,0.22
CCOCC1NC1(C)C,0.3181
OCC1COC(=O)C=C1,0.2171
CCC1CCC(=O)C1=O,0.1423
c1c(nn2c1NCC2)N,0.2338
OC1CC2(CC12)C#N,0.2885
CC1(C)C2NC2C1C#C,0.2801
CCNC(=O)C1(C)CN1,0.2672
c1c(cnnc1F)N,0.1964
O=CC12NC1CC2C#N,0.2198
CC1C2C(=O)C=CC12O,0.1824
CC1(O)CCOC1(C)C,0.3072
OCC12C(O)C1NC2=O,0.2517
CC(CO)C1OCC1=O,0.225
c1c(c(n[nH]1)C#N)N,0.1971
C#Cc1c[nH]c(c1O)N,0.2076
c1c([nH]cn1)CC2CC2,0.2487
CC1CCCCN=CO1,0.26
CCc1c(n[nH]c1N)C,0.2396
CN=C1OCCC11CN1,0.2571
CC(=O)C(=NCC=O)N,0.1767
C(=O)c1c(c([nH]n1)O)N,0.182
CCC(C)C1(CC)CO1,0.3355
OC12CC3C(OC1=O)C23,0.2661
CNC(C#N)C1CC1C,0.2768
CC1C2C3CC1(O)CC23,0.3249
O=CC12CC1C(O2)C#N,0.221
OCC1OC2C1OC2=N,0.2598
CC#CCC1CN1,0.2947
CCC(=O)N(C=N)C=N,0.2388
C1CC=C(COC1)CO,0.2492
OC12C3NC3C1C2C#C,0.2519
C[NH+]=C(N)OCC([O-])=O,0.1391
OC12CN3CC1C23C#C,0.2452
N=C1OC(=O)NC=N1,0.2134
C(N=C1CCO1)C1CO1,0.2739
CC1(OC1CO)C(N)=O,0.2635
C(CNC=O)CNC=O,0.2742
C#CC12CN1C1(CC1)C2,0.2545
CC(=NO)C1CCCC1,0.2568
C1OC1C1=CN=CN1,0.2391
O=CC1C2COC12,0.2145
CCC(=O)C(=O)C(=N)N,0.1678
N=C1CN2N=CN=C2O1,0.2289
CC1C2(N)CNC12C#N,0.2351
OCCOC1CC1C#C,0.2859
CN=COc1ccco1,0.2239
CC(O)C(NC=O)C#N,0.2757
NC(=O)C1=NCC(=N)N1,0.1882
C1CC23C=CC4C(C24)C13,0.2275
CC1CN(C=O)C(C)=N1,0.2238
O=CC12CC3C(CO1)C23,0.2209
OC12CC3CC(O)(C1)C23,0.3203
O=CC1COCC1C#C,0.2242
C1CC11C2NC3C2OC13,0.297
C1C23CCC12N=COC3,0.2336
CN1N=NC(=O)OC1=N,0.1825
CCC1CN2CC12C=O,0.2135
OC12CC1(OC2)C1CN1,0.2917
FC(F)(F)C1NC2CC12,0.2954
C#CCCC1C2COC12,0.2936
CC1(CC(O)C1)OC=N,0.2798
CCC1CN=C(N)C1=O,0.1818
CCC(CC)C(=O)C=O,0.1538
c1c(nc(c(=O)o1)N)F,0.1579
CC1CC2N1CC2=NO,0.2172
CCCN1C2C3NC3C12,0.2635
C1CC1C12CCC1O2,0.3265
OC1CC1C1CC1,0.324
CCC12CC3OC(C1)C23,0.3099
COC(C)(CC=O)C#C,0.2208
C#Cc1[nH]c(cn1)O,0.1935
COC(=O)C(O)C1CC1,0.2659
C#Cc1c(con1)C=O,0.1986
CC1CC11C2C3CC1N23,0.3105
CN1C(C=O)C1(C)C=O,0.183
CC#CC#CCCO,0.2263
CC1=CC2CC3CC2C13,0.2453
CCC1=NC(=N)NC=N1,0.1834
CC12OC3C1CCC23O,0.3117
CC1=CC(=O)OC2CC12,0.2137
CC1(O)CC1C#N,0.3069
C1N2CC11COC3C2C13,0.275
CC1CC2(C)CC2O1,0.3205
CC1CC1C#C,0.2907
CC12COC1(C)CCC2,0.3178
CC(O)(CC=O)C=O,0.2061
CCc1ccc(o1)C=O,0.182
CC(=O)NCC(O)C#C,0.2612
c1cc(=O)nccc1O,0.1707
CC(C#N)N(C)C(N)=O,0.2756
C#CCOC1C2CC1C2,0.2881
COC1OCC(O)C1C,0.3211
C1CC1C2(CC2)N3CC3,0.3086
N#CC12CC=CC1CO2,0.2624
CCOCC1(CO1)C#N,0.2709
CNCC(=O)OCC#C,0.2351
N=C1OC=C(O1)N(=O)=O,0.1559
CCOC1OCC2CC12,0.3452
C1C2OC1C1CCC2C1,0.3116
C1C=CNC(=O)C(=O)N1,0.2093
CC1C(C)C1(N)C#N,0.2975
CC1CC1C1C2CC1C2,0.3496
CC12CC(C1)C21COC1,0.3172
CC1NC(=O)C2NC12C,0.253
COc1nc(on1)CN,0.2356
O=C1CC2NC1C2C#C,0.2086
CC1C2C3CC3(C#C)N12,0.254
OC1C(=O)C(O)C11CC1,0.2156
O=CC1C(C#C)C1C#C,0.2168
Cc1cc([nH]c1)NC=O,0.1949
NC(=O)C1CC1CC#C,0.269
c1c([nH]c(n1)O)CC=O,0.1618
CC1OCC2NC12C#C,0.265
CC1C2COC1C2(C)C,0.3211
CCC(=NO)C(C)CO,0.2488
CCN=C1C=C(CO1)N,0.2056
CCOCC1(CC1)O,0.3239
c1c(c(cn1C=O)N)N,0.184
CC12C3C4C1C(N23)C4=O,0.2105
CC1(COC1=NC)C,0.2824
COC(C)CC#CC#N,0.2346
O=C1OCOC2COC12,0.2477
CC12OC1CC=C2C#C,0.2015
c1c(nco1)C(=O)C#N,0.1839
CC1C[NH2+][C-](C=O)C1=O,0.1926
CC1CC(C=O)=CN1,0.1796
OC12CCC1(OC2)C#C,0.2534
CCC1(CNC1=O)C=O,0.2129
Cc1[nH]nc(n1)CNC,0.2268
CC1=CC2CCC2C1O,0.254
Cc1nc(no1)N,0.2308
C1OC11CCC=CCC1,0.2573
CC1C2NC(=O)C1C2C,0.2584
CC12C3CC4C(CC14)C23,0.3453
CCC1C(C#C)N1C,0.2564
CCC12OC1CC21CN1,0.299
CCC(=O)C(=N)N1CC1,0.1903
N#CC1C2OC3CC3C12,0.2772
OC1C(O)C2CCC12,0.2962
C1C2C3CC1COCC23,0.317
Cc1c(con1)CC=O,0.2143
CC1CCC1C(C)(C)C,0.3446
O=C1CN2CCC12C#C,0.203
C1C(=O)CN=C(N1)C=O,0.1702
CC(N)C(=O)OC(C)=N,0.2375
Cc1[nH]c2c(n1)nc[nH]2,0.2173
CCN=C1C=NNC=N1,0.179
NC1(CNC1=O)C1CO1,0.2606
CN1N=NC=CC1=O,0.1789
OC1CCC2C(C#C)C12,0.2865
O=CN1C2COC2C1=O,0.2043
CCNC1COC1C#N,0.239
Cc1cn(cc1C#C)C,0.2172
CC#CC(C)(C#CC)O,0.2684
CC1N2C(CO)C2C1=O,0.2151
CC1(CCC(=O)CC1)O,0.2236
C1CC(C1)C#CCC=O,0.217
c1cnc(cc1N)O,0.2238
Cc1c(n(nn1)C)OC,0.2368
c1c(onn1)CCO,0.2342
CN(C)C(=O)CCCO,0.2696
C1CC1(CC=O)C#N,0.2247
CNc1cnc(o1)C=O,0.1553
CC1CCC2CC2C1C,0.3345
C1CC2=C(O1)ON=N2,0.1686
COCC(=O)CC1CO1,0.2182
COC1CC2(C)NC12,0.2999
CC(=O)C(C#C)C(N)=O,0.2051
OC1C2CC3CCC1C23,0.3146
C1OC11CCCOC1,0.3253
CC(C#N)C1(CO)CO1,0.3046
Cc1c(n[nH]n1)C#N,0.2339
CC1CCN1C(=N)C#N,0.1985
c1coc(c1O)CO,0.2248
OC1CC2C3OC1C23,0.3025
c1coc2c1oc(=O)o2,0.2194
O=CC1CN1CCC#N,0.2143
CC1(CC1OC=N)C#C,0.2564
ON=C1CC2CC(O)C12,0.244
O1CC2CC3CC2(C1)C3,0.3228
CCC(O)C(CO)C=O,0.2187
OC12COC(C1)C=C2,0.246
CCC1CC(C)(C1)C#N,0.3381
CC(C)C1C2OC1C=C2,0.2363
CN1CC(C)(O)C1C#N,0.2567
CC1C2OCC12CC#N,0.2732
CCCc1[nH]cc(n1)C,0.2458
OCC12CC1C(=O)C=C2,0.1883
C(CO)NCC(F)(F)F,0.2993
CC(O)C1(C)CC1,0.3341
OC1CN2CC12CC#N,0.272
CC1=NNC=C1C1CN1,0.2547
CCc1nc(on1)C#C,0.2132
CC12CC(O)(C1)CC=C2,0.2547
O=C1N2CC2C=C1C#N,0.1853
OC1C2C3OC3(C=O)C12,0.2172
CCC(=O)c1cnno1,0.1898
CC12COC=NC1C2O,0.2422
CC1C2NC2(C#N)C1N,0.2521
ON=C1C2C3NC1C23O,0.2418
CC(C#C)C(C#C)C#C,0.2817
CNC1(C#N)C2CC1C2,0.2737
CC1C2OCC(=O)C12O,0.2071
CC1OCC2CC1(C)O2,0.3145
CCC1=NOC(=N)O1,0.2463
CCOCC1(CN1)C#C,0.2779
Cc1cc(cnc1N)F,0.1906
CCc1cnn(c1)C=O,0.2104
OCC1NC1COC=N,0.2796
c1nnn(n1)CC(=O)N,0.2226
C#CCCC1OCC=C1,0.2469
CC1C2C3C(C#C)C2C13,0.2998
CC(O)CC(O)CC#C,0.2926
N=COC1CC11CCC1,0.2695
Cc1cnc(nn1)N,0.1662
OCCC1OCCC=C1,0.2645
CC1C2C(CC=O)CN12,0.2072
CN1C(=N)OC=CC1=N,0.2025
N=C1OC=CC=NC1=N,0.1796
COC1C2CC1N2C,0.3063
N=COC1CCOCC1,0.282
C1CC11OCC2CCC12,0.3095
CC(O)C1=C(O)C=CN1,0.2277
C#CCCOC(=O)C=O,0.1804
OCCCOC(=N)C#C,0.2381
CC(=O)CC(C)(C)C=O,0.2228
CC1CC2=CC(O)=CN12,0.2259
CC1CC2(C)C(C)CC12,0.3342
OC1C2CC=CC1CO2,0.25
CC(O)CCC1CC1,0.3311
CC(O)C1=NCC(=N)N1,0.2231
OC1C2COC1C21CN1,0.3026
COC1(C)OC(=O)C=C1,0.2207
CCCC1(C)CCC1O,0.3297
CC(C)OC1CN=CO1,0.2788
OCC12CC1C1OC1C2,0.3267
C1CC11CC2CCOC12,0.3188
CCC1CC(=N)O1,0.2898
CC1(CCC(=C1)C#C)C,0.2095
C1COC(=N1)C2COC2,0.2648
c1cnn2c1nccn2,0.1622
COC1(C)C(O)C1C#N,0.2775
CN(C)C(C#N)C#N,0.2413
CC1C2OC2C2COC12,0.3133
CNC(=O)C1=CNCC1,0.1953
CC1OC(=N)C2OC12,0.2676
CC1NCC(O)C1=O,0.1985
CCC(C)C(C)C1CO1,0.3436
OC12C3C4C3N3C(C13)C24,0.292
CC(C)C1CC1(C)CO,0.3325
CC(C#N)C(=O)C(N)=N,0.192
CCCOC(=O)C(C)N,0.2587
COCCC(=O)OC,0.2703
C1CN=C(OC1)CC#N,0.2712
C1CC2C1C1COC2C1,0.3146
Cn1cnoc1=O,0.2452
CC1C(O)C2C3CC3N12,0.2638
OC12COC3OCC1C23,0.3166
Cc1cn(cn1)C,0.249
CC1CCC2NC2C1=O,0.215
c1c(c(c(o1)N)O)CO,0.2276
C1C2C3C2C2CC3OC12,0.3209
CCC1(O)C2OC2C1=O,0.2063
CCC1CC2OC(=O)C12,0.2777
COc1cnc(nn1)O,0.1679
CC12C3C4CC(CC14)N23,0.3313
OCC1=CC(=N)N=CO1,0.2067
OC(C#C)C(=O)C#C,0.1902
C(C#N)NCC(=O)C#N,0.1672
Cc1cnc(nn1)C#C,0.1651
CC1C2CCC2NC1=O,0.2737
CC1CC(C)(C)N1C=O,0.2657
O=C1CC2C3CN3C12,0.1967
CC1(N)C2NC2C1C#N,0.2763
O=C1NCC11C2CCC12,0.269
CCCC(CC)OCC,0.3253
C1CC(C=C1)(CO)CO,0.2489
N#CC1C2C3NC3CN12,0.2587
c1c(c[nH]c(=O)c1F)O,0.1651
CC1=CC(O)C(O)C1,0.2539
C1C(=O)NC(=N1)CO,0.2353
C1C2CN1C1=CC=NN21,0.2476
CC1(O)CC=CC1,0.2658
CCCCOCCC#C,0.3114
CN=C1NC=CC2OC12,0.1998
CCOCc1cocn1,0.2461
C1C2COCC3CN3C12,0.2947
CC1CCCC1C1CC1,0.3448
CCOC1CCCOC1,0.3223
Cc1c(c(n[nH]1)O)O,0.2295
OC12COC3C1C2C3=O,0.2176
CNC(=NCC#N)OC,0.2566
OC12CC3C1OC(=N)C23,0.2686
CC1CC1(C)N(C)C=O,0.2661
CC12CC(CC1(C)C)O2,0.3176
O=C1CCC11NC1C#N,0.2041
OC1C=CCCC1=O,0.2107
CC1NCC(=O)C11CN1,0.1948
CC1C2CCOC2C1=O,0.1961
OC1COCOC1C#N,0.2844
OC1CC2(C1)OCC2O,0.29
OC12CC1(C=O)C1CC21,0.2147
CCC(C)OCCO,0.3317
OC1CC11CC2(CC2)C1,0.3231
CC1C2C1(O)CC21CN1,0.302
C(C(=O)NC(=O)N)N,0.2352
C#CC12OC1C1OC21,0.2456
CC#CCC1CC1C=O,0.2267
OC12C3C1C1CCC3C21,0.3035
N#CC1C2C3CC3CN12,0.2471
CC12CC3N1CC23CO,0.2903
CC(O)CC1NC1CO,0.3055
CCC(=O)CN(C)C=O,0.213
CC12CC1C(C=C2)=NO,0.1859
CNC(=O)C1NCC1O,0.2558
CC(C)CNC(=O)OC,0.3081
COC=NCC#CC#C,0.2237
CC(=O)Oc1c[nH]nc1,0.233
CC1N2CC2C1(N)C#N,0.2658
NC(=O)OC1C2CC1C2,0.3227
C1c2c(oc(n2)N)CN1,0.2266
CC(O)C1CC2CC12,0.3169
CC1(O)CC(O)C11CC1,0.3203
CNc1conn1,0.1892
OCCC1=CCN2CC12,0.2312
COC(=O)C1NCC=C1,0.2329
ON=C1C2C3CC1C23,0.2535
N=C1OCC1C#C,0.2844
CCCC(O)C=O,0.2362
CC(C)(CC(C)(C)O)O,0.3162
NC12CCOC1C2C#N,0.2678
O=C1N2CC2C11CC1,0.2322
CC12CCC3(COC13)O2,0.2751
C1CN=COCC1=NO,0.2305
CC1CC2OC1(C)C2O,0.3106
COCC(C)C#CC#N,0.2365
OCC1C2C(CN12)C#C,0.2772
CC(=O)C1CC2CCN12,0.1961
COCC1C2OCC12C,0.3078
OCC1C2COCC1O2,0.2942
CCC(CO)CO,0.3261
C1C=CCN1CC=O,0.192
CC1(O)C2C3NC2C13O,0.2846
O=C1OCC2OC12C#C,0.2366
Cn1cccc1N,0.2363
CC#CCC1CC(O)C1,0.2982
OCC(O)C(=O)OC=N,0.2266
CCC(=O)CC(C)OC,0.2324
CC1CC1CC1COC1,0.3219
CC12NC1CC(=C2)C#C,0.2009
O=C1C2CC1C1CC21,0.2295
c1nc(c(c(n1)O)O)O,0.217
C1CC1(CC(=O)N)C=O,0.2307
C1CC2C3NC3COC12,0.3054
CCC1C2CC3C(C2)N13,0.3267
OCC(O)C1(CN1)C=O,0.2202
N=C1NC2=C(ON=C2)O1,0.197
COC(C)(C#N)C(N)=O,0.2605
CCC1(CN1C)C#N,0.2766
NC12CN3CC1C23C#N,0.2421
CC(CC#C)NC(C)=O,0.2719
c1cc(oc1)N,0.2241
N#CC1C2CC1CC2,0.3307
O=CC1CC2CC12,0.2209
CC(C)C1(C)COC1=O,0.2788
C(C1C2CCC12)N1CC1,0.3093
O=C1N=NOC(=N1)C#C,0.2085
CC1C2CN1C(C)CO2,0.2878
C1OC2=NC3CC(C3)C12,0.2505
CCCc1[nH]ncn1,0.2696
CC12CCC1CC1CC21,0.3388
COC1CC2CC(C2)C1,0.3225
COC12CCCC1C2C,0.3152
c1c(n(cn1)CC#N)O,0.2214
OCC1OC(=N)C1C#C,0.2775
CC(C#N)(C#N)C1CC1,0.3081
COC1CCCC=C1C,0.256
CC1CCC1NC(N)=O,0.2956
CC12CC(C1)CCO2,0.3157
CC12C3OC1=NCC23O,0.1694
CC1OC(=N)COC1=O,0.2604
c1ncnc(n1)F,0.2251
CCN1CC1CC#N,0.2714
C#CC1CC2CC3C2N13,0.2854
CC1C(O)C1C(C)(C)O,0.27
CC1NCC1(O)C#N,0.2552
COc1ccc(cn1)N,0.1802
CCc1cccn1C=O,0.184
OC1CC2(O)C=CCC12,0.2541
CC1(O)C2OCCC12C,0.2934
CCCC1(C)OC1(C)C,0.3331
CC(C)C1CC=CC1C,0.2635
CN(CC#N)C(=O)C#N,0.2263
COC(=O)n1ccnc1,0.2128
O=CC1COC2CN1C2,0.1952
CC1(CC#N)NC1CO,0.279
CC(=O)C1C(O)C1(C)O,0.205
CC1COC(C)C(C)=C1,0.2601
OCCC1=CC2CC1C2,0.2354
OC1CC2OC1CCO2,0.3111
OC(C=O)C#CCC#N,0.2202
CC12CC=CCC1C2O,0.2443
OC1CC2CCC3C1N23,0.2829
O=C1OC2CC(C#N)C12,0.2746
CCC(C)(O)C(C)C#C,0.3046
OCC(CC#C)C=O,0.2267
CC(=O)c1ccc[nH]1,0.1876
CN(C)C(=O)C1CCO1,0.2602
C1COC(=NCC=O)N1,0.2174
CC(=O)C(C)(CO)C#N,0.2277
N=C(C#N)N1CC2CC12,0.205
C1C2CCCC3CC12C3,0.3287
COC(CCO)C1CN1,0.3208
CCC1(CC1)CNC=O,0.2805
COCC1N2CC1(C)C2,0.2991
CCOc1c(onn1)C,0.1964
NC(=O)C1C2CN=CN12,0.2471
COC1CC1(CO)CO,0.3006
CC1(CC1)C(=O)N2CC2,0.2441
N#CCC12CC1N=CO2,0.2625
CC(=O)C1C=CC2NC12,0.2262
CC1(COC1)C1CCO1,0.3094
c1nnn(n1)CCCO,0.2579
C1C2CC1C1(COC1)C2,0.3093
C#CC1CCC1C#C,0.2872
CCC1=CCCCOC1,0.2463
CC1NC(CC#N)C1O,0.285
CN1N=CNC(=N)C1=O,0.1889
CC1C2NCC(=O)C12O,0.189
N=C1C=COC=C1C=O,0.1726
CC(=O)C(=O)C(C)(C)O,0.1455
C#CC(CO)(C=O)C#C,0.2107
CCC12NC(C1C)C2=O,0.2462
NC(CO)(C#C)C#N,0.2627
NCC(N)=[NH+]CC([O-])=O,0.2515
COCc1cncnn1,0.1656
NC1=NOC(C[NH3+])=C1[O-],0.1381
CC1(C#N)C2NC1C=C2,0.2175
C1OCC11CCC2OC12,0.32
CC1=CC(=O)OC1(C)C,0.2255
CC1COC=NC(C)C1,0.2569
CC1(CN1C(N)=O)C#C,0.2773
C1CC2(C1)CCC=C2,0.2595
OC12CC1CCC1NC21,0.3028
Cc1ccc(o1)NC=N,0.2279
OC1CC2CC(O)C1O2,0.29
c1cnc(c(c1F)O)O,0.2132
CC1CC=CC2OC12,0.241
C1OC23CC4OC2CC134,0.2859
CC1OC(=O)C(C)=C1N,0.2149
CCC(OC)C1CC1,0.338
O=CC1(CC#N)CCN1,0.202
C#CC(CO)(C#N)C#N,0.2945
C(C(=O)C(=O)C#N)O,0.1482
OCCN1CC2(O)CC12,0.2878
Cc1cnn(n1)CC=O,0.2127
O=C1OCC(O1)C1CO1,0.3263
COCC1(CO)CO1,0.3217
COC1OC(=O)NC=C1,0.2291
OC1CC2NC2C1C#C,0.299
CC1=NNC(O)=CC1=N,0.1822
CC1(CO1)C1OC1CO,0.3314
CC1OC11CCC1C=O,0.2199
N=CNC(=O)COC=N,0.2262
c1c(n[nH]n1)CC=O,0.2191
CCC12CC1CC=C2C,0.2477
C(=O)Oc1nnon1,0.2296
C1C2C3COC4C1N2C34,0.289
CC12CC(O)C1(O)C2O,0.2767
CC1CC1N1C(C)C1C,0.295
Cc1cc(ncc1F)O,0.2028
CC12C3C4C3C1(CO)C24,0.2862
CCC(CC)(C#N)N,0.2916
CC12C3CC1(C)CC23O,0.3089
NCC(OC=O)C#N,0.2543
CC1OC1C1C2COC12,0.3131
CC(C)OC1C(O)C1O,0.284
CC1C2N3CC3CC12O,0.2959
CNC(=O)C1(CO)CN1,0.262
C1CC23CCCC2CC13,0.3388
CN=C1OCOC1C#C,0.2659
CCC1OCCOC1=O,0.2584
N=COCC1=CC=NN1,0.2525
OC(C#N)C1OC1C#C,0.2726
CC1OCC2C3OC3C12,0.3086
C1C2CC3OC3C1O2,0.3069
OCC#CC1CC2CN12,0.2549
COCCOCCC#N,0.2953
COCC1C2COCC12,0.3214
N=COC(=O)C1CN1,0.2341
CC1OC(C)C(C)=C1,0.2496
CCCC1(CC1)C,0.347
CC1OCC2C1OC2=O,0.271
CCC12CC1CC(C)C2,0.3337
O=CC1COC(=O)O1,0.2219
CC1=C(CO)CN2CC12,0.2234
CNCC(NC=O)C#N,0.241
COC1CC11COC1=O,0.2655
COCC1CC(=N)O1,0.2791
CC1(O)CC2CC1C2=O,0.2334
CC(=O)CNCC#N,0.2143
OCC1C2CN(C=O)C12,0.2583
N=C1NC=C(O1)C1CN1,0.2108
CC1C2CC3(C)C2CC13,0.3543
Cc1c(nnn1C)O,0.2217
OC1CC2CC1C21CC1,0.3294
O=CC1C2OC(C#N)C12,0.2159
NC(=O)N1C2C3NC2C13,0.2757
CC12C3OCC1CC23O,0.2964
CC(O)C(NC=O)C#C,0.2688
CCC1CN2C=CC=C12,0.2482
CC(C)C(=O)C1CC1O,0.2178
OC1C2NC1(C#N)C2O,0.2705
N=C1CC2(CO2)CO1,0.2818
CCC1CC2C(C)C12C,0.3197
Cn1c(nc(=O)cn1)F,0.1917
O=CC1CC=CC(=O)O1,0.2097
CCC(C)(CC)C=O,0.2229
CC(O)C(O)(CO)CO,0.2968
CN=C1CC(O1)C(C)=O,0.2203
O=C1C2NC2C2CCN12,0.2434
CC(CC1CC1)NC=O,0.2815
CC1C(O)CC11CCC1,0.3207
CCC1C2C3CN2C13,0.3057
COC(CO)C(O)C#N,0.2802
C1CC(=O)C=C1C#N,0.1684
C#Cc1ccc(cn1)F,0.1977
Cc1cc(cc(=O)[nH]1)O,0.1872
CC1COC(OC1)(C)C,0.3307
CC#CCC1C2CCC12,0.3014
COC12COC1C1NC21,0.2894
CC(C)(C)C(O)C#C,0.2935
CC1C2NC2(C#C)C1O,0.2592
CC1N2CCC12C#C,0.2475
OC1CCC(C#N)C1O,0.3006
CN1CC1C1=CN=NN1,0.2333
CCC1=NC(=N)ON=C1,0.1657
OC(C=O)C#CC1CC1,0.2081
CC1OC1C1(C)COC1,0.311
ON=C1C2CC2C1O,0.2423
O=C1CN2CC2C=C1,0.164
CCC(=O)C(C)C1CC1,0.2292
CC1=NC(=N)C=C(N)O1,0.1924
O=C1COC2CNC12,0.1981
O=CCC(C=O)C1CN1,0.1984
O=CCCC12CCC1O2,0.2267
CC(CCO)CC#C,0.3118
CCOC1C2C3C1CN23,0.3148
C#CCC1CCN=CO1,0.273
CC(C)OC1(CCC1)C,0.3143
CCCC1(C)CCOC1,0.3211
C1CC1C1C2OC=NC12,0.2567
CCc1ccnc(n1)N,0.1989
CC(=O)C#CC#CCO,0.1849
C1CC(=O)NC(=C1)CO,0.2125
O=CC#CC1C2CCC12,0.2036
CC#CC12CN1C=NC2,0.2364
OCC1CCC(O1)C=O,0.2195
CC1CC1CC1CC1C,0.3428
O=C1C=CC(=O)C11CN1,0.1509
COC1C(C)C1CC#N,0.2973
CC1NC(=N)C1(O)C#C,0.254
OC1CC2(COC12)C#C,0.2768
CC1CN=C(N)C1=O,0.1837
O=C1CC2OC11COC21,0.2084
C1C2CCOCOC12,0.3261
Cc1cncc(n1)C=O,0.1674
C1CN1c2[nH]nc(n2)N,0.232
C1CC12COCC(=O)O2,0.2605
CCCCC(=NO)C#C,0.2097
CC1(C)CN1CC1CN1,0.3098
c1cnc(nc1O)O,0.2213
N=C1OCCN2CC1C2,0.2314
OC(CC1CO1)C1CO1,0.3209
C#CC1COCC1C#C,0.2934
CC1C2CC3N2C1C3=O,0.2135
CC(OC(=O)CN)C#C,0.257
O=C1CCOC(O1)C#C,0.2667
O=CC12OCC(O1)C=C2,0.2118
CC1(O)CCCC2CC12,0.3272
CC12CC3CC(CO1)C23,0.3144
c1c(n[nH]n1)NC=N,0.2163
Cc1coc(=O)cn1,0.1659
C(CC(=O)C#N)C#N,0.2117
COC(C)C#CC1CO1,0.2684
C1CC1NC(=O)N2CC2,0.2735
CC1(CO)COC(=O)N1,0.3064
CC1N=C(C)OC1C#N,0.2668
CC1=CCC2OCC12O,0.2558
CC12CC(C1)OCOC2,0.3297
CC(C)Nc1ccno1,0.2228
N#CC12COC1C=CC2,0.2531
OC1C2NC3C1(O)C23O,0.2754
CC1(C#N)C(N)C2CN12,0.2667
C1C2OC3C4NC4C1C23,0.2924
CCC#Cc1ccn[nH]1,0.2099
O=CC1=NCC(O1)C#N,0.1938
O=CC1CC11CC(=O)C1,0.2149
O=CC1CCOC1C#N,0.2228
COC1CCN=C(C)O1,0.2754
OC1CC2OC(C#N)C12,0.2633
CC(C)CC1C(C)N1C,0.2862
COC1C2OC1(C)C2=O,0.2356
CCc1c(cccn1)F,0.2219
c1ncn(c(=O)n1)C=O,0.1789
N#CC1OCC2CC1C2,0.2959
c1c2c([nH]n1)CCC2=O,0.2131
N=C1OCC2CC(=O)N12,0.247
COCc1nc(on1)N,0.2463
C#CC#CC#CCC=O,0.1801
CC(CO)NC=O,0.2821
C1OC2C1C1CCC2O1,0.3211
O=CN1CCC2(CN2)C1,0.2638
C#CC(=O)C(=O)C1CC1,0.1516
ON=C1C2CN2C1C#N,0.2304
COCCOC(C)C=O,0.2268
CC12CC1OC(C2)C=O,0.2101
CN1C2C=CC1C2(C)O,0.2158
CNC(=O)C(=O)C1CC1,0.1787
OC1CC11NC(=N)C1O,0.2522
C(CC=O)CC=O,0.2161
CCC1CN=C(O1)C=O,0.1861
C1CN(C(=O)C1=O)C=O,0.1562
CC12OC3C=CC1C23C,0.2223
OC1C2NC(=N)C12C#N,0.251
CCC1=CC(CO)OC1,0.2444
Cc1ccn(c1C)C,0.2409
N#CC12CCC(CC1)C2,0.3382
CC(CO)C(C#C)C#N,0.2909
N=C1OC2C=CC1C=C2,0.2235
OC12CC3CC1(O)C2O3,0.277
CC1(C)C2COC12CO,0.3109
CCCCC1C2CC1C2,0.3769
c1nc(c2n1C=CC2)N,0.1721
CC1(C)C(OC1=O)C#N,0.2744
c1c[nH]c(c1NC=O)O,0.2123
C#Cc1coc(n1)C#N,0.1887
CC1=CC2CC1CC=C2,0.2297
CC1=CC2CC3(C)C1N23,0.2167
CC1OC(=N)C1NC=O,0.2731
COC(=N)NC(=N)C#N,0.1981
CN1C=CC(=N)N=N1,0.166
OC1C2CCC=CC1O2,0.2406
CC(=O)Nc1cnoc1,0.2178
CC1CC2CC(C=O)C12,0.2171
O=C1COC(=O)C2CN12,0.2333
CCCC(=O)N1CC1,0.2535
CC12OCCC1CC=C2,0.2623
CCC1CC2(CO2)C1=O,0.2019
C1C2CC11OCCC1O2,0.3132
O=CN1CC=C2CCC12,0.2327
OC12CC1(OCC2)C=O,0.1985
CC(CC#C)OC(C)=O,0.2819
NC(=O)C1(CN1)C1CC1,0.2647
CC1CC2=C(O1)N=CO2,0.2042
[NH3+]CCC1=NC=C([O-])O1,0.1746
Cc1cc(c([nH]1)O)O,0.2253
C1CCC(C1)(C#N)O,0.3186
OC1CC(C1)C(=O)C#N,0.1909
c1[nH]c(=O)[nH]n1,0.2421
C(OCC1CO1)C1CN1,0.3195
CC1C(C(O)C#N)N1C,0.2445
C1CCC(C1)(CO)C#N,0.313
OC12CC(O)(C1)C(=O)C2,0.2326
COC1C2CC(C)(C)C12,0.3244
CC12C3C4CC(N13)C2=C4,0.1805
C1CCC2(C1)COCO2,0.3279
CC(OCC#N)C1CN1,0.248
CC1(O)C2COCC12O,0.2911
C1CC2(C1)C1C3OC1C23,0.3059
OCC1C(C#N)C2CN12,0.2774
CCC12CC(O)CC1N2,0.2955
O=CNC1CC1NC=O,0.2482
OC1CCOC2(CC2)C1,0.32
CC1CN(C1)CC(=O)N,0.2625
N#CC12CC1CC1CC21,0.2921
c1c(n[nH]n1)N,0.2241
C(C(=O)NC=O)OC=O,0.2181
CC1CC(=CC1O)C#C,0.2081
CC(=O)C1OC2CC1C2,0.2185
c1c([nH]c(n1)C#N)CO,0.203
COC1C2C1C(=O)C2O,0.2232
CC(C)(C)c1ncno1,0.2632
OC1(C=O)C=CC2NC12,0.1898
COCC1NC1COC,0.3293
C1C2CC3=CN=CN3C12,0.2471
CC1(COC1)OC2CC2,0.3216
OC12CC3OCC1OC23,0.2885
N=C1CC2NC2C(=O)N1,0.2335
CCCOc1ncon1,0.2466
OCC1NC(=O)C=C1,0.213
CC1OC(=N)C1N(C)C,0.2457
CC1CN=C(O1)C=O,0.1867
OC(C#C)C12CCC1O2,0.2947
CC1CN1C1CC1O,0.3048
CCn1ccc(c1)O,0.2309
CNC(=O)OC(=N)C#C,0.2059
N=COC1OCC2OC12,0.2867
O=CC1C2COC1CO2,0.2188
CC1(C)C2OCC(O)C12,0.2954
FC1=NC=NC(=N)O1,0.196
COCC12COCC1N2,0.3274
CC1=CC(OC1=N)C#C,0.223
c1coc(c1O)OC=O,0.2053
CN=C1OCC1CO,0.2767
C1CC1C#CCCCO,0.2808
CC12CC(O)C1O2,0.328
O=CCOC1CCOC1,0.221
CC1N2CCC2(C)C1=O,0.203
OC1CC2C3OC3C=C12,0.2331
c1cn[nH]c1CO,0.2561
O=CC1C(C=O)N1C=O,0.203
C1C2COC3=NCC1C23,0.2505
CC1(O)C2OCC12O,0.2719
N#CC1C2C3CC=C1C23,0.1754
CC(=O)C12CC1N=CN2,0.2059
O=C1CC=C2CC3C2N13,0.1936
COCCC1NC1C#C,0.2828
CC(=O)n1cccn1,0.2189
CCOC1(C)C2CC1O2,0.3126
OC1COC(C#C)C1O,0.2816
OC12COC(C1)OC2=N,0.285
CN1CCOCCC1=O,0.262
C#CCOC1CC(=O)C1,0.2214
N#CC1CCOCC=C1,0.2602
O=C1CNC(CN1)C#N,0.2436
O=C1C2CCC2C11CN1,0.2104
CCC(C)C(C)C(C)O,0.3304
c1cc([nH]c1)N2CCC2,0.2255
CCCNC(=[NH2+])C([O-])=O,0.1979
CCN1C=NCC1C#N,0.2428
COCCCC(=O)OC,0.271
OCC(=O)OCC1CN1,0.2487
C1N=C2C3NC3C3C1N23,0.2099
CCC1CNC(=O)C1=O,0.1703
Cc1c[nH]nc1CCO,0.2568
N#CC12COCCC1N2,0.2848
COCCC(OC)C=O,0.2133
CCC12OC3CC1CC23,0.3216
CC12CC(=O)CCC1O2,0.2231
C1N2C3C4NC4C=C1C23,0.2079
CCC12CC1(C)OC2=O,0.2719
NC1=NN2C3CC3C2=C1,0.2048
CC1NC11C=CCC1C,0.2435
CCCC(=O)OCC#N,0.2863
CCC12CC(C)=CC1O2,0.2409
C1CC1C1=NC2CC2O1,0.2511
OCC1CCOC(=O)O1,0.3142
N=COC1CC2CC1C2,0.2798
C1C2NC3=CC=NN3C12,0.2361
CC1(C)OC1(C)CO,0.335
CC#CC1NC2COC12,0.267
CC1(CO1)C(CO)C=O,0.2202
OC1C2N=CNC12C#C,0.2324
CN=C1NC(C)CC1=O,0.1611
NC(C#C)C(N)C#N,0.2774
CC1OC23CCC2CC13,0.3032
CCC(=O)N(C)CC#C,0.2688
CC1CCC(=O)C1O,0.2099
CC12CC(CC11CC1)O2,0.3247
CC#CC(C)C(C)(C)C,0.3002
CC1(C)NC1C1CCO1,0.3066
CCN1CC(=NO)C1,0.2255
CCC12OC3C1OC23,0.2965
CC1CC1(C)C#CC#C,0.2172
CC12CN1CC=CC2O,0.2343
CCNC(=O)CCC=O,0.23
O=C1OC2CC1C1NC21,0.2636
CC1C(C)C2(CN2)C1O,0.3024
CCc1c[nH]c(n1)C#N,0.2041
N#CC1C2CC=CC1O2,0.2415
CCn1cc(cc1O)O,0.2311
COC1CC(C)(C1)C=O,0.2272
CC1(CCCCCC1)C,0.3586
CC1C(COC=O)N1C,0.2376
CNC1(C#N)C(O)C1O,0.2365
CCc1c(cco1)C,0.234
C1OC2C1N1CC=CC21,0.2296
CC1C2OC2(C)C1C#C,0.2893
Cc1c2c(n[nH]1)nno2,0.1778
CC1OCC2CC3C2C13,0.3189
OC12CC1C1CC21O,0.2627
CN=C1OC(C#N)C1N,0.2519
CCC1(CC1)O,0.3242
CC1(O)CN2C(C=O)C12,0.1975
C#CCC12CCC1CO2,0.2869
CCC1CC1C1(C)CO1,0.3329
COc1c(con1)C#C,0.2168
CC12CC3CN=C(O1)C23,0.2177
CC1CC(C=C1)=NO,0.1926
COC(=O)C1CCC1,0.277
CNCC(O)(CO)C#N,0.2857
Cn1cc(c(c1)N)CO,0.229
C1C2NC11COC=NC21,0.2454
OC12C3C4C1C(N34)C2=O,0.2026
CC#CC1(CCN1)C#N,0.249
OCC12CC(C1)C=CC2,0.2533
C#CC12CC(C1)(C2)C#N,0.2876
COC(=O)C#CC(=O)N,0.2199
O=C1CCC2CCC2N1,0.2715
CC1(CO)C(O)CC1=O,0.2151
C1CC23OC4C2N1C34,0.2797
CC12CC3OC3C1(C)O2,0.3307
CC12CC3=CCC1(C)C23,0.1767
NC1(C#N)C2C3C1CN23,0.2659
CC1(C)C2CC(=O)C12,0.2286
CCC(C)C1CCC1=O,0.2188
CC1(C)COC1C1CN1,0.3094
CCCC1C(C)N1CC,0.2852
C1C2CC34CCC23C1C4,0.2966
CC12CC1C(OC2)C#C,0.2914
CC1CCC11CCC=C1,0.2551
CC1N2CC2(C)C11CO1,0.3204
CC(=N)Nc1ccco1,0.2097
[NH3+]C1CC([N-]C1=O)C#N,0.2703
OC(CC#N)(C#C)C#N,0.2825
C(C#CC(=O)C=O)C#N,0.1535
CCC1OC2C(C)C12C,0.2983
[NH3+]CCC([O-])=O,0.1338
CN(C)C(=N)C(O)C#N,0.217
CCC1C2CCC1C2O,0.3143
CCC(O)C1=CON=C1,0.2447
CC1CC2COC12C#C,0.2654
NC1C(OC11CC1)C#N,0.2558
CC1CC2(CCO2)CO1,0.3084
CC1(C)CC2C(C#N)N12,0.2611
OCC12CC(O1)C=CC2,0.2404
OC1C2N(CC12O)C=O,0.2528
CCCC#CCOC=N,0.2788
OC12C=CCC1C2C#C,0.2395
COCC1(O)CN2CC12,0.2984
CN1CC2=CC3NC3C12,0.2171
CCNc1cnoc1,0.208
C#CC1CC2(CO2)C=C1,0.2511
NC(=O)CC1OC1C#N,0.2577
CC1C(=O)NC11CCC1,0.2793
CC12COC1C(=O)C=C2,0.1764
CC12CC(=O)N1CC=C2,0.2458
CC#CCN=CNC=O,0.2278
CCC1=C2CN3C(C1)C23,0.1677
OC1C=CC(O)C1=O,0.2303
CC(C)(C)c1[nH]ncn1,0.2704
CC(O)C1COC1C#C,0.277
NC1CC(OC1=O)C#C,0.2517
CCC12NC1C1OC21,0.2747
O=C1CC2OC11CCC21,0.2094
COC1CN=C2NCC12,0.2503
CC1CC(NC1C)C#N,0.2712
CC12C(CC1=O)C1CN21,0.1982
CC1(CC1OC=O)C=O,0.2241
COC(=O)CC=O,0.2272
CC1=CCC=CCC1O,0.2472
CC1C2C3(CO3)CC12C,0.3354
C1CC1C(=O)N,0.2784
CC1C(=O)OC1(C)C#C,0.2753
CC1CC11CC(C)C=C1,0.244
OCC1CC11NCC1=O,0.2159
NC1=NC(CN1)C#N,0.2604
OC1C=CCC2OCC12,0.255
N=CN1C2CCC2C1=O,0.2248
N#CC1C2NC2C11CC1,0.2735
CC(C)C1OC(=O)C1C,0.281
C1CC11CC=C2COC12,0.2409
C1OC2C3C4CCN3C124,0.282
CCC(C)CC(C)(C)C,0.3644
OC1CC2C3COC1C23,0.3047
CCN1C2C3NC2(C)C13,0.2877
CC1C2CC(O2)C1O,0.321
CC1OC11C2CC1(C)C2,0.3452
OCCC1CCC(=O)N1,0.2732
CCCN1CC1C(C)=O,0.2028
C1C=C2C3C4OC3C1C24,0.1641
O=CC1CCC2CC1O2,0.2185
CC1(O)CC(C)(O)C1O,0.3087
Cc1c(=O)onc(n1)F,0.1657
C1C2COC3CC(C3)N12,0.3052
C1CN1C(=O)COC=O,0.2454
COCC12CC1C1OC21,0.2925
CCCOC(C)C#N,0.2968
O=C1C2NC1C2CC#N,0.2489
CCC1C2OC2C1OC,0.3166
CCCC12CC(O)(C1)C2,0.3367
[O-]C(=O)C12CCC1C[NH2+]2,0.2505
OCC1C2C3C2C(=O)C13,0.2407
c1c(cncc1F)C=O,0.1802
CC1CC1C#CC#N,0.226
C#CC12OCC1C1CC21,0.2585
CC1CC(=O)CC(C)O1,0.2251
CCOC1CC1OC,0.3195
CC(C)C(=O)C1(C)CO1,0.2179
OCC1NC1(CO)C=O,0.2218
C#CC12OC3CCC1C23,0.243
OCC1C2CN2C1C=O,0.2142
CC12CC1C1(OC21)C#N,0.2408
O=CC12CCOCC1O2,0.219
C#CC1(CC1)CCO,0.2947
O=C1NCC2CC(C2)N1,0.2898
C1C2(CO1)COC(=O)N2,0.3123
CCC(CC)CC,0.3891
Cc1c(cc[nH]1)CO,0.2335
CC1CC2=C(ON=N2)O1,0.1684
C(N1CC1)C12CC1CO2,0.3153
CC1N2CC3CC1(C)C23,0.2835
CC(C#CC=O)C(N)=O,0.1834
c1c(nc(nc1N)O)N,0.2281
CC(O)(CC1CN1)C=O,0.2203
CCC1CNC(=O)C1C,0.2692
OC1CC11CC2CN2C1,0.2979
ON=C1C(O)CC11CC1,0.2346
CC1(CO)OCC11CC1,0.3094
OC(C#N)C(=O)C1CC1,0.2364
CN=C(C=O)OC1CC1,0.1697
CC1=C2CC3CC(C1)C23,0.2145
O=C1COCC1C1CN1,0.2084
COc1ccc(=O)[nH]c1,0.1633
OC1(CN2CC1C2)C#C,0.2521
O=CC1OC11CCC1,0.2174
C(CNC(=N)C#N)C#N,0.2126
OC12C3NC1C(C#N)C23,0.2707
OCCC12C3CC1CN23,0.3106
OC1C2C3CC1C23C#N,0.2786
CC(C)(C)C1CC2CN12,0.2997
c1c(nc[nH]1)CC=O,0.2109
O=C1CCOC2CC12,0.2229
CC1(O)C2C3OC2C13O,0.284
OCC1(CO1)C1CCC1,0.3425
C#Cc1[nH]cc(n1)O,0.1841
OC(C#N)C1CC2OC12,0.2796
C#Cc1cnn(c1)C=O,0.1871
COC1C(C)OC1CO,0.311
CC#CC1(C)C2CC1C2,0.2905
CC12CC3C(O1)C23CO,0.3005
OC1CC2OC3CNC123,0.2701
N=C1OC=CNC1=O,0.1806
CC1=CC2CC2(O)C1,0.2388
CC1(CC(C1)(C)O)C,0.3218
OC1CC2COC(C1)O2,0.3347
O=CC12CC1OC(=O)N2,0.2158
CC1CC2CC(O)C12O,0.2966
COCC1(C)CCO1,0.3208
CC1CN=C(C)OCO1,0.2543
c1c(c[nH]c(=O)c1N)F,0.1651
c1c(c(c(cn1)O)O)O,0.2103
C1CC(O1)C1CC2OC12,0.3118
CC(N(C)C=O)C(C)=O,0.2105
COC1CC2C(O)C12O,0.3073
CC1CCCOC1C#N,0.2918
CC1COC1C(C)(C)O,0.2987
C#CC12COCC1O2,0.2752
C1CN1CC(=O)C=O,0.1511
CC1=NNC(=N)NC1=O,0.1819
CC1CC11COC1=O,0.2784
CC(=N)N(C)C(=O)CO,0.2379
COC1CCCO1,0.3471
CC1OC2(C)CC12C=O,0.2152
CC1CC11CCOC1=N,0.2777
OC1COCC1C1CN1,0.3008
C1C2C3C4C(C=C13)N24,0.1776
CC12CN=C3OC1C23N,0.1543
CN1CC23CCC12CO3,0.2596
c1coc(n1)OC2CC2,0.245
CC12CC3CC1(C)C23O,0.2889
CCC1(O)CCC=C1C,0.2617
COC(CCC#N)C#C,0.2997
CNc1nc(no1)N,0.2431
CC1CC1OCC(N)=O,0.2804
CC1CN=C(C=O)N1C,0.1548
C#CCN1CC(=O)C1,0.211
ON=C1C2CN3C2CC13,0.2411
OC1CC=C(C1)C1CC1,0.2483
N#CC12CC3C1N3CC2,0.2827
CC12C(O)C3C1COC23,0.309
C1CC1C1CC11COC1,0.3097
CCCc1cc(no1)O,0.2466
N#CC#CC1C2CC1C2,0.2357
C#CC12CC3OC1C23,0.2602
CC12CCC1=CC1OC21,0.2357
C(c1c(c(no1)O)N)N,0.2181
CC#CC1(C)C2CCN12,0.2626
O=C1C2CC1OCCC2,0.1969
CC(=O)N1CC2(C)CC12,0.2577
CC1(CC1C#N)C1CC1,0.2979
N#CC1NC11CC2CC12,0.2733
OC1(CC2OC12)C1CN1,0.3071
C1NC11COCCC=C1,0.2377
CC1=NOC(=N)N=C1F,0.1679
CC1C2C3OC1(CO)C23,0.2946
c1cnoc1OCC#N,0.237
CC1(CC1)N(C=N)C=O,0.2327
OC1CCCOC1=N,0.272
C1CC1C2=NCC(=O)N2,0.2303
CC1C2C3C(CC2=O)N13,0.2144
NC(=O)C1C2C3OC2C13,0.2533
C1OC1C1=CON=C1,0.2395
N=C1OCC(=C1)C1CO1,0.2054
CN(C)C1(CC1)CC#N,0.2511
CCCc1cc(c[nH]1)O,0.2281
C1CC1CN2CCC2=O,0.2774
NC(C#N)C1(CO)CN1,0.2712
N=COC1CCCC1=O,0.2029
CCCCc1cc[nH]c1,0.2502
NC(N)=[NH+]C1=CN=N[N-]1,0.1813
CCC12CC1C1OC21C,0.2923
CC1(C)C2CC1(O)CC2,0.3241
CC1CNC(=O)CN1,0.247
CC12CC(CCC1)C2O,0.3103
OCC#CCCC1CO1,0.2845
CC1C2N1C(=O)C=C2N,0.2035
O1C2C3C=CC4C1C2C34,0.2325
O=C1C2C3CC1C23C#C,0.2374
OCC(O)C#CC#C,0.2191
CC12CC3(C)C1CC23C,0.3486
CC#CC1CCCOC1,0.2956
Cn1cc2c(c1)C=CC2,0.1977
CNC(=[NH2+])C1=NC=N[N-]1,0.1765
CC12CN1C(CC#N)C2,0.276
CC(O)C(C)C(C)=O,0.2244
CCCC1CCC1CC,0.3613
OC12CC3OC(CC13)C2,0.3191
c1c(c[nH]c(=O)c1F)F,0.1703
CC1C2CC1C(C2)C#N,0.3356
COC1C(O)CCC1O,0.3065
CC1CC(C)C(C1)C=O,0.2282
CN1CC2CC(C1)O2,0.2973
C1CC2(C1)COC(=O)N2,0.3088
COC1(CCC1)C1CN1,0.3121
OC1CC2=CC3CN3C12,0.2264
CCC1C2C(CN12)C=O,0.2143
CC(=O)CC1CN=CO1,0.2283
OC12CC3(CC1C23)C=O,0.2165
CC#CC1(C)OC1C#N,0.2565
CNc1ccn(c1)C,0.2167
NC1=C(F)C(=N)OC=N1,0.1674
COC1CCC1(C)C,0.3288
CC1(C)CC2OCC12C,0.3056
COC=NC1(CC1)C#C,0.2461
OC1CCC=C1CC#C,0.2618
ON=C1CCCCC1O,0.2511
CCC1C2CCC1C2=O,0.2277
COCC1(CCC1)O,0.3279
C1C=CC2=CCOCC12,0.1974
CCC1NC1C#C,0.2826
C1C2C3C1C1=CCN3C21,0.1643
CCC(CC)(C=O)O,0.2255
CC12CC1C(CO)O2,0.31
CC1(CC(=N)O1)C(N)=O,0.266
c1c([nH]c(=O)o1)NC=O,0.1864
C1CC(=O)C2(CC2)C=C1,0.2214
NC(=N)NC1=CN=NO1,0.1587
CC(=N)OC1C2COC12,0.2757
CC12CN1C1(CC1)C2=O,0.2206
CCC1C(C=O)N1C,0.1948
C1OC=NC2C3OC2C13,0.2434
CC1CCC1C(=O)CO,0.2337
CCCNCC#N,0.2702
Cn1cc(cc1N)OC,0.223
c1ccc2c(c1)OCO2,0.2079
N#CC1CC2CC3C2N13,0.2859
CC1CCC(OC1)C=O,0.2264
CC1CC(=CC1=O)C#C,0.1696
OC1CC(O)C(=C1)C#C,0.2081
CC1(CC1)C(=O)N,0.2772
CC(O)(CC1CC1)C#N,0.3052
CCC(O)C1(CC)CC1,0.3285
OC1(COC1C#C)C=O,0.2129
OC1CN(C=O)C(=N)C1,0.2264
c1c(=O)onc(n1)CO,0.1608
CC(C)(C)C(O)CC=O,0.2228
CN1C2C3C(O)C3C12C,0.2728
CC(C)C1OC2CC12O,0.2897
O=C1CC2OC1C21CN1,0.2117
CC1CC2OC3(CC3)C12,0.297
OC12C3C4C1C(=O)C2N34,0.1966
CCc1cnc(cn1)O,0.1938
CNc1cc([nH]c1)NC,0.2209
CC12CCN1C(=N)C2O,0.2319
CC12CC3C(O)C1C23O,0.3044
OC12CC1C1NC21,0.2817
CCCC1CCOC=N1,0.27
CC1(CO1)C(=N)NC=O,0.2275
OCC(O)CC#CC#C,0.2281
CC1(CC1)C(=O)C1CO1,0.2165
c1c(c2c([nH]1)CCO2)O,0.2234
Cc1c2c([nH]n1)CCO2,0.2216
C1C2N3CC22C3CCN12,0.1887
C1CC1CC(=O)NC=N,0.2364
N=C1CCC2OC2CO1,0.274
C1CC23C4OC2C4C3=C1,0.2611
OCCC1C2CN1C2,0.3081
CC1CC(=O)CC1(C)C,0.2214
OC1CN2CC2(C1)C#N,0.2692
CC1COC2C3OC3C12,0.3012
CN1CC1(C)COC=O,0.2536
CC#CC1CCCC=C1,0.2577
CC1C=CC2(C)CC12,0.2459
C1CC(=CCOC1)CO,0.2502
OCC1CC(=O)NC=N1,0.2264
CC1CC2(O)C3OC2C13,0.3049
C(COCCC#N)C=O,0.2284
CC1CCC(=O)C(=O)C1,0.1628
CC1=CC(=O)CC1C#N,0.1934
C1CN1CCCOC=O,0.2525
CCCC1(CC)CC1O,0.3251
CC(C)CC12CN(C1)C2,0.2952
C1C2C3OC2C2C3N12,0.3023
COCC(C#N)C1CO1,0.3048
OCCC1NC1CCO,0.3138
C1COCC=CCOC1,0.2371
C#CC1C2C3CC3N12,0.2441
CC1C(C)C(=O)N1C=N,0.2263
OCCC12CC1OCC2,0.3035
CCC(C)(O)C1CC1O,0.311
C1C2OC3C2CCOC13,0.316
CCC#CCCOC,0.2995
O=C1CCC11CN2CC12,0.1938
Cn1c2c([nH]cn2)nn1,0.2118
CCC(=O)C(=O)CC,0.1578
CCC12CC1OC2=NC,0.2729
CCCC1CC(CO)C1,0.3382
CC1OC2CC2(O1)C#N,0.2751
OC12CC3(C#C)C1OC23,0.2648
CC1CC23CC(C2O)N13,0.2738
CC(O)C12CC3C1OC23,0.306
CCn1cc(nc1)O,0.2287
O=CC1COCC2OC12,0.2203
O=C1NCC23CN(C2)C13,0.2422
N#CC1C2CCCC12,0.3128
CCNc1conc1C,0.2124
OCC1=CCOC(=N)C1,0.257
C1CC12C(=O)CNC2=O,0.2129
N=C1NC(=O)C(C=O)=C1,0.1494
COC1COC1C(C)C,0.3158
c1cn2c([nH]1)nnc2O,0.2089
CC1NCC1(C#C)C#N,0.2555
OC12CCC1OC=NC2,0.2683
COC12CC(OC1)C2O,0.3124
CN=COC1C2CCC12,0.2692
CC1(C)CC(=N)O1,0.2895
CC1COCCCC1O,0.3117
COC(C)C1(CO1)C#N,0.2763
CC1C2C(CO)OC12C,0.3053
N#CC12CN(C1)CCO2,0.2526
COC1CC1C1CC1,0.3151
CC12CC3C(OC1)C23,0.314
CC1C2OC3C2C13C=O,0.2157
C(C1CN1)N1N=CN=N1,0.2191
CC1=CCOC1C#N,0.254
OC1(CC#N)CC2CC12,0.2917
CNC(=O)C#CCC=O,0.2165
CC1C(NC1=O)C=O,0.2144
CC1C(O)CNCC1=O,0.2166
COC(CC(C)O)C#N,0.2991
C1C2CCC3OC3CC12,0.3323
CC1CC1C1CC1C#C,0.2866
OCC12OC1COC2=O,0.2454
c1c(nc(nc1O)O)N,0.2311
c1nc(nc(n1)N)N,0.2279
CC12CC1(C#C)C(=N)O2,0.2578
CCC12OC3C1CC23,0.3148
Cc1cnc(cc1O)N,0.2094
CCC1C(C)C1N1CC1,0.3132
CC(CC=O)C1(C)CC1,0.2273
CC#CCn1nccn1,0.2545
c1c(n(nn1)CC#N)N,0.2243
CN1C2CC3C(O)C3C12,0.2657
C1C2C3C4C=CC13C24,0.2218
C#CC12C3C4CC1C4N23,0.2502
CCCC1CC1C(C)=O,0.23
O=CC1CC2NC2C1,0.2257
c1c(c(no1)O)C(=N)N,0.2096
CC1C2C=CC(O)C12,0.2366
O=CC1OC(=O)C2CC12,0.2215
CC1(C)OC(=O)C1C#N,0.2768
CC(C)C1=NCC(C)O1,0.271
CC1(C=C(CO1)C#C)C,0.206
CC12CC(O)(C1)C2,0.3379
O=C1C2CC3C4C3N1C24,0.2197
c1c(non1)C(=O)N,0.2084
O=C1CC2C(C1)C2C#C,0.2241
CC1CC2=CC(O)=NN12,0.2384
CCC1(NC1C)C(N)=O,0.2584
C#CC1CC(C1)C1CO1,0.3074
O=CC1C2C3OC3C12,0.2286
C1C2C1C1CC2O1,0.3391
c1cc(nc(c1)F)O,0.2137
NC1=NC2CC(O)C2O1,0.2752
CC1(C)OCC1C1CC1,0.3209
CC1C2OC2C1(C)C#C,0.2958
O=CC1OC2CC=CC12,0.2192
CC(C)C1(C)OCC=C1,0.2468
Cc1cn2c(o1)nnn2,0.2309
CCOC1CCC(O)C1,0.3155
C1C=Cc2c1noc2N,0.1929
c1c(cc(nc1F)F)F,0.2386
O=C1OC2CC=CCC12,0.2627
N1C=CN=CN=CN=C1,0.198
CC1CC=C2CCOC12,0.2538
CC(=N)OC(CO)C=O,0.2182
CCC12CC(C1)C(=O)C2,0.2287
OC1C2C=CC3CN2C13,0.218
C1CN1c2nc(on2)N,0.2425
CC(NC(=O)CO)C#C,0.2714
OC1C(C#C)C1(O)C#C,0.2467
COC(=O)C1(CN1)C#N,0.26
CCC12CC3CC1C23O,0.3023
CC1C2CC(C3CN3)N12,0.3006
OC12CC=CC11CC2N1,0.2298
C1C(=CC(=O)C1=O)N,0.1538
CC(CO)C(=O)C1CN1,0.2288
O=CC1NC11CCC1,0.2188
CC(O)C12CN1CC=C2,0.2287
CC12CC1(O)CCC2O,0.3249
CCCC12CC1C1CC21,0.2888
C1CC2OC1CC=C2,0.2586
Cc1cnc(c(n1)N)O,0.181
COC(CO)C1OC1C,0.318
OCC1NC(=O)OC1=N,0.265
OC1C(OC1=O)C1CC1,0.2611
CC(=O)C(C)(O)C(N)=O,0.2177
CC1OC(=O)CC1(C)C,0.2777
OC1CCOC1C=O,0.2052
CC(C)C1OC11CCC1,0.3302
CC1=CC(=N)OC(F)=N1,0.1899
CC12NCCC1OC2=O,0.2515
CC1C2NC2C=C1C#N,0.2057
CCC1=CC(C)CC1,0.2573
CNC(=O)n1cnnc1,0.2326
N=C1OC2CC1C21CO1,0.2796
N=C1OC=NC=NC1=O,0.1847
CNc1cc(c([nH]1)O)O,0.2226
CNC(=O)C(C=O)C#C,0.2017
C1CC2=CCC=CCC12,0.249
CC1C(C#C)C1(C)C=O,0.2146
C1C(CO1)(CC=O)CO,0.2015
N=C1OC=NOC1=N,0.2098
CCC(O)C1=CC=CN1,0.2386
CC(=O)[C-](OC=[NH2+])C=O,0.1698
OC1(CC1OC=O)C#C,0.2652
Cn1cc(cn1)C=O,0.2084
C1C2CC1C21COC=N1,0.2593
CC1CC2(C)OC1C2=O,0.2317
Cc1nc(c(o1)O)N,0.2076
CC(=O)C1CC(=O)C=C1,0.186
C#CC(=O)C1CCCC1,0.206
CCC1=CC2CC1(C)O2,0.2314
COCC#CCCCO,0.2837
CC1N2CCCC12CO,0.2996
CN=C1NC=C(O)C=N1,0.1315
CN1CC1C1=CC=CN1,0.2348
COc1c([nH]c(n1)O)N,0.2357
CN=C1OC2C(O)C12C,0.2598
CC1C2C(C)OC12CO,0.3003
CC12CC1CC(O)C=C2,0.2514
C(C=O)OC(=O)CO,0.2282
CC12CC1(O)C(O)C2,0.2831
CC#CC(C)C1(O)CC1,0.298
CCN=C(C(=O)C#N)N,0.1583
C1C2C3C1C1CC3CC21,0.3728
N=C1OC(=O)CN2CC12,0.2273
N=C1OC2(COC2)C=C1,0.2073
OC(C=O)C#CC1CO1,0.216
CN=C1ON=NC(N)=C1,0.1401
N=C1CCC(O1)C#C,0.2837
OC1CC(=O)C2CC1C2,0.2261
CC1C2C3OC(C)C2C13,0.3319
CC1(CCC(=O)O1)C,0.2786
CC12OCC1NC2C=O,0.2107
CC(CO)CC(C)(C)O,0.3108
CC(C)([NH3+])C(N)C([O-])=O,0.2642
OCCC12CC1CC=C2,0.2478
CCCNC(=O)NC=N,0.2404
CC1OC2C(O)C2C1=O,0.2225
C1CC1C1COC11CC1,0.3056
CC1CC2(C)C3CC3C12,0.3107
CN=COCC(C)CO,0.273
O=COC(CC#C)C#N,0.2661
OC1CC11CC(C1)C#N,0.2981
c1cnc2c(n1)CNC2,0.1793
CC12OCCC3C1OC23,0.3052
COc1c(nc([nH]1)N)O,0.2187
Cc1coc(c1C)CO,0.2285
CC1NC1C1CC1C#N,0.2819
CCOCC(=O)C(=O)N,0.1787
C1C23CCC12C=CCC3,0.2427
CCC1CC2C(O)C2O1,0.3075
CN=C1OC2C(O)C12N,0.2569
COCCC(=O)CCO,0.235
CC1(CO1)C1CN1C=O,0.2563
C1C=C(CN=CO1)C=O,0.1829
C(C1CO1)C1=NON=C1,0.243
CCCCC(C)C1CO1,0.3475
c1cnc(cc1O)C#N,0.2125
CC1(C)CC1CC#C,0.3106
O=CC(C1CN1)C1CN1,0.2061
CC(C)C(=NO)C(C)C,0.257
C1CC1(CO)C#N,0.3071
CCC1C2CC3(CO3)C12,0.3369
OC12C3COC1C=CC23,0.2264
C1C2OC3=C(C=NN3)C12,0.2409
C1CC12CC(C2)CO,0.3365
OCCC1C=CC2CC12,0.2459
CC(C)(O)C1OC1CO,0.3156
Cc1cc(=O)[nH]cc1F,0.1713
OC1C2C3CC4C1N4C23,0.2903
c1cc2n(c1)CCC2,0.244
O=CNCC12CC1OC2,0.2552
CC1NC2CC2NC1=O,0.2504
C1CC23CCOC2C3O1,0.3024
CCC1(C)NC1C#CC,0.2743
CC1CCC(C=C1)C#N,0.2619
CC12CC3C1N3C21CC1,0.3173
CC1OC1(CO)CO,0.3235
O=CNC1C=CC2OC12,0.2319
CNC(=O)C(=NC)N,0.2155
CC1(CC=O)OC1C#C,0.2196
NC1COC2=C1ON=C2,0.2038
CC1C(C=O)C1(O)C#C,0.2126
CC(O)(COC=N)C=O,0.2254
CC(C)OC1CC1O,0.3008
CN1C=C(C=N1)C1CN1,0.2389
Cn1c(cnc1OC)O,0.2425
Cc1coc(n1)C2CC2,0.232
C1C2OC2C2=C1C=NN2,0.2386
CC1C2C3CC1CCC23,0.3336
CC1OC2CC1OCC2,0.3143
CCC(C)C1=NC=NN1,0.2696
CC1NC(=O)OCC1O,0.3028
CC1=CC2OCCC2C1,0.2613
CCN(C)C(=O)NC=N,0.2488
C1C(CC1=O)OCC#N,0.2216
C[NH2+]CC1=CC=C([O-])O1,0.1548
OCC1(O)C(O)CC1=O,0.1969
NC(=O)C1CC(=O)CN1,0.2136
OC12C3C=CC(C13)C2=O,0.1986
CCOCc1ncno1,0.2429
COC1C(C)C2CCC12,0.3099
[NH3+]CC1(CC1)C([O-])=O,0.2789
COC(C)C(N)=O,0.2744
N=C1CNC(=O)C(=O)N1,0.2003
CCCC(O)C(=O)CC,0.2386
CC(=O)C(C)(O)CC#C,0.2274
CC(C=O)(C=O)O,0.1927
COC1CCCC(C)C1,0.3268
O=C1OC2CC1(C2)C#N,0.2745
CC12C3CC(N13)C2=O,0.2337
CC1CC1CC1CN1C,0.303
CC1C(C)C2(CN2)C1=O,0.2057
CC12CCC1C2(N)C#N,0.2813
CN1C(=N)OC(O)=C1C,0.2244
C1CC11CCC2CC1C2,0.3381
CN1CC1(C)C(O)C#C,0.2578
O=CC1CC(C=O)=CN1,0.1762
CC1CC(O)C1CC#N,0.3135
[NH3+]CCC1=C([O-])OC=C1,0.2234
ON=C1CC=CC1O,0.2406
CC12CC(O)C1OCC2,0.305
CC(O)C1(O)CC2CC12,0.3051
COC12CC1OC(=N)C2,0.2707
CC(=NO)C1NC1CO,0.248
CC1C2NC(=O)C(O)C12,0.2548
NC(=O)C(C#N)C1CC1,0.2681
CCc1cc(c[nH]1)O,0.2278
CC1OCC=CCC1O,0.2609
CC#CC(O)COC=O,0.2793
CC1CC2CCC(C1)O2,0.3095
O=CC1CC2NC(=O)C12,0.2218
OC12C3CC4C1CN4C23,0.2926
CC1(CC1)OC(=O)N,0.3168
N#CC12OC1CC1OC21,0.2726
OC1CC(C=O)C1O,0.2154
c1[nH]c(=NCC=O)[nH]n1,0.1919
CC1(CC1)C1OCC=C1,0.2482
Cc1cncc(c1F)C,0.2377
CC1(C=O)C2C(O)CN12,0.2221
CC1C2N(C)C(C)C12O,0.264
CC1C2C(=N)OC12C#C,0.2481
OCC1CC11OC2CC12,0.3024
CNc1c(non1)N,0.2128
C(C(CO)(C(=O)N)O)O,0.2602
CN1C2CC2C1C(C)=O,0.188
CC(O)C1OC1C1CO1,0.3303
CC12CC3C(CN13)C2=O,0.2064
C#CCC#CC#CCO,0.2172
C1NC1C1=CON=C1,0.2374
CC1=Cc2cncn2C1,0.1803
OC12C3NC1C3C2C=O,0.2075
CCC(C)(O)C#CC#N,0.2388
Cc1c(onn1)C,0.2263
OC12CC3C(C1)C3CC2,0.3271
CNC(=O)n1ccnn1,0.2273
FC(F)(F)C1CO1,0.3642
OC1CC11C=CC2CC12,0.2357
C#CC(C#C)(C1CC1)O,0.2783
NC1C(C#N)C1(N)C#N,0.2431
C1OC23CN(CC2)C13,0.2605
CCN1CC2C(C#N)C12,0.2476
COC1(COC1=N)C#C,0.2573
O1C2C3C=CC=CC1C23,0.1696
CC1=CCCC(C1)(C)C,0.2619
CCC1CC(O1)C(C)=O,0.2169
CC1OC1C(CO)CO,0.3194
CC1CC([NH3+])C1C([O-])=O,0.2722
CC(O)C1C2C=CCN12,0.2254
CC12CN1C1(C)CC2C1,0.3216
c1(nc2n(n1)nno2)N,0.1774
CC1OC(=N)CC1(C)C,0.2858
CC(=N)N(C)C(=O)C#C,0.2057
COCCNC(C)C#N,0.2721
OC1COC11CCC1,0.3009
N=C1OC2CC2C1C=O,0.2244
CCC1C2CC1C1CC21,0.3433
CCC1(C)C=CCC1C,0.2619
CC12CC(O1)C(=C2)C#N,0.1974
O=COC1C2C3OC3C12,0.2668
CNc1c(cnn1C)N,0.2144
C1CC2OC=NC2C1,0.2707
CC1(C)CN2CC12C=O,0.2149
CC12CC1(C)N=COC2,0.2482
NC1C(=O)N2CC12C#N,0.2255
C1CN1C1C2CC1C=C2,0.2375
Cn1c(c(nc1O)N)O,0.2235
C1CC2(O1)C1CC2C=C1,0.2377
CCC12NC1C(C)C=C2,0.2435
CC1NC11C2CC2C1O,0.3019
O=CC1CC11CCO1,0.2163
OCC1C=CCC11CC1,0.2508
CC1(O)C2OCOC12,0.3084
OC(C#N)C12CCC1N2,0.277
COCC(O)CC#N,0.317
CC12CC3C(O)C1C3O2,0.3087
COCC1CC(O)C1O,0.3046
CC1(CNC1C#N)C#N,0.2596
c1cc(=O)[nH]cc1CO,0.175
c1nc(c(o1)OC=O)N,0.2024
C#Cc1c(nco1)C#N,0.185
CC(C)(C#CC#C)OC,0.226
CC1OC2=C(O1)N=CN2,0.2068
NC1C2CN(C2)C1C#N,0.2483
CC#CCCOCC#N,0.2632
CC1C2C=CC1(O)C2O,0.2391
O=CC#CC1CN=CO1,0.1981
C1C2CCCCCOC12,0.3054
CCCc1nc(no1)N,0.2305
N=C1N=COC=N1,0.2159
OC1CC(O)C2(CN2)C1,0.296
CC1CCC=C1C,0.2598
c1c(=O)cc([nH]c1O)F,0.2171
OC1CNC2=C1NC=N2,0.2058
CCC12CC(C1)C(=O)O2,0.2763
CC12CCNC(=O)C1O2,0.2519
CC1(CC(C1)(C=O)O)C,0.2275
CC#CCN(C)C(=O)N,0.28
CC#CC12CN(C1)C2,0.2806
CCCCC(C)CO,0.341
CCC1OC(C)C1CC,0.3153
COCCCOC,0.3367
COC1C2CC2C1=NO,0.2421
CC(OC(C)=O)C1CN1,0.2537
CCC1(COC1)C(C)O,0.307
CC(C)C(=O)NC(=O)N,0.2393
CC1=C2CCC2C2NC12,0.2343
CC(CCCO)C#C,0.3156
CC#CCCN1CC1C,0.2881
CCCC1=CC2OC2C1,0.241
c1c(nnnn1)CCO,0.165
CC12CCN1C2CO,0.2908
c1c2c([nH]c(n2)N)no1,0.204
COC1(CC1C)C#C,0.2781
c1c(cc(=O)oc1O)F,0.1857
CC1C2C=C(C)C(=O)N12,0.1984
C1CC12CC(=O)C(=O)N2,0.1725
Cc1c(c(c[nH]1)NC)O,0.2224
CC1=CCN(C(=O)N1)C,0.2244
CC(O)C(C)C#CC#N,0.2416
CC12CN1C1(CC21)C=O,0.2019
C1CC12COC2=O,0.2802
CC1(C)C2OC(N)=NC12,0.266
CC12N3CC1(C3)NC2=O,0.2123
O=C1CC2OC1C=C2,0.1999
CC12OCC3C1C(O)C23,0.3096
O=C1CC2C3OC3C2N1,0.2765
CC1C2CCOC1C2=O,0.2108
c1c(c(=O)[nH]nn1)C=O,0.1418
CC12CN1CC1(CO1)C2,0.3107
C[NH2+]C(C)CCC([O-])=O,0.2726
COc1ncnc(n1)O,0.2348
C1C(=O)CNC1=O,0.2096
CC12CC1C1(O)CC21C,0.281
CC1=C(C)C2CC2CC1,0.2401
NC1=NCC2OCC12O,0.2525
OC1C2OC1C21CCO1,0.2979
C(CO)c1nnon1,0.2136
CCCC(C)C#CCC,0.2988
OCC1CC2OCC=C12,0.2357
C(CO)NCC(=O)C=O,0.1145
c1nc(c(=O)on1)C=O,0.126
N#CC1=NC2CCC2O1,0.2117
CC1OC2C1C2(C)CO,0.2997
COC12CC1CC1NC21,0.3018
CC1(COC1=N)C1CC1,0.2918
CCCCCC(=O)C,0.2343
O=C1C2CC1C(N2)C#N,0.2046
C1C2CC11N=COC1C2,0.2571
CCCC1OC(C)C1C,0.3203
CC(C)c1c(c[nH]n1)N,0.2265
O=C1NCC2C3CN3C12,0.2546
C1C=CCN1C=O,0.2421
CC1(O)C2OC2CC1=O,0.2146
C1C(COCO1)C#N,0.3046
COC(=N)N(C=N)C=O,0.2304
CC1C2OC2COC1=N,0.2778
N#CCC1NC1C1CO1,0.3076
CC12CC1C(O)CO2,0.2956
CCC(O)C(=O)C1CO1,0.2235
OC1CC2C1=CCC2=O,0.2197
CC12NC1C1OC1C2=O,0.19
CCN1CC(C)C(=O)C1,0.2055
CC#CC12COCC1O2,0.2704
c1c(onn1)C=O,0.1867
CC1OC2CC=CC1O2,0.2533
CC1C2OCC12C,0.3083
CNC1COC(=O)C1=O,0.1617
CC1([NH3+])CC1CC([O-])=O,0.2628
c1ccnccc[nH]c1,0.1705
OC(C=O)C12CC1CC2,0.2147
C#CC(=O)C1=NCCO1,0.1711
CC1OC(=N)C1(C)C#C,0.2803
CN=C1NC(C=O)C1O,0.2063
c1c(c2c([nH]1)[nH]cn2)O,0.2138
CC1CNC2=C1ON=N2,0.1763
CC(O)CC1CC1O,0.3241
CCOC1CC1N1CC1,0.2881
C1CC1CN=C(C#N)N,0.2166
Cc1c(=NC)cnon1,0.1822
C1C(CO1)(CO)C(=O)N,0.2676
CC1N2C(=O)CC12C#N,0.2293
CC1CC2C3NC3C12C,0.2979
CC(O)(CC(N)=O)C=O,0.2149
CC1C2C3C4C3C2(C)N14,0.2974
CC1C2OC(=O)C12O,0.2495
CC(=NO)CC(=O)OC,0.2528
CC(C)Cn1nccn1,0.256
Cc1c(oc(n1)N)NC,0.2306
CCNc1c([nH]nn1)N,0.2287
COC1CC(C)C2OC12,0.3295
C#CCC(C#C)N1CC1,0.2738
CC12C=CC3CC1C2C3,0.2461
c1c[nH]c2c1[nH]cc2O,0.2039
COC12CCC1(O)CC2,0.3059
OCC(O)C1=CCOC1,0.2371
CCC(COC)C1CC1,0.3412
CC1=[NH+]C=C(N1)C([O-])=O,0.1534
CNC(=O)NCCC#C,0.2979
N#CC1C2NCC3C2N13,0.2563
c1[nH]c2c(n1)CNC2=O,0.2209
Cc1cc(co1)N(=O)=O,0.1736
OC1CNC2=C1NC=C2,0.2084
CCC(O)C1CCOC1,0.3267
OCC12CC1(CN2)C#N,0.2663
CC#CC(O)(CO)C#N,0.2677
CC1N=COC1(C)C=O,0.213
N=C1OCOCC2CN12,0.2505
CC12OCC(CO1)C2O,0.3248
CN=CN(C)C(=N)C#N,0.1814
O=CC1C=CCC1C#C,0.2086
O=C1CN2C3C4C(C23)C14,0.1976
CC1C2C3OC(=O)N1C23,0.2619
CC1OC(C=O)C1=NO,0.2088
COC1(CCO)CC1O,0.3003
CNC(=O)n1cncn1,0.2392
O=C1CN2C3CC2(C3)C1,0.2053
CC(C)C1CCN1C=O,0.263
O=C1NCC2C3CC12O3,0.2515
OCC1C2CC(C=O)N12,0.2076
CCC12CC3OC1C23,0.3034
CC12OC1(C#N)C1CC21,0.2681
CC12C3C1C1C3CC21O,0.2991
CC1CC2(C)CC2(C)C1,0.3279
CC12OC3=NCC1(O)C23,0.1661
C(N1CC1)C12CCC1N2,0.3263
COC12CC(C)(C1)C=C2,0.2395
N#CC12C3C1C1C3OC21,0.2817
CC1(C)C2COC1C2O,0.2954
OC1C2C1C(=O)N2C=O,0.2224
CC12CC3(O)C4C3N1C24,0.2845
O=CC1OC23CN(C2)C13,0.1978
N#CC12CCC3CC1C23,0.3038
C1N2CC=C3CC=C1C23,0.2022
CCC(C)COC1CC1,0.3296
c1conc1C(=O)C#N,0.1893
C1COc2n1nnc2O,0.2123
COC1C2CC(OC)C12,0.3205
CC(C)C1(CC1O)C=O,0.2238
C1CC1(CCO)OC=O,0.2751
CCC1CC1N1CC1,0.3193
CCC(OC)C(C)OC,0.3144
OC1C(CC1C#C)C=O,0.2213
CC1(O)CCC(O)C1O,0.3177
CC1=NC2C(O)CC2O1,0.2637
CCC12CN1C(=N)OC2,0.2843
O=CC#CC12CCC1O2,0.1903
CC1CC2C(CC12)C=O,0.2224
C(C1CN1)C1=NC=CN1,0.2488
OC1CC(=O)OC1C#C,0.269
NC(=O)C12CCC1O2,0.2582
CC1C(C#N)C2NC12C,0.2741
CC1CC2CCC2(C)C1,0.3495
C1COC(=O)C(=O)CN1,0.165
CC1CC1(O)C1(C)CO1,0.3173
CC(=O)OCC1CCO1,0.2695
OC(CC(O)C=O)C=O,0.2225
CC#CC1=CCC2CC12,0.2001
CCC12CCC1(O)C2C,0.3074
CC(C)COC(C)C#C,0.2928
CCC12CC1(C)C(C)C2,0.3195
CC(C)C(C#C)C(C)=O,0.2219
CCC(C)(C)COC,0.3282
CC1OC2C(CC12)C#N,0.2864
CC1(OCC(=O)O1)C,0.2777
C#CC1(OC2CC12)C#C,0.2419
CC1C(CCC1=O)C=O,0.2155
OCC1C2CC1C2=O,0.2522
CC12CC1CC1(CC1)O2,0.3022
CC1C2CC1(O)C2C,0.3318
O=CC1CCOC1C#C,0.2228
CC1CC2(CC#C)OC12,0.2986
C1OC11C2C3OCC1C23,0.3231
CC1CCC=C1,0.2642
CCCN1C2CC(O)C12,0.2945
CC1=NCC(C)(O1)C#C,0.2695
CC(=O)NC(=NC)C#C,0.1963
CC1(C)CC2NC(=O)C12,0.2697
CC1OCOC(C)C1=O,0.2026
CC1=CCCOC(=O)N1,0.2306
CC12COCC(N1)C2O,0.3061
CCOCC(C)C(C)C,0.3326
CCN1CCC(=O)CC1,0.2124
CN(CC#C)C1COC1,0.2558
c1(=O)c(nc(n[nH]1)O)F,0.1648
CC1=NCC2CN=CN12,0.233
CC1=CC2(O)C3CC2C13,0.2251
CC1C2NC=CC(=O)C12,0.1834
C1C2CCC3=CC=C1N23,0.1843
C1CC(O1)C1COCO1,0.3206
N=C1NC=NC=NC1=N,0.1855
CC(O)C(O)C(C)=NO,0.2518
CC12CC1COC2CO,0.3305
CC(C#N)C1NC1C#N,0.2975
OCC(O)(CO)C1CN1,0.2904
CC12C3CC1(C)CCC23,0.3214
CCC(C)(C)COC=O,0.2867
CCC12CC(C)(O1)C2C,0.3189
OC12CN3C(C=CC1)C23,0.2203
CC1C2CC1(O)C=C2C,0.238
CC1OC(C#C)C11CN1,0.2669
Cc1ccc(nc1)C#N,0.2076
C#CC(CCC=O)C#C,0.2272
CC#CCCOCC=O,0.222
CN=C1OCOC1=N,0.2277
CCCC(=O)OC(C)C,0.2855
CC(C#N)C(C=O)C#N,0.2212
C1CC1(CC#N)NC=O,0.2745
CC12C3CN1CC2O3,0.2739
CCC1CCC2(C)OC12,0.3389
OC1C2C3C(O)C1C23O,0.3036
CCC1(C)C=CC2OC12,0.2455
CC1OC1C1OC1C,0.3338
CN(C=O)C(=N)C(=O)N,0.1995
CN1C2CCC1C1OC21,0.2966
CC(NCC(N)=O)C=O,0.2139
CCC1CC1C(C)=O,0.23
CC#CC1N2CC1(C)C2,0.2566
CNc1c2n(nn1)CC2,0.2101
c1c(nc[nH]1)C2(CC2)O,0.2424
C#CC1CN=CNC=N1,0.2223
c1ncn(n1)C(=O)C#N,0.197
CNc1cc(oc1)N,0.2224
C#CC12CC3NC3C1O2,0.2674
C1OC2C3C=CC(O1)C23,0.2431
c1cc(nc(c1)F)C#N,0.2033
OC1=CC(=O)N=NO1,0.208
C1CC1(CCCCO)O,0.3253
OC1C(=O)CC1(O)C#N,0.2081
O=CC12CC1(OC2)C#C,0.2022
CC1CCC2(O)CC12,0.3329
CCC1C(OC1=O)C=O,0.2219
OCCC(O)C(=O)C#N,0.1754
CC12C3N1C1C2CC31C,0.3018
OCCC12C3CC1OC23,0.3031
c1c[nH]c(c1N)C=O,0.1711
CC([NH3+])CCC([O-])=O,0.2729
CC1C2C3OC3C12C,0.2847
CC12CC3C(O1)C3C2O,0.3173
CC1(O)C(=N)NCC1=O,0.2093
CCC1C2OC3CC3C12,0.3142
N#CC1CCN2CC12,0.2821
CC1C2C(O)C2C=C1C,0.2312
OC12COCC1NC2=N,0.2638
COC(=O)C1CCOC1,0.2626
CNc1ccc(cc1)O,0.1838
O=CN1C2CC1COC2,0.2606
CC1COC1C=O,0.2136
OC1CC2C3CC2C13,0.3381
CN1CC11C2NC1C2=O,0.2325
Cc1cc([nH]c1NC)C,0.2308
CC(O)C1C2C3OC2C13,0.2976
COCC1COC(C)=N1,0.2625
COc1cc[nH]c1C#N,0.1994
NC1=C(F)C(=N)C=CN1,0.1844
C1OC11CC2CC1C2,0.3482
OC1C2CCC(=N)OC12,0.2744
OCCC(O)CC#N,0.3017
c1c(cn2c1C=CC2)N,0.1588
CC1(O)C2CC(O)CC12,0.305
c1c(nc([nH]1)NC=O)N,0.1723
CC12CC1(C)N(C2)C=O,0.2557
OC(CCC#N)C#N,0.3129
CN1C2C(O)C1(C)C2=O,0.2323
CC12OC3CC1C=CC23,0.2402
C1NC23COC12C=CC3,0.2273
CC(CO)N1CC1(C)C,0.3085
CC(C)CC1CCC1,0.3631
CCc1[nH]c(c(n1)O)C,0.2199
O=C1CC2OC2C1=O,0.1483
CN=C1OC2(C)CNC12,0.2538
CC12CC1(O)C1CC1O2,0.2956
CC1(O)C2OC1C21CO1,0.3033
O=CC12CC(CC1=O)O2,0.2005
CC12CC(C)(C1)C21CN1,0.3074
COC1(CO)C2CCC12,0.322
CN(C(=O)C=O)C(=O)N,0.1762
O=C1NCCC2NC12,0.2487
CN1C=NC2(CC12)C#C,0.2383
CC(C)(CC#N)OC,0.2996
CC1C2C1C(=NO)C2C,0.2426
CCC12CCC1OC2=O,0.277
C1C2OC2C2=CC=NN12,0.2438
CC1C(C)C2C3OC3C12,0.3202
C1C(=O)C(O1)(C#N)C#N,0.2211
COC1=CC(=O)ON=N1,0.1671
CN1N=C(C)C=CC1=N,0.1522
CN1C(C=O)C1(C)C#N,0.1926
CC(=N)OC1=COC=N1,0.2318
c1ccc(=O)nc(c1)O,0.1684
Cn1ncc(=O)cn1,0.1784
OC12CC3C(CC13)C2,0.3266
CNc1ncc(o1)OC,0.2268
CC(C)(C(=O)C#C)OC,0.2011
Cc1nc(on1)C2CC2,0.2481
CC(CC1(C)CC1)C#C,0.3116
CC(C)N1C2CC(O)C12,0.2924
OC1C(C#C)C1C1CO1,0.2797
CC(CC=O)OC(N)=O,0.2254
OCC1(O)CNC1=O,0.2604
CC(CO)N1N=CN=N1,0.263
CC12CC(N1)C2C#N,0.2791
O=CC(C#N)C1CN1,0.21
CC12CC3CC1CC2O3,0.3197
c1c(c(n[nH]1)C=O)C=O,0.1858
c1cn2c(n1)OCC2,0.2429
Cc1ncc(o1)C2CC2,0.2255
OC12CC(CCC1)C=C2,0.2565
CN1CC1C(C)=NO,0.2222
COC(CCO)C1CO1,0.3303
CN=C1N=CNC(O)=N1,0.1906
COC(C)C1CC(=O)N1,0.2815
C#CC12COC1C1OC21,0.2681
CC1CC(C)(O)C1C,0.3203
COC12CC(C)(C1)OC2,0.3149
N#CC12CC3CC1C2C3,0.3091
O=C1CC(C1)C1CCO1,0.2255
CCOC(C#C)C1CC1,0.2994
OC12CC3C(C1)OC23,0.3072
CC1C2C3OC4C1N2C34,0.2594
CCC1C2OC(=N)C12,0.2777
CC1CC2CC2C(O)C1,0.3284
NCC(NCC#C)C#N,0.2628
CC1CC2CC11OCC21,0.2949
CC1OC1CC(=O)C#C,0.2029
C#CC12CCC1N2,0.275
CNC(=O)C1NC1C=O,0.2123
CN1CC1C(O)C1CN1,0.2873
Cc1cc(=NO)cn[nH]1,0.1572
CCN1C2C1C(O)C2C,0.288
C1CC1(C=O)C#CC=O,0.2028
CCC1CC=CC2CC12,0.2466
CC1=CC2(O)CN(C2)C1,0.2242
CC1C(N)C1(O)C#N,0.2712
OC12CC3CC1OC2C3,0.3032
OCCN1C=COC1=N,0.2206
CCCC#CCN1CC1,0.2792
Cc1cc(noc1=O)C,0.1844
CC(C)(C1CCC1)OC,0.3237
CCCNC(=N)C#N,0.2112
O=C1CC23CCC2(C1)N3,0.2005
C1C2CC1CCCCC2,0.3412
CC12OC3(C)C4C(C14)C23,0.3313
CCC(=O)C1(C)OC1C,0.2219
CC1OC(=O)CC1C#N,0.276
CCC1=CC(=O)N2CC12,0.1992
C1C2CC=CCC1O2,0.266
CCC(C)(O)C1CN1,0.2935
Cc1c(c(nn1C)O)O,0.2241
OCC1OC1(C=O)C=O,0.195
C#CC12CN3CC3C1N2,0.2526
C1CC(C1)C2(COC2)O,0.3101
CN1CC1C1OCC1O,0.2762
CC(O)CC1=NC=NN1,0.2671
OC1(CC1C=O)C=O,0.1962
C1OC11C2COCC1O2,0.3204
CN(C)Cc1cc[nH]n1,0.2246
COC1CCC2OCC12,0.3174
C1CC2CC1OCC=C2,0.2572
CC1OCOCC11CN1,0.3117
CC(O)C1=C(N)ON=N1,0.208
CCC(C#N)C(C)O,0.3097
c1nc(c(o1)NC=O)O,0.2229
N#CCC1NC11CCC1,0.295
CC(C)C1(C)C(C)C1C,0.3258
OCC1(O)COC1=N,0.2741
OC12CC(OC1)C21CO1,0.2999
OCC1CC2=NC=CN12,0.2554
CC12C3CC1(O)C(O)C23,0.3035
OC1(CC=O)C2COC12,0.2131
c1c(=O)nc(oc1O)F,0.2241
C1C(CO1)CCCC=O,0.2249
N=C1CC2OC(=O)C2O1,0.2504
C1C2CC11CC=CCC21,0.2706
CC1C([NH3+])CC1C([O-])=O,0.2654
N#CCC1CC(C1)C#N,0.3299
CC1CC1(C)NC(C)=O,0.2708
Cn1cnc(n1)N2CC2,0.2301
COCCCNC(=O)N,0.3031
OC1CC11NC=CC1=O,0.1859
CC1=CNN=C(F)C1=N,0.1774
CC(O)C(O)C1CCO1,0.3155
CCC1(O)CC2CC12,0.3128
C#CCC1CC(C1)C#N,0.299
C1C2COC3=NCC1N23,0.2481
C1CCOC(=O)CNC1,0.2325
CC(C)c1c([nH]nn1)O,0.2389
CN=C1CC(=NO)CO1,0.2351
c1nc(c(o1)N2CC2)N,0.2019
CC(C)CC1CNC1=O,0.2802
OCC1=CC2C3CC1C23,0.2351
CC1OCC2C3CC12C3,0.3283
OC(C#N)C1(CO1)C#N,0.2981
NC1C2NC1(C=C2)C#N,0.223
C(C#N)C(=O)C=O,0.1575
OC12CCC3C(CC13)C2,0.3282
CCN=C(CO)NC=O,0.2128
O=CCC1CC=CC1=O,0.1834
COC1(C)C2CC2C1=O,0.2081
CC12CC3C(C1)C3O2,0.3142
C#CCC(=O)C=O,0.1533
CC1(NC1(C)C#N)C=O,0.2223
CC1CC2OC3C1C23O,0.2897
C1OC2=NCCCC12,0.2699
CC1C(C)C2(CO2)C1=O,0.2032
N=C1OC(C=O)C2CN12,0.2174
c1nc(n(n1)CCO)O,0.2636
CC12C3C4C1CC4C23O,0.3045
COC(C)C#CC(N)=O,0.2346
Cc1ccc(nc1F)F,0.219
C1C2OC1C1=C2NC=N1,0.2257
O=C1NC2CC2NC=C1,0.2016
CCCC(C)COC,0.3371
CC1=CNC(=N)C1=NO,0.1433
CCC(C=O)C(O)C=O,0.2189
CC1CC1CC#CC=O,0.2054
CC(O)CCC(N)C#N,0.298
[NH3+]C1C2OC1C2C([O-])=O,0.1457
CCC(=O)c1cc[nH]c1,0.2036
OC1CC(=O)NC1=O,0.2354
CC#CCC#CC#N,0.2268
CC1C2OCC12CCO,0.3039
CC(NC=O)C(F)(F)F,0.2822
CC(C)(CC=O)C#N,0.2196
NC(=O)CC1CCC1O,0.2784
CC12C3C4N1C4(C=O)C23,0.1883
Cc1c(c(on1)N)C#N,0.2255
N=C1NC(C#C)C11CO1,0.2556
CNC(CC#N)C(C)=O,0.2062
c1cncc(=O)nc1O,0.1632
Cc1c(con1)CCO,0.2488
CCC1CC2C=CCC12,0.2597
OC12CC(C1)C1OCC21,0.3136
N#CC1CC2CC2C1,0.316
OCC1(CNC=N1)C#C,0.2448
CC1CCC2(O)C(O)C12,0.2975
CC1C2C3CC1CC23C,0.3408
C(C(=N)N(C=N)C=O)O,0.2188
Cc1c2c(n[nH]1)C=CC2,0.2071
C1N=C2OCCN3C1C23,0.2227
CC1C2OC3(CC3)C12,0.3036
CCNC1(CC1N)C#N,0.2565
CC12CC1C1NC1C2=O,0.2028
CC1NC1C1OC2CC12,0.3035
C#CC1CCC=C1C#N,0.2195
C1N2C3C4COCC13C24,0.3021
O=COC12CC1C1CC21,0.232
CCOc1cnccn1,0.1989
O=C1CC2COCCN12,0.2615
OCC(=O)C1C2CC1C2,0.2299
FC(F)(F)C(C#C)C#N,0.2975
COCC12CC1C1CN21,0.2789
Cc1c([nH]nc1C#C)C,0.2242
CC(=O)C(O)CCC#C,0.2277
Cc1ccn(c(=O)n1)C,0.1843
COCC(O)C(O)CO,0.3216
CC1CC(C1)C1CCO1,0.3251
NC(=O)C1CC(O)C1=O,0.1986
C1CC11C2C3C=CC1C23,0.2351
CC(C)(CC=O)C1CO1,0.2218
CCC1OC(C)C1=O,0.2207
OCC1C2CC=CC12O,0.2462
CC1(O)C2(C)CC1(C)C2,0.316
OC1CC11CC2CC1O2,0.3167
CC1C(CC=O)N1C=O,0.2154
COCCC(=O)N1CC1,0.2536
OC1COC(=N)C2NC12,0.2593
CC1(CC(N)=O)CC1O,0.2663
N#CC1(CN2CC2)CN1,0.2595
c1cn2c([nH]1)nc(n2)O,0.2336
CCC1(CC1C#C)OC,0.2813
CN=C1OC=NC(O)=N1,0.183
N#CC12C3C4CC1N2C34,0.2502
NC(=O)OC1CC1O,0.2905
N#CC#CC1CO1,0.2274
CCC12CC1(CO2)C=O,0.2148
CN1C2C3C1CC23C#C,0.245
OCC1(CO)C(O)C1O,0.2789
CC12CN3C(C13)C2C=O,0.2079
CC(=O)Cc1cnn[nH]1,0.208
C1C2C3C4C1OC4CN23,0.3004
CC#Cc1c(con1)C,0.2194
CC12C3C(C1O)N3C2=O,0.246
C1NC11COCC2CC12,0.299
CC(=O)N1CC1CC=O,0.2217
CC1(C)N2CC1(C2)C#N,0.2699
CC1C2CC1C(C)(O)C2,0.3303
N=C1CCC2(CN2)CO1,0.2776
CC1(CC1)C2(COC2)O,0.314
CC1(O)C2C3CN3C12C,0.276
CC(O)CCC#C,0.3134
CC1C2CC1(C)C=C2C,0.2376
CN=C1N=CNC=C1O,0.1852
OC12CCC1=CC1OC21,0.2361
CC12COC1C2(O)C#N,0.2597
CC(=O)C1(C)COC1=N,0.2259
C1C(CO1)C(CO)CO,0.3026
CN=C(C#N)NC1CC1,0.2025
CN(C)C(=O)C=O,0.177
Cc1c(con1)C=O,0.2004
Cc1c(n[nH]n1)N(=O)=O,0.2066
CC1OC2CCC3C1C23,0.3164
c12c(nc([nH]1)N)n[nH]n2,0.2069
CC(C)C12OC1CC=C2,0.248
CNc1cc(on1)C#N,0.1778
c1[nH]c(c(n1)NC=O)N,0.1975
Cc1c([nH]nn1)CC=O,0.2057
CCCC(O)C1(O)CC1,0.3167
CN1C2CC(=O)C=CC12,0.1731
OC(CNC=O)C1CO1,0.2806
O=CC1=NC(=O)N=NO1,0.1682
O=CC12CCC1COC2,0.2173
CNc1cc(oc1)CO,0.2132
C1CC11OC2C3OC1C23,0.2805
COC1=C(N)OC(=N)O1,0.2411
C#CC(=O)C#N,0.1947
CN=C1CC=CC(C)O1,0.2516
CC1C(N1C)C(C)=O,0.2173
CC1NC(=N)COC1=O,0.2357
OC1C(OC1=N)C#N,0.276
N=COC1=NON=C1,0.2244
CC12COC1CCC2O,0.3083
OC1C(OC1=N)C1CC1,0.2837
CCc1cnc(o1)CN,0.2377
OC1C2CC1(O)C=C2,0.2399
CC1CN2CC2(C)C1O,0.2838
COC(=O)C1(C)CC1C,0.2776
OC1CCC2OC12C#N,0.2745
CC1CC(C)(C)CCO1,0.3177
CC1C2N1CC2(O)CO,0.2737
Cn1cncc(c1=O)F,0.1941
CC12NC(C1O)C2O,0.3132
CCC(C)C(C)(C)CC,0.3649
OCC12CC3CC(C1)N23,0.2808
CC12NC1C1CC2O1,0.3079
CN1C2CC1C2(O)C#C,0.2356
CC1=C(N=CO1)C1CN1,0.2211
CC(O)C1(C)CC(=O)O1,0.2845
OCC(CO)C1CCO1,0.3049
OC1CCC11CC2NC12,0.3047
CC1OC1C1=CC=CN1,0.2321
CC1(CCO)CO1,0.3372
C#Cc1c([nH]nc1O)O,0.2329
C1CC1OC(C#N)C#N,0.2556
OCC(O)CC1COC1,0.2957
CCCc1c(nc[nH]1)C,0.2436
CC(C)C1CC1CO,0.336
CCNc1cn[nH]c1C,0.2166
CC1=CC(=O)C(=O)C1,0.1423
COC12CCC(CC1)O2,0.3298
Cc1cc(on1)COC,0.2474
CCOc1c[nH]nc1,0.2325
CC(C)c1ncnnn1,0.1627
O=C1CC2OCC=CC12,0.2115
CC(C)(C)C1CNC1=O,0.2797
CC1C(O)C1OC(C)=O,0.255
CC(C)(C)C1CCCC1,0.3688
CC12CC1(CC2)C(N)=O,0.2637
C1C2C3C=CC4C1C2N34,0.2065
c1[nH]c2c(n1)OCCC2,0.2238
O=C1NC2CC2C(=O)N1,0.2407
CC(O)CCC#CC#C,0.2302
C#CC1CNC(=N1)C#C,0.2033
CC1=CC=CCOC1=N,0.1754
CCC1=CC(=O)C2CC12,0.1888
COC(=N)N1N=CN=N1,0.2257
CC(=O)CC(=O)C,0.2068
CC1C=CCN1C(C)=O,0.2409
NC(=[NH2+])CC(=N[O-])C#N,0.1735
CN1C2C3OC=NC2C13,0.2236
CC1=CC(O)CCOC1,0.2461
C1C2OC3=C(N=CO3)C12,0.2154
OCC1=CC2CC3C2C13,0.2371
c1cncc2c1nno2,0.1868
Cn1c2c(cn1)CC=C2,0.1905
CC12COC1(CN2)C#N,0.236
CC(O)C1CC=C(C)C1,0.2602
CC1OC=NC1C=O,0.2124
c1c[nH]c(=O)nc1CO,0.1861
CC1CN(C1)CCC#N,0.267
[O-]C(=O)C1OC11C[NH2+]C1,0.2489
N=C1OCC2=CCOC12,0.2345
C#CCCC(=O)C=O,0.1542
OC1COCC(O)C=C1,0.2449
CC1C(C#C)C1(C)C,0.2866
Cc1cc(no1)OC,0.2479
C#CCC1OCC2NC12,0.3001
CCCCC1CC(C)C1,0.3656
CNc1cnc([nH]1)C=O,0.1614
CC12CC3(O)C(CC13)C2,0.3192
CCC1(C)CCC1=NO,0.2508
CCC(=O)C1(C)CO1,0.2237
c1c(noc1N)C#N,0.1974
CC(C#C)C(C)(C)C=O,0.2259
CCC1C(O)C=CC1O,0.2583
CCCNC(=O)C(=O)C,0.1789
C1NC1C12CC1OC=N2,0.2593
CC#CC1CCC1C#C,0.2794
OC1C2CC1CCC2,0.3152
CCC(=O)c1c[nH]nn1,0.2079
CCc1[nH]c(c(n1)N)O,0.2308
C#CC12CCC1(N2)C#N,0.2465
OC1CC2C3OC3C2C1,0.3231
C1CC12COC(=O)C2=O,0.173
CC1=CC(CO)C2OC12,0.2388
CC1NC1C(=O)N(C)C,0.2574
c1cc2c(cc[nH]2)nc1,0.1936
Cn1c(cnn1)COC,0.2515
CC12CC3CC1C2CO3,0.312
OCC1OCOCC1=O,0.2054
CC1(COC(=N)O1)C#N,0.2712
CC1OC2CC3OC3C12,0.3149
CC(C)CCNCC#N,0.2697
OCC1(CN1)C#CC#N,0.2262
OCC(O)C1(CC1)C#C,0.2803
OC1CC11C2C3CC1C23,0.3106
O=C1CN2CC1CCC2,0.1933
CC1CCC(C1)C1CO1,0.341
OC1CCCCOCC1,0.3188
CN(C)c1conn1,0.1813
C1C(=CNC1=O)NC=O,0.1843
OC1C2NC1C2OC=O,0.2656
CC1CC(C)=CC1(C)O,0.2606
CCC1(CC1)C(=O)C,0.2314
C#Cc1c(cc[nH]1)O,0.1948
CC(=O)OC(CO)C=O,0.2308
C(=O)C(C#N)C#N,0.2228
[NH3+]C(C#CC#C)C([O-])=O,0.2211
COC1C(O)C(O)C1=O,0.1779
CC1C(C)(C)C1(N)C#N,0.296
Cc1c(cnc(n1)C)F,0.2072
CCC(C)(C)CCOC,0.3216
OC1C2NC2C11CCO1,0.2862
COC1CC2C3CC1C23,0.3295
CC1=CCC(C=O)C1=O,0.1937
C1C2OC3OC4C2C4C13,0.3152
CC1NC1(CO)C1CC1,0.308
CCC1OC(=O)C1C#N,0.278
CC(O)C1CC(=O)CO1,0.2208
CCC1C(=O)NC11CC1,0.2742
Cc1c(oc(c1N)C)C,0.2161
O=CN1CC1(C=O)C#C,0.2142
CC1C2CC(C#C)C12,0.2994
CC1=CCCOC1=N,0.2185
c1c(c(ncn1)N)O,0.2053
N#CC#CC1C2CCN12,0.2019
c1c[nH]cc-2ccnc12,0.1606
CC12CC3(CN3)C1C2O,0.3132
CC12C3OC1C3OC2=N,0.2583
OC1C2OCCC2C1=O,0.1957
C1OC2CC1C=CC2,0.2569
CCC1(CC1C#N)C#N,0.2902
O=C1CCC2OC2CC1,0.2262
Cc1c[nH]cc1C(C)C,0.2494
CC1OCCC(=C1)C#N,0.2223
CC1CC(C1)OC(C)=O,0.2831
O=CCC1C2OC(=O)C12,0.2209
CCC(C)C1CC1C,0.3471
NC1(CC2CC12O)C#N,0.2947
N#CC1OC2CCC1C2,0.284
CC12C=CC3C1C2C3=O,0.2052
O=CC(=O)C1C2CC1O2,0.141
O=C1CCC(=O)N2CC12,0.2104
OC1C=CC2OC2C1=O,0.1876
OC1CC(=O)CN2CC12,0.2131
CC1(C)CC2OC2C1O,0.3226
OC1C2NC11CCOC21,0.3046
C#CC1=C(COC1)C=O,0.164
CC1N=COC1CO,0.2652
CN1C2C3(O)CC3C12C,0.2779
OC1=NNC(=O)C(=N)N1,0.188
C1C2C3CN1C23,0.3121
C1CC1(C=O)C#N,0.2295
COC(C)C1CC1,0.3334
CC1NC11CC=CC1O,0.2444
COC1C(C)C=CC1C,0.2633
CC1C(C([O-])=O)C1(C)[NH3+],0.1392
c1c2n(cn1)CC23CC3,0.2498
CCC1C2CC2C2CC12,0.318
CC1N=C(NC1=N)C#C,0.1914
CC(C)C1C2C3C1CN23,0.3125
CNC1(CC1C)C#N,0.2658
CN=c1[nH]ccn1C=O,0.174
CC(O)(C#N)C1CO1,0.2943
CCOc1nnn(n1)C,0.2285
CC(=O)c1cn[nH]c1N,0.1932
COC1CC1CC1CO1,0.3253
CN1N=CC=C1C1CN1,0.2456
CCc1cn(nn1)C=O,0.202
CCC(O)C1=COC=C1,0.2415
CC1(CO)CN=CO1,0.2695
O=C1C=CC2CN2C=C1,0.1614
CCC1(CN1)C(C)C#N,0.2938
CC1C(=O)OCC1(C)C,0.2741
CCc1cccc(c1)C,0.2369
CC1CC2CCCC12,0.3509
c1c[nH]cc1C2CC2,0.2392
C#CC1C2CCCC12,0.2875
OC(C#N)C(C=O)C#C,0.2166
CCC1CC2=CCCC12,0.2458
COC(CO)C1CC1,0.3181
O=C1OCC=CC2OC12,0.231
CC#CCc1cnn[nH]1,0.2551
CC12NC(C=C1)C2C#N,0.2358
Cn1ccnc1CC#C,0.2427
OC1CCOC2CCC12,0.3195
COC12CN(C1)C1CC21,0.3008
CC1(CC(O)C1)C(N)=O,0.2714
CCC1=C(CCC1)C,0.2523
c1cocc1N(=O)=O,0.1832
O=CC(=O)C1C2CC1C2,0.1509
CC1(CC(=O)N1)C1CC1,0.2788
Cn1cnc(nc1=O)O,0.2155
C1C2OC2C11CN=CO1,0.2662
CC(C)(O)C1(CO1)C=O,0.2173
CC1C=CNC1=O,0.2147
CC1CC(C#C)C1C,0.3039
OCC12CCC1(O2)C#C,0.2612
C1C2CC3CC1C2CO3,0.3092
C1CC23CC4(OCC24)C13,0.1264
COC(=O)N1CC(C1)O,0.2923
OCC(CC#N)C#N,0.3055
COC1C2(C)CCC12O,0.2975
O=CC1C=CC2CC1O2,0.1974
NC(CO)=[NH+]CC([O-])=O,0.2493
OC12C3CC3C1CC2=O,0.2004
c1coc(c1C=O)CO,0.1949
N#CCCC1OCC=C1,0.249
C1CC1OC1CCCO1,0.3388
CC1COC(CCO)C1,0.3234
Cc1c(nc(o1)C)C#N,0.2188
C1CNC(=O)COC1=O,0.2546
CC(C)C(C=O)C1CN1,0.2091
c1cnc([nH]1)C(=O)C=O,0.1459
C1OC2OC(C=C2)C=C1,0.2378
c1cnn2c1ncnc2,0.1781
CCC12COCC1N2C,0.3021
C1C(CO1)COCCO,0.323
CC12CC1(NC2=O)C=O,0.2098
C1CN1CC(=O)N2CC2,0.2435
CC12C3CC1(O)C=CC23,0.2404
Cn1ccc(c1O)C=O,0.1889
Cc1c(ocn1)C#C,0.2006
OC1C2C3NC2(C=O)C13,0.1966
CC12C=CCC3CC1C23,0.2461
CCC1CC(O)C(=O)N1,0.2748
CC([NH+]=C(C)N)C([O-])=O,0.2491
CC1(C)C2CC1OCC2,0.3101
CCNc1ncncn1,0.2075
C1C2CC3CC4C(C12)C34,0.3187
OC1C2CCC1C2O,0.3195
COCC12COCC1O2,0.3252
CN(C)c1cc(c[nH]1)O,0.2211
c1nc(c(c(n1)F)F)N,0.2228
C1C2COCC3CCC123,0.3293
CC12OC1C1CC21C#C,0.2499
O=C1OC2C3OC3C12,0.2703
CCNCC(O)C#N,0.28
CC(CO)C1CCC=C1,0.2626
CC1OCCC2CC1C2,0.325
CC1C=CCCCC1=O,0.2241
OCC1C2N3CC2(O)C13,0.3125
CN1C2(C)CC1(C2)C=O,0.189
C1C2CC3OC4C1N2C34,0.2784
OC12CC1OC1CC21,0.3016
CC(C)(CCO)CC#C,0.3081
N=C1OCC(=O)OC1=N,0.2161
CC(C)(C(=O)C1CC1)O,0.2157
COC1(C)C(C)NC1=O,0.259
CC#CCCCN1CC1,0.2954
N=C1N=COC(=O)C=N1,0.1782
Cc1c(cn[nH]1)C=O,0.2078
ON=C1CC2NC12C=O,0.1994
OCC1(O)CCOC1=O,0.2541
CC1NC11CC(O)C1C,0.2998
CNc1nnn(n1)C,0.2064
OCC(C=O)C(O)C#C,0.2221
CC(O)C1C(C#N)N1C,0.2577
OCCC1CC1CC#C,0.3139
CC1(CC1(C)C#C)C=O,0.224
ON=C1COCC1C#C,0.2412
CC1CC=CC(C)C=C1,0.2562
CC12COC(=O)C1CO2,0.2685
CCn1ccc(n1)OC,0.2396
C1C2COCC3OC1C23,0.3101
C#Cc1cn[nH]c1O,0.2314
OC1CCC2CC12C=O,0.2261
CCCc1c(nc[nH]1)O,0.2236
N=COC1COC(=N)C1,0.2784
Cc1ccc(n1C)OC,0.2329
Cn1cnc(=O)nn1,0.1677
CCN1CC1C1(C)CO1,0.3074
CC1=C(C)C=NC(=N)O1,0.1594
NC1=NC=C(O)NC1=N,0.1612
FC1=CC(=N)NC(F)=N1,0.1919
OC12CC1C(O)(C2)C=O,0.2224
c1c(oc(=O)o1)C2CC2,0.2432
COC(=O)c1ccoc1,0.2146
CC12CC1(CN2)C#N,0.2604
OCC1(CCC#N)CO1,0.3122
CC1C2C3NC3C1N2C,0.2903
O=C1CC2CCC1CO2,0.2217
OC12CC3N(C1)C23C#N,0.2621
CC1CC2OC(C)OC12,0.3317
C1C(=O)CN1CCC=O,0.2087
COC1(CC(=O)C1)C#C,0.2194
CCOC(=O)C(C)OC,0.2547
CC1(CO1)C(=O)C#N,0.1987
CC(=O)C1CC2(C)OC12,0.2234
Cn1c(cnn1)C#C,0.2123
CCC1(O)CC2NC12,0.2953
CCC1C(CO)C1C#N,0.2961
CC1CCOCC1C#C,0.2972
C1C2CC=CC1O2,0.2399
c1c(ncnn1)F,0.1775
O=CCC1CCC=CC1,0.2236
CC1NCC(=O)NC1=O,0.2213
CC1=C(CC(=O)C1)C,0.2221
CCC(C=O)C#CC#C,0.202
CCC(N)C(NC)C#N,0.2787
COC1C2CC1(O)CO2,0.2984
CC1(O)CC1(C=O)C#N,0.22
Cc1c(cnc(n1)N)N,0.1722
Cc1c(cn[nH]1)N,0.2276
CC1OCOC2CCC12,0.3347
CC1CC2C(O)C2C1O,0.3013
CC#CC1C2OC1C2C,0.2825
Cc1c(=O)cc(on1)N,0.1888
CC1(O)CC2C(C=O)C12,0.2169
C1C2OC2C11CC=CC1,0.2641
CCCC1COC(=O)O1,0.3318
CC1C2N=C(C)OC12C,0.2564
CC1=CC2CC2C1,0.2447
CN1CCCC(=C1)C=O,0.1835
C1C2CC1C1OC21,0.3442
CCCC12CC(O)C1O2,0.3262
CCC1(CN1)C(C)O,0.3119
CC12CC1N1C=NC=C21,0.2312
N=C1NCC=CCC1=O,0.2113
Cc1c(nc[nH]1)COC,0.2417
C1C(COCO1)CO,0.3236
CN=C1C(=O)OCCO1,0.1962
CC(C)N1CC1CC#N,0.2621
C1CC1COCCO,0.3426
CCN1C(=N)ON=C1O,0.2505
CC12CC(CC1=O)C2O,0.2281
OC1CCC=CC1,0.2682
CN=C1OC(C)C11CN1,0.2624
O=CCCC1CCO1,0.2291
COC(=O)C(C)(O)C=O,0.2158
CC1C2CCC22COC12,0.3051
CC#CC1NC1CCO,0.2754
OCCC1(CN1)C#N,0.2913
CC#CCc1ccn[nH]1,0.2607
C(CC(=O)N)C#CCO,0.2704
C(C(CO)(C=O)C=O)O,0.2048
CC1C2CC3(C)CN1C23,0.2796
OCC1=CC(CC1)C#N,0.2592
CC1CC1C1(CO1)C#C,0.2816
OC1C(O)C1OCC=O,0.2111
CC1(CC=O)C2CCC12,0.2234
CC(C#C)N1CC1CO,0.2633
c1ccc(c(c1)CO)O,0.2217
N=C1OC=NC=C1,0.1815
CCC1C2C(O)C(=O)N12,0.2224
CCC(OC)C1OC1C,0.3287
CC(=O)OC1(CC1)C#N,0.2782
CC1OCC11CCO1,0.3147
CC12CC1(CO2)C(N)=O,0.2574
OC1CC(C#C)C11CC1,0.3017
CC1CC2(CCN12)C=O,0.1887
C1C(N1C=O)(C=O)C=O,0.1943
OC(C#N)C1=NOC=C1,0.2527
C#CC1=CC(=O)NC1,0.1909
CC1NC11C2NC1C2=O,0.248
Cc1c2c(co1)COC2,0.2281
Cc1c(c[nH]c(=O)n1)N,0.1577
OC12CN3C1C1OC1C23,0.3024
OC1CNC11CC1C#N,0.2604
O=CCC12C3C4C3N1C24,0.198
OC12CC1(CC2)C#C,0.2548
OC1COC1CC1CC1,0.3029
CC1C2(C)C3N2CC13O,0.2865
C#Cc1ccc([nH]1)N,0.1881
CC1=CC2CC1OC2=N,0.237
CCC1(C)C(C#N)N1C,0.2594
CC1C(O)C1C(C)=NO,0.2277
OC1(CCC1)C1CN1,0.2985
C#CC1CC(CC#N)C1,0.2946
OC1CC23CNC12CO3,0.2732
CCC#CCC1OC1C,0.2974
Cc1cc(c[nH]1)C#C,0.2167
CC12CC1NC(=O)C2O,0.2547
CC1C2CC3N2C13C,0.3228
C1OC23COC(CC12)C3,0.3145
Cn1c(cnc1C#C)O,0.1926
COC1C2C(=O)NC12C,0.2527
C#CCCC1(CC1)C#C,0.2907
NCC1(CC1C#N)C#N,0.2518
C1C2OCC3C=CC2N13,0.2118
CC(O)CN1CC(O)C1,0.3043
O=CC12CCN3CC1C23,0.2099
CC12OC3CC4C1N4C23,0.2986
CC12OC(C1C#N)C2=O,0.2427
N=C1NC=NCC(=O)N1,0.2222
OC1COC2(COC2)C1,0.3004
C#CCCN=C(C#N)N,0.2156
CCC1(OC1C)C(N)=O,0.2622
CC1=CCCCCC=C1,0.22
NCC1(NC2CC12)C#N,0.2612
CC1CCC2(CC12)C=O,0.2314
CC1=CC2NC1C2=O,0.2344
N#CCCC12CC(C1)O2,0.2854
CCC1CNC(=O)CN1,0.2475
C1COC(O1)C2COC2,0.3235
Cc1cc(oc1)OC=O,0.2162
CC1C2C3OC2C13C#N,0.2661
CC1CN(C1)C(=N)C#N,0.1985
COC1C2CCC12OC,0.3219
COC1(C)CC(C)(O)C1,0.317
O=C1CNC(C1)C1CO1,0.205
O=C1CC2CCC2CO1,0.274
CC(CN)(C#N)C#N,0.2644
CC1C2COC(=O)C12C,0.2729
O=C1N2CC2C11COC1,0.2262
NC1(CC1C1CN1)C#N,0.2694
c1coc(=O)c(=O)o1,0.1836
c1c[nH]c(c1N)NC=O,0.192
C1C2C1C13CC2C1CO3,0.3117
O=C1OC2CC1C21CO1,0.2728
CN1CC1COC(N)=O,0.2818
CC1CCC2CCC12C,0.3472
COCC1(CN1)C(N)=O,0.2638
CC12CC(=O)N1CCC2,0.2526
COC1CC1(OC)C#C,0.262
O=C1CCC2OCC2N1,0.2711
COC1CC2CC12C,0.3261
CC1(O)CC2C1NC2=O,0.2724
CC(=NC1(CC1)C)OC,0.2526
CC12CC3C(N13)C2=O,0.2332
CCNc1c(onn1)C,0.1843
O=CN1C2CCOCC12,0.2567
CCN1N=CN=CC1=N,0.1479
c1cn(nn1)C2CC2,0.2543
C1C=C2CC=CC22NC12,0.218
CC12NC1C1=CCOC21,0.2231
C(CO)CO,0.3386
CCC12OC3C4C(C14)C23,0.3298
CN=C1C=CN(C)N=N1,0.1583
CC12CCCC1CC2=O,0.2145
CCOC(=O)C(C)CC,0.2809
O=C1NCC11NC1C#N,0.254
CC1CCC2CCC2C1,0.3515
CN1CCCC1C#N,0.26
O=C1OCC1OCC#C,0.2485
OC1CCC1O,0.3067
O=CC12OC3COC1C23,0.1924
N#CC#CC1OCC=C1,0.2184
CC1CC(=O)CC1C=O,0.212
CC1CC=CC2C(O)C12,0.2473
CCC12CC1(O)CC2O,0.317
Cc1c(coc1C=O)N,0.165
CC1COCC(CO)C1,0.3134
CC1CC2(C)CC12C#C,0.2653
OC12CC3OC(=O)C1C23,0.2658
CC12CC1C(=O)C2(C)C,0.2258
CC1C2CC3(C)CC3C12,0.3091
C1CC1C12CCC1OC2,0.3103
CCCCC1(CC1)O,0.3269
CC1OC(=O)C1C1CO1,0.2832
CC(=O)C1(CC=O)CO1,0.2072
c1c-2cn[nH]nc2cn1,0.1336
CC12C3OC3C3C1OC23,0.3024
OC1C2CCC1OCO2,0.3098
CC1CCN(C1)C(C)=O,0.2679
CC12OC1C1CCC21C,0.3217
CC(=NO)COCC#N,0.2434
CC1COCC2(O)CC12,0.3181
CC(O)CCC(C)O,0.3294
CC12NC1C1C3CN1C23,0.2986
CC1OCC11CC1CO,0.3017
OC1COC(=O)C1C=O,0.2241
c1cc(cnc1)CC=O,0.2129
CCC(O)C(CC)C=O,0.2163
CC(=O)OC1CN2CC12,0.2566
N#CC12OCC1C1OC21,0.2559
CC1(CC(=O)CO1)C#C,0.2192
Cc1cc(oc1C)C#N,0.1957
CC1=CC(=NO)C(=O)C1,0.163
c1nc2c(o1)COC=N2,0.1945
CC(O)C#CC#CC=O,0.1793
CCC(CCO)CCO,0.3393
O=C1C2CC2C2COC12,0.2009
O=C1COC1C1CO1,0.2252
CC1(NCC1O)C=O,0.1994
CN=c1occc(=O)o1,0.2006
CC(=N)OC1CCC=C1,0.262
OCC1(O)C2C3NC3C12,0.2734
CNC1(CC1CO)C#N,0.2624
OC1C(O)C2C3NC3C12,0.2829
OC1CC2(CN2)C1=O,0.2012
COC1(CC2OC12)C#N,0.2824
C1C=CC(=O)C=CCO1,0.1836
CC(=NO)CN=COC,0.2481
OCC(O)C#CC#N,0.2218
CC1CC(O)CC1C#C,0.2965
CC1CCC(=O)OCO1,0.2718
N=C1OCC2(CN2)C1=O,0.1783
CC1N=COC11CCC1,0.2679
CCC1CC2C1NC2=O,0.2723
C#CC12CC3(CO3)C1O2,0.2597
CC1C2CC2(C)N1C=O,0.2609
CC#Cc1ccoc1C,0.2093
OC1C(=O)N2CC12C#C,0.2171
CC12CC(C=C1)C2(C)C,0.2361
C(C1CO1)C1OCC=C1,0.2486
N#CC12CC1CN1CC21,0.261
CCC1CC(C)OC1C,0.3182
CCC(=O)N(C)C(=O)C,0.2183
CC12NC1(CC=C2)C#C,0.2348
CCCN1C=NOC1=N,0.2251
NC(=O)C(O)CN1CC1,0.2801
CCc1nc[nH]n1,0.2689
c1c(nc(o1)C=O)C#N,0.1886
CC1C(CC=C1C)C=O,0.2193
CC#CC(=O)C#CC#C,0.1675
CC1(CO1)C1C2COC12,0.313
OC12CC1(O)C1CCC21,0.3126
CC1CN2C=CC=C2N1,0.2273
CC(C#C)N1CC1C,0.277
COCCCCC(C)O,0.3216
COC12CC=CC1C2O,0.2289
FC1=NNC(=N)C=N1,0.1391
C1C2C3C4OC2CC4N13,0.3014
CC12C3N1C=NC2C3=O,0.1978
CC1C=CC2CC3C2C13,0.2556
C1C(=O)CN1C(=O)C#N,0.2154
CCC1OC1(CN)C#N,0.2645
C1C2OC1C1C=CCC21,0.2523
CC12CC3(COC13)CO2,0.2776
OCCN1CC1CO,0.2911
CC1C2CC3C(O)C3C12,0.2978
CCOc1c[nH]c(n1)O,0.2378
OC1C2C3CC1C(=O)C23,0.2268
COCC(CO)C1CO1,0.3284
C1CC1CC#CC2CC2,0.2819
O=CC1CN1C1CCC1,0.21
C1C2C1C1C3C4C2C4N13,0.2839
CC1C2OCC(C)OC12,0.3031
C#CC1(CCCCC1)O,0.2959
CC1=CC(CC1=O)C#C,0.1957
OCC(O)C1C2CCC12,0.3144
OCC12NC1C1NC21,0.266
CNc1cc(=O)nco1,0.1983
OC1(CC1CC=O)C=O,0.2051
CC1CC(=O)NC(=O)O1,0.2504
O=CCC1C2C=CCN12,0.1932
COCC#CC1COC1,0.2775
c1conc1NCC=O,0.191
CC1C2C3NC(=O)C3N12,0.2447
CCC(=O)CC(C)O,0.2288
Cc1c(c[nH]n1)OC,0.2375
CCc1nc(co1)C#C,0.2146
CNC(=O)CCCC=O,0.226
C1C(=O)CC12CN2C=O,0.2135
C1CC2OCC=CCC12,0.2618
CC1C2(C)NC2C11CO1,0.2975
c1c([nH]nc1C#N)C=O,0.1968
CCOCc1[nH]ccn1,0.2524
CCCCC(CO)C#C,0.3047
OCC1CC1(CO)C#N,0.3041
COC1C2C3CN3C12,0.2831
CC(C)OC(=O)C(C)O,0.2705
CC1CC2(CN2)C1CO,0.3152
CC(=O)C1CN1CC=O,0.2066
OCCC1COC1C#N,0.2778
OC1CC2=C(C1)N=NO2,0.2113
OC1C2COC1C1CC21,0.3326
C1C2C1C1(CC1)C21CC1,0.331
CC1C(CC#C)N1C,0.2707
CC1C2CC1(O)CC2C,0.3262
O=C1CC2CC(C2)O1,0.2704
C1OC1C1CC1N1CC1,0.3201
C1C=CNC(=O)C(=O)O1,0.1807
c1c([nH]c(n1)O)CCO,0.2465
CN(CC=O)C(=O)C#C,0.2101
CC1COC(=O)C(O)C1,0.263
c1c(n(nn1)C(=O)N)N,0.194
O=C(OCC1CN1)C#C,0.2123
CC(O)CCC1CC1C,0.3279
C#CC(=O)C(=O)N,0.1606
OC1CC11CCC1O,0.323
CC(O)CC(C)(O)C=O,0.224
c1cnn2c1COCC2,0.2552
CC(O)C1C=CC2CC12,0.2436
CCC12C3C4C3C1(C)N24,0.2803
c1cncc(cc1=O)N,0.1468
OC1C2NC1C2O,0.3135
C1C2C1C1CC21,0.2941
FC1=CC(=N)NC(=O)N1,0.2133
O=C1CCC2CC12C#C,0.223
CNC=Nc1cnno1,0.1812
CCC(=O)C#CC(C)C,0.2092
N=C1CCN=CN1C=O,0.2225
CCC(C)(O)C(O)C#C,0.2824
CC12C3OC1C(O)C23O,0.2786
CC12CC3CN1C2CO3,0.3049
CCc1conc1C#N,0.2232
CC(O)C(O)C(C)CO,0.3167
COCC1(C)CC1(C)C,0.3274
CC1C(OC=O)C1C#C,0.2568
O=C1NC2CC3(CC3)C12,0.2682
O1CC2(C1)C1C=CC2C1,0.2345
c1(n[nH]nn1)C(=N)N,0.2046
CC1=C(CCC1=O)C#C,0.1764
c1cc(oc1CC=O)N,0.1681
CC(C)C(C)NC(C)=O,0.2756
CC1OC2COC12CO,0.2961
O=C1NC2C3C=CC1C23,0.2221
CCC12CC1(C)C1NC21,0.3182
CN=C(CC#C)OC=O,0.2555
CC([NH2+]CC([O-])=O)C=O,0.2123
CC1CC2COC2C1C,0.3113
C1CC2(C1)CC3(C2)CC3,0.3426
C1C23COC12C1OC1C3,0.2769
COC1(C)C2CCC1O2,0.3216
O=C1CNCCN2CC12,0.1981
OC12C3CC1N1C3CC21,0.295
C#CCc1c[nH]c(=O)o1,0.2391
CC1(CC12CC(=O)C2)C,0.221
N=C1OC2C3NC1C23,0.2445
N=C1OCOC1C#N,0.2783
CCC1(CNC=O)CN1,0.2813
C1CC11CC=CC2NC12,0.2392
CC(=O)CCC#C,0.2312
OC1C2CC1C1(CC1)O2,0.2861
CCC1CCC(C)=C1,0.2577
N=C1NN=NN1,0.2045
C1CC11C2OC1C21CC1,0.3102
CC12C3C(O)C1=CCN23,0.1673
C1CC2C3OC22C1OC32,0.2177
N#CC1CN2CCC2=N1,0.2438
CC(O)C#CC#N,0.2394
COC(C#N)C1CCO1,0.2748
CC1C2OC3C(O)C1C23,0.3019
C1C2C3CC4C(C2O3)N14,0.2994
CC1CN1C1C2CCC12,0.3115
CC(O)(CC#C)C#C,0.2872
OC1(COC1C#N)C=O,0.2208
COC12CC(C=C1)C=C2,0.219
OCC1CN2C(C#C)C12,0.26
CC1OC1(CC=O)C#N,0.2294
C#CC#CC1C2CN1C2,0.2067
O=CC12OC1C1CC2O1,0.2083
CC1OCCC=C1C#N,0.224
CC1C2C(CN12)C#N,0.2727
C1OC2C=CCOCC12,0.2431
O1C2C3OC4C1C2OC34,0.2638
CCC1CC2OC2C1=O,0.2071
Cc1cnc(n1C)C#C,0.1978
CC12CC3C4N3C1C24C,0.2938
CC1=CC2C(O)C1C2=O,0.2448
OC1CCC=CC1C=O,0.2293
NC1=C(N)C(=N)C=NO1,0.149
CCC(C)C1CCC1C,0.3541
c1c(ncc(n1)N)CO,0.1824
C1COC(=N1)N2CC2,0.2696
C#CC1OCC(=C1)C#N,0.2135
C1C=C2CC=CC3C2N13,0.2155
CC(=O)NCC(=O)C=O,0.1463
CCC1NC1C(C)OC,0.3156
C1CC11C2CC3C(C2)N13,0.3362
CC12CC3C1COC23,0.3311
N#CC12OC3CNC1C23,0.228
CCC([NH3+])C1=N[N-]N=N1,0.2653
N=C1OCCC=C1C#C,0.1916
OC12COC(C1)CCC2,0.3105
CC(O)C#CC1CN1,0.26
Cc1nccn1CCO,0.2461
CC(O)C=O,0.2271
O=C1C2CC2N1C1CC1,0.2446
N#CC12OC1C1CC2N1,0.2472
O=CC1(NCC1=O)C#N,0.1934
CN1CC2CC2C1=O,0.2642
CC1(C)OC1(CO)C#C,0.2801
CC1=C(O)NC(=N)C=N1,0.1509
CC1=C[C-](OC1=[NH2+])C=O,0.1638
C#CCc1[nH]c(=O)on1,0.2548
O=C1CCC2CCCC12,0.219
CC(O)C1=CC=NC=C1,0.2293
CCC(O)C1(O)CCC1,0.3158
CC(=O)c1cn(nn1)C,0.2066
CC1CC1C1CN1C,0.3013
OC1(CC11COC1)C#N,0.2624
CC#CCNC1COC1,0.2719
CC1CCN=C(O1)C=O,0.1944
ON=C1CC23CC(O2)C13,0.2413
O=C1OCC2NC1C=C2,0.2109
CCC(CO)C1(C)CO1,0.3271
CC12C3CCC(C13)C2O,0.3164
C(C(CO)C#CC#N)O,0.2271
O=CC12CN3CC1C23,0.2034
CC(O)C1(C)CC(O)C1,0.3191
Cc1c(con1)N,0.2181
N#CCC1CCO1,0.2926
OCC12C(O)C1C1CC21,0.2709
CC(C)C1(CC1C)C#N,0.3148
O=CC1C2CC3CC1N23,0.1959
CC1=CC2COC1C2O,0.2356
O=C1N=NOC=C1C#C,0.1747
C1CC2(O1)C1COC21,0.2734
O=C1C2CC(C#C)C1O2,0.2332
COc1ccncn1,0.2288
CC(O)C(C)(C=O)C=O,0.1955
CC1C=CC2OC12C#N,0.2445
CC1=C(CC2OC12)C#N,0.2061
CN=C1OCOC1C#N,0.265
CCC12CC(CC1C)O2,0.3238
O=CC1C2C3OC1C23,0.2086
CC1(C#C)C(O)C1CO,0.2708
C#CC12NC3C1NC23,0.2511
CC(=NC)OC1COC1,0.2691
O=C1C=CCC2CC12,0.1906
N=C1NC(=CN=C1)C#C,0.1378
CC(C)Cn1cnnc1,0.2658
C1C2CNC3=C2N1C=C3,0.1857
c1coc(=O)c(n1)C#N,0.1552
c1c(c(c([nH]1)N)O)CO,0.2252
CCCCC1CC=CC1,0.2648
CC1(COC2CC2)CO1,0.3261
C1NC11CCCC11CO1,0.3047
C1CC11CCC2OCC12,0.3235
CCc1nc(co1)N,0.2135
CC(=O)OC(C)(C)C=O,0.2249
CC1C2C3C2N1C3C=O,0.2121
CC1(C)C2C(O)C2C1O,0.2932
OC1C(=O)NC11CCC1,0.2706
CN=C1C=COC(F)=N1,0.2055
C#CCc1cc([nH]c1)O,0.2373
CC1CC(=O)CC1C#N,0.2221
OCC1OCCC11CO1,0.3187
CC(=O)C1=CCOC1,0.188
CC(=O)C1NC1C1CO1,0.2209
OC1C=CC2C(C=O)C12,0.2128
OCC1(CN1)C#N,0.2926
N=COC1CCN=CO1,0.2705
COC(=O)C(C)C#CC,0.2549
N#CC12CCC3C1CC23,0.3218
CCOC1CC1CC#C,0.3077
CC1C2CC=CC(O)C12,0.2621
N=C1CC2NC2CO1,0.2832
C#CC1C2CCC1O2,0.2851
OC12CCC1(O)C2C#N,0.2683
CC12OCC3C4C1N4C23,0.3194
CC1(O)C2C3CN2C13C,0.3199
CC1CC2=CCC(O)C12,0.2495
ON=C1C2CC1C1NC21,0.2586
CC1(OCC1O)C1CC1,0.3048
OC1CC2OC2C=C1,0.245
C1CC1C12C3C4C3C1C24,0.2935
O=CNCC1CC(=O)N1,0.2693
CC1NCC(=O)CC1O,0.2159
OCC1CC1OCC#N,0.2673
CCC#CC1(C)CC1C,0.2805
CCn1c(cnn1)N,0.2352
OC1CC2C(C1)N2C=O,0.2542
CCOC(CC)COC,0.3277
CC1(COCC=O)CO1,0.2289
Cn1c(=O)nc(cn1)N,0.1844
CN1CC(=O)N(C)C1=N,0.2268
CC1CC2CC1(C)CO2,0.312
COC12CC(C1)C(C)C2,0.3284
N#CC1CC2OC2C=C1,0.2441
CC1=CCCOCC1,0.2486
CC12CC3N1C2C31CN1,0.3024
C1COCO1,0.3437
COC1OC2C3NC2C13,0.3172
CC1=CCC=CCC1,0.2529
OC1=NNN=C1C1CO1,0.2255
CC(=O)C1(C)CC1C=O,0.2055
CC1C2OC(=O)C12C,0.2741
N#CC1C2C1C1OCC21,0.2884
CC#CC(N)C(N)=O,0.2578
CCc1c(cc([nH]1)N)C,0.2273
CC1C2NC(=O)C12O,0.24
CC(O)C1=C(C)C=NN1,0.2491
N=C1ON=CC=N1,0.1594
C1CN(C1)CC(=O)CO,0.2078
CCc1c(ocn1)OC,0.2297
CN1CC1C1OCC=C1,0.2331
CC#CC(O)C=O,0.2133
CC(C)(C)OCCC#C,0.3079
OC1CCC2OC1C=C2,0.2475
OCC1(O)C2CC1(O)C2,0.2933
C1CC2CC=CC22NC12,0.2301
OC12CC3C4CC1N4C23,0.2765
N=C1OC2CCC2C1=O,0.1847
Cc1nc(on1)C(C)C,0.2624
OC1C2OC(=N)C12C#C,0.2461
CNC(=O)c1[nH]ccn1,0.2126
CCC1(C#N)C2CC1N2,0.2738
O=CCC12COCC1O2,0.2243
CC1CC23NC4C2N1C34,0.2763
C1Cc2c(n[nH]c2N)C1,0.2332
CCC#CC(O)C(C)C,0.2866
COC1(CCC1=O)C=O,0.179
CN1CC(=O)C1,0.2071
CC(O)C1=CCN2CC12,0.2302
CC1(C)C2C3COC1C23,0.3215
CC(C)C(=O)COC,0.2308
CC1(O)C(NC1=N)C#N,0.261
NC1=CC(=O)C2NC12,0.1927
CC1(Cc2n1ncc2)C,0.2687
C(C1CO1)C1C2COC12,0.3136
CCC1(CC(=O)O1)CC,0.2828
CN(CCC#N)CC=O,0.2089
Cc1c(nc(n1C)O)O,0.2326
CCC1OC1C1CC1C,0.3374
CC#CC#CC(C)(C)O,0.222
COC1(CNC1=O)C=O,0.1981
OC1C2N3CC2(C3)C1=O,0.1807
CC12CC3C1CCC3O2,0.3185
c1conc1OCCO,0.2513
c1coc(c1N)N,0.2168
OC1C2C3C4OCC13C24,0.3054
O=C1OCC11CCCO1,0.255
c1c(con1)COC=O,0.2494
CC(O)C1OC2C(O)C12,0.2909
CC12CC1(C=O)C(=O)N2,0.2127
CC1=CCN2CC12CO,0.2376
CN=CNC(=O)CC#C,0.2332
COC(CCO)C(N)=O,0.2649
CC1C2COC(C2)C1O,0.317
c1c(nc(oc1=O)F)F,0.2052
COC12CCC1N(C)C2,0.278
CC(C)C1(C)CNC1=O,0.2797
CC(O)CC(=O)NC=O,0.2162
O=C1CCNC(C1)C#C,0.2231
CC12COC1(C)C(=O)C2,0.2009
C1CC1C1OC2CC2O1,0.3351
OC1=NC=NNC1=N,0.1691
CC1=C2CC3OC(C1)C23,0.2082
CC1(C=O)C2C3CN3C12,0.2108
FC1=C(F)N=CC(=N)N1,0.1439
Cc1c[nH]c(=O)cc1F,0.1823
CCOC1CCOCC1,0.334
CN=c1[nH]c(no1)C=O,0.1382
OCCC1CC2CC2O1,0.3181
CCC1C=C2CC3C1C23,0.1793
O=C1C2C3CC2(C#C)C13,0.2467
OCC1CC2(O)CN1C2,0.2995
CC1NC11CNC1C#N,0.2611
OC12CC(C1)C(=O)OC2,0.2769
OC12C3C1N1C3CCC21,0.2812
CCCC(=O)C(=NC)N,0.1915
CCC1(CO1)C(C)=NO,0.255
CCOC1(CC(=O)C1)C,0.2211
OCC1(CNC=O)CO1,0.2826
c1coc2c1NCC=C2,0.1659
CCC1C2C3COC1C23,0.3191
C1CC1C(=O)C#CC#N,0.1842
CC1(C)C2CC(=O)C12C,0.2275
C1C2OC3CC12C=CC3,0.234
CC12C3C4N3C1C24C=O,0.1943
CCC12C3C4C1C4(C)C23,0.3011
CC12CCC1(O)COC2,0.3131
CC(=[NH2+])NCC([O-])=O,0.2533
CCC(O)C(=O)C1CN1,0.225
CC1(CC=O)CC2NC12,0.2166
N#CCC1CCC11CN1,0.2858
CC1=C(C)C2NC2(C)C1,0.2402
C1CC2OC3CC1C2C3,0.3139
CC1CCC2OC12,0.3457
CC(O)(CCC#N)C#N,0.3152
CC1(O)CC2C(O)C12O,0.289
CC12CC3(CC1C23)C#N,0.2856
OC12CCC1OCC2=O,0.2046
C(CC=O)COCC#N,0.23
CCCN=C(C=O)OC,0.1695
OCC12CC3CC1(O)C23,0.3005
N#CCC12CC1C=CC2,0.2495
COCC(=O)C#C,0.2083
OC12CC1(C#C)N1CC21,0.2519
CCc1ccc([nH]1)NC,0.2285
CC1(C)C2C3C2C(=O)N13,0.2469
C(CO)N=C(N)NC=O,0.2186
CCCc1coc(n1)C,0.2403
c1c(nc([nH]1)CCO)N,0.219
CC1OC2C3OC2C3O1,0.3061
OC1CC11CC2CC2C1,0.3334
c1c([nH]cn1)OCC=O,0.1726
CC1OC2CCC1C2=O,0.2078
CC(=O)NC1(CC1)CO,0.269
CC1(O)C(=O)C2CC12O,0.2298
CCOC(CC)C#N,0.3036
CC1=NC(=N)C(C)=NO1,0.2045
OCC1C(=O)CC11CC1,0.2175
O=C1OC2CC3CC3C12,0.2754
CC1C2C1C(=NO)C2O,0.2393
OC1C2C1C1(O)CCC21,0.2908
CC1OC2C=CC(C)C12,0.2475
CC1C(C)C1C(=O)C#N,0.2038
c1c(ncnc1F)C=O,0.1757
NC1=C(N)C(=N)OC=N1,0.1565
NC(=O)C1C2NC2C1=O,0.2087
C#CCn1ncc(n1)O,0.2296
CCC1CN1C(=O)OC,0.2869
O=C1OC2CC(C2)O1,0.3201
O1C=CN=CC=CN=C1,0.1823
OC1C2CCCC1C2O,0.3106
CC1C2OC(C)CC12O,0.3122
CCC12CCC1CC2C,0.3289
CC1C2CC2(C)C1(C)O,0.3074
CC1C2C3CC1(CO)N23,0.2946
COCC1(CC1)CC=O,0.2238
NC(=O)C(O)(CO)C#C,0.2617
CC12CC(N1)(C#N)C2O,0.2767
COCc1nc[nH]n1,0.2577
OCC1=CC2NC2CC1,0.2393
CC1C2CC3C(CN13)O2,0.3008
CCCC1CN1CC#N,0.2754
COC1(CC1C#N)C#C,0.2686
CC#CC(O)CC(C)=O,0.2261
Cc1cncc(c1O)C,0.2374
C1OC11C2NC1C1OC21,0.3034
CC(O)C1OCOC1=O,0.2616
CC1C2(O)CC=CC12O,0.2407
Cc1c(cno1)C2CC2,0.2271
OC12CN3CC1OC2C3,0.2716
OC1C2CC11C=CCN21,0.2172
OC1CNC2=C1OC=N2,0.1983
CC1C=C2CC3C1C23O,0.1738
CCCC1C2C3CC1C23,0.3284
CC12CCCC(=O)C1O2,0.2168
CC1(O)C2OC2C1=NO,0.2424
CC1C2OC2C1C1CC1,0.3358
CCN=C1CCCO1,0.2724
OC1C(=N)OCC11CN1,0.2693
OC1C2CC3(O)C2CC13,0.3159
NC(CC1CC1O)C#N,0.2983
CC1OCC(O)C(=O)O1,0.2768
CC(C(N)=O)C(=O)CO,0.2331
NC1=NOC(=C1)C1CO1,0.2196
CCn1cc(nc1)C=O,0.2042
C1C(COCO1)OC=O,0.2708
CC12COC(CO)C1N2,0.3331
CC1(CC1)C(=O)COC,0.2326
CC(CCC(N)=O)C#N,0.2762
CNc1c(cn[nH]1)C=O,0.1931
CNC(=O)N1CCC1=N,0.2431
C1CN1C1C2OCOC12,0.2925
C#CCc1ncco1,0.244
Cc1cc(oc1)C#C,0.1954
COC(C=O)C1CN1C,0.1948
CC1(C#N)C2CC1(O)C2,0.3105
CC1CCCC11COC1,0.3032
OC12CCC=C1C1OC21,0.231
C#CC1CN2C(C#N)C12,0.2682
CC1=C(CCOC1=O)N,0.2026
CC12CC3CC1C2O3,0.3246
OC12CNC1C2C#N,0.2709
NC1C2CCNC12C#N,0.2454
CC1C(C)(C)C11CCC1,0.3242
CN1CCCCC1=O,0.2654
C1CC23C4C2C2C4C32O1,0.2789
OC12CC3(COC13)C=C2,0.2278
OC1C2(O)C3OC2C13O,0.2859
c1c[nH]nc1OCC#N,0.2499
CC1(O)C2N3CC3C12O,0.2611
CCCC(=NO)CC#N,0.2595
C1C=C(NC(=O)O1)C#N,0.1924
CC12CC1(O)C(=O)C2,0.2261
COC1CCC(=O)OC1,0.2704
CC1(C#C)C2CC1C=C2,0.2379
CCOC(=N)CC(N)=O,0.2671
CC1C2OC(C2O)C1O,0.3033
N#CC1CN2C3CC2C13,0.2849
N#CC1C2CNCC1O2,0.2448
CC1CC(C)(O)C1=NO,0.2472
Cc1nc(nc(n1)N)N,0.2295
CC1CC2(C)CC(=O)N12,0.2342
CCC(N)(CCO)C#N,0.2871
C[NH2+]C(C#C)C([O-])=O,0.2658
CC12C3CC1C(C=O)C23,0.2227
N#CC1CC2CCC=C12,0.2433
CC1=CC2OC=NC2C1,0.2544
OC1CC11CCC1,0.328
C1CC1(CO)NC=O,0.2727
CC1=CCCC1NC=O,0.2524
OCC1C2(O)CC1(O)C2,0.3116
C1C=C(COCO1)C=O,0.1917
CC1C2CCC2OC1=N,0.2841
N=C1COCC(=N)N1,0.2391
C1CC2C3CCC2C1O3,0.3139
OC12CC(C1)C2N1CC1,0.3094
CN=C1N=CNN=C1N,0.1852
CC1=C(C=O)C(O)CC1,0.1882
CCOc1c(non1)C,0.2329
C#Cc1cnno1,0.2007
O=C1C2C3CC4C3C1N24,0.2199
Cc1coc(c1N)C=O,0.1768
CC1C(O)C1C(=O)CO,0.2153
OCC1C2C3CC(C3)N12,0.2889
O=CC1C=CC2CCC12,0.2156
[NH3+]C(C#C)C(O)C([O-])=O,0.2615
CC(C)(CO)NC(=O)N,0.2991
COC1CC(=N)OC1C,0.2852
C1CC1C#CC#N,0.2282
Cc1cc([nH]n1)C2CC2,0.2468
COC1C2OC1(C)C2O,0.2958
CC(=O)Nc1nnon1,0.2074
CC1=C(F)C(=N)NC=C1,0.1698
CC12CC(C1)C(O)C2O,0.3186
O=CC12CCC(O1)C2=O,0.212
CC(C)OC12CC1OC2,0.3022
c1c([nH]cn1)C(=O)C#N,0.1714
CC12CC(OC1)C2C#N,0.2777
O=C1NC2C3CN3CC12,0.2533
OCC1C=CCNC1=O,0.2528
C1C(CO1)CC#CCO,0.2742
CC1=NC2(COC2)CO1,0.2662
CC1CC11N=CNC1=O,0.222
OC1=C(NC=C1)C1CO1,0.2193
ON=C1C2OC2C1C#C,0.2404
OCC(=O)C(O)C#N,0.2268
CC(=N)N(CC=O)C=O,0.2113
CC12OC1C1NC(=O)C21,0.263
C#CC1C2C3C4C3N1C24,0.257
CC1=CC(=CC=CC1)C,0.1827
OC1C(CC11CN1)C=O,0.218
c1ccncocnc1,0.1919
CC(C)NC(=O)C1CC1,0.2772
C1C=CC2C3NC3C=C12,0.2391
CC1CCC11OCC1O,0.2962
N=C1C=NOC=NC1=N,0.1905
CC1=CC(=O)CC1C=O,0.1856
CCC#CC(=O)N,0.2344
c1c2c(no1)ocn2,0.2083
C1CC1C1C=CC2NC12,0.2431
CCCOc1cnc[nH]1,0.2445
O=C1CN2C3CC12C=C3,0.194
Cc1c[nH]cn1,0.2533
Cc1cc(cnc1F)N,0.1896
Cc1ncc(c(n1)O)N,0.1937
CCC1C2OC1C2(C)C,0.3245
CC1=CCC2(C)CC1O2,0.2435
CC1(O)CCCOCC1,0.305
CC(CO)(CC=O)C#C,0.2221
N=C1OC2CC(O1)C=C2,0.2162
CN1CCN(C(=O)C1)C,0.2553
C1C2C3OCCC3CN12,0.2925
CC(C)C(O)C(F)(F)F,0.3501
CC(=O)Cc1c[nH]nc1,0.2195
CC12OC3CC1CCC23,0.3145
C1CC1OC(=O)C=O,0.1808
CC1(C)OC1C1CC1O,0.3232
O=C1NC2CC1CC=C2,0.2336
C#CC1C2CC=CC1O2,0.2394
OC1COC1=N,0.284
O=C1OC2CC3C2NC13,0.237
OC1(C2CO2)C2CCC12,0.3117
CN1C2C1C1CC2O1,0.2978
CCOC=NCCC#C,0.2657
c1ccoc(=O)c(=O)c1,0.1584
OCC12CC1C1NC1C2,0.308
CC1OCC2(C)OCC12,0.324
COC1(CO)OCC=C1,0.2494
C1C=Cc2c1[nH]c(n2)O,0.1836
CC12CC3(CC3O)C1O2,0.314
OC12COC(C1)OC2=O,0.2763
C1COc2c1noc2N,0.2019
CCOC(=N)C(O)C#N,0.2796
CC(O)CC1CCCO1,0.3176
CC1CC2CC(C)CC12,0.3512
CC(O)C1CC(O1)C#N,0.2747
c1c2c(on1)NCCC2,0.2167
CCC12CC(C1)C(C)C2,0.3672
O=C1CCC(CC#N)O1,0.2781
N#CC1=CC2OC1C=C2,0.1794
O=C1OC2CC2(O1)C#C,0.271
CN1C=NC(=N)N=C1O,0.197
CC1(CCOC=N)CO1,0.2838
C1CCC(CC1)CC=O,0.2279
CC1C=CC2=NC=CN12,0.1799
CC1(COC1)C(F)(F)F,0.3269
CC1CC(C)(C)C(=O)O1,0.2777
O=CCC1OC1C=O,0.1975
OCC1=CCC2(CO2)C1,0.2624
Cc1nc([nH]n1)CC#N,0.264
N=C1OC2CC2(O1)C#N,0.2584
CCCCC1CC1C#N,0.3158
C(C1CO1)N1CC1,0.3289
CC1OC2C3CCC1C23,0.3091
C1C2OC=NC3COC123,0.2506
CC1CN=C(N)C(=O)O1,0.1984
c1nc(nn1C(=O)N)O,0.2214
CCC(CCC#C)C#C,0.3002
N#CC12C=CC3C1OC23,0.2244
OC12COCC11CC2O1,0.3003
CC1CC2CC2(C)C=C1,0.2502
C#Cc1c(con1)CO,0.225
CC(=O)c1coc(n1)N,0.1839
CC1OC(C)C(O)C1C,0.2991
c1ccc(cc1)OC=O,0.2338
O=CC12CC3C1C(=O)C23,0.2142
CC1(C=O)C2NC2C1=O,0.1957
c1c(cc(nc1N)O)F,0.2137
CC1CNC(=O)C2CN12,0.2437
CN1N=NC(N)=CC1=N,0.158
OC(C1CC[NH2+]1)C([O-])=O,0.2584
CC#CC(C)C(=O)CO,0.2228
OC1CC1(O)C#CC#N,0.2084
N#CC12CC(C1)CC=C2,0.2489
CCNCc1ncno1,0.2103
O=C1NC=NC2CNC12,0.2082
CC(=O)C#CCCC=O,0.2046
OC1C2CC1C1OCC21,0.3193
CC(O)C(N)C#N,0.2983
CC1(CN1)C12CC(C1)O2,0.3089
C1C2COC3CC2OC13,0.3254
CC1CN2C=C(C)N=C12,0.2503
CCCC(C)([NH3+])C([O-])=O,0.2703
Cc1c(c(=O)cc[nH]1)N,0.1814
C1CC(C1)(C(F)(F)F)O,0.3527
CC(=NO)C1COC=N1,0.2525
CCOC(=N)C1CCC1,0.2911
OCCC1CCC1C#C,0.3015
CC1(CCOC1=N)C#N,0.273
c1coc(nc1=O)O,0.2111
CCN1C(=O)CC12CC2,0.265
N=C1C=NC=NC=N1,0.1672
COC(C)C1OCCO1,0.3204
C#CC(=O)C1(CC1)C#C,0.191
CC1CC1CC(O)C#N,0.2923
CN1CC2(CO2)C1C#N,0.2515
COC1C2CC2OC1=N,0.26
CN1CC(C1)OCC#N,0.2287
COCC1OC1C(C)=O,0.2226
NC1CN(C=O)C1=O,0.2009
OC12CC1C=CC21CC1,0.2338
CCOc1c(nno1)N,0.2118
NC(C#N)C1=CC=NN1,0.2434
C1CC=CNC(=O)C1,0.216
CC(O)C#N,0.3166
CNC(=O)C1CC1(C)C,0.2738
COC1=NC2C(O)C2N1,0.2558
N=C1NC2C(OC12)C#N,0.2403
COCC(OC=O)C=O,0.2237
OC1=NNC(=C1)C1CO1,0.2322
OCC1CCCCO1,0.3378
COC1(C#N)C(N)C1O,0.2516
CC1CC1C1NC1C#N,0.2829
OCC1OC2CC1CO2,0.338
C(c1c([nH]nc1O)O)O,0.2523
CC1=C2CCN2C(=O)O1,0.2269
C1C2CC3OC2C1C=C3,0.2507
CC(CC#C)(C#N)C#N,0.2768
CC1C(C#C)C1C#N,0.2735
OC1CC2CC2C1C=O,0.2228
CC12OC3C4OC4C1C23,0.2787
CC1(O)CC1CCC#C,0.3067
CCC1(CC(=N)O1)C#N,0.2804
c1cc(=O)[nH]nc1C=O,0.1634
N=C1OCOC1=N,0.2383
C1CC1N=COC(=O)N,0.2503
CC1NC=C(C=O)C1O,0.1765
CN(C)C1C=CNC1=O,0.1967
CCC1=C(CNC1=O)N,0.2147
CC1C2N1C1CC21C=O,0.2018
O=CC1OC1C=O,0.1942
CCNc1c(c[nH]n1)C,0.2285
CC1CCCC1C(N)=O,0.2745
CC(=O)NC1COC1=N,0.2669
O=C1C2CN3CC2C13,0.2192
c1coc2c1[nH]c(=O)[nH]2,0.2021
C#CCC(=O)C#CC=O,0.1881
OC12CC3(C1)C=CCC23,0.2452
NC(C#C)C1=NC=NN1,0.2569
CN=C(N)C1(CO1)C#C,0.2427
C1CC2CC3OC3CC12,0.3395
CC12CCC3C(O)C1N23,0.2958
N#CCC12CC(CC1)O2,0.2899
CN1C2(C)C3NC3C12C,0.2691
CN(C)C12COC1C2O,0.2678
CCc1cnccc1F,0.2402
Cc1c(c[nH]n1)COC,0.2608
OCC1=CCN2CC1C2,0.2333
CC1(C)C2N3CC2(O)C13,0.3111
CC(O)C1=CC(N)=CN1,0.2161
CC1(CO)C(O)C1O,0.2873
CC(=O)C12CC1(O)CN2,0.1951
COC(CO)C1CC1C,0.3265
CCC(CC#N)C(C)C,0.3358
CC1N=COC1C(N)=O,0.2545
Cc1cnc(o1)CN,0.2309
OC1CC2(CC=O)NC12,0.2111
CN1C(C=CC1=O)C#C,0.21
Cc1cc(nc(c1)F)N,0.2041
C1OC11C2CCC1O2,0.3345
CC1C2C3CN3C12,0.2847
CC1(C#C)C2OC1C2=O,0.2441
CC1(C)C(CO)N1C=O,0.2526
OC12CC1OC2,0.3024
Cc1ccnc(=O)nc1,0.1637
CCC(=O)OC(C)(C)C,0.28
CC(O)CC1CC(=O)O1,0.2858
CC(C)C1(CO)CCO1,0.3243
OC1CC2NC2C2OC12,0.31
CC(O)CCC(O)C=O,0.2346
CCC1CCC11CC1,0.3496
NC12C3N=C4CC1N4C23,0.1815
OCC12CCC(=O)C1O2,0.2126
OCC(NCC=O)C=O,0.2094
CC1(O)CC1C#C,0.2898
CNC(C#N)C1CN1,0.2731
CNc1cnc([nH]1)C#N,0.1839
CCCCC(C)(C)C#C,0.3187
O=CC1=CCN2CC2C1,0.1789
CC1CC(O1)C(F)(F)F,0.3371
OC(C#C)C1CC2NC12,0.2638
OC12CC1CC1NC1C2,0.3097
Cc1c(nc(o1)N)CO,0.226
c1c2c(cno2)[nH]c1O,0.2007
OC1C2CC1COC2,0.3275
CC1C2CC1(C)CCC2,0.3466
CC(C)C#CC(=O)C=O,0.1551
OC12CC(C1)(OC2)C#C,0.2672
CC1C2CCC(=O)C12O,0.2152
CC1OC2CN3CC1C23,0.2832
CCCC(C=O)N1CC1,0.2211
CC12OCCC3OC1C23,0.2867
CC1=C(F)N=NNC1=O,0.1821
C1C(CN1)(C#N)OC=O,0.2394
CC1(N=COC1=O)C#N,0.2411
CCCC(C)OC(N)=O,0.3233
Cn1cc2c(c1)COC2,0.239
OC1CCC1(C=O)C#C,0.2064
ON=C1CCOC1C=O,0.2066
CCC(CC#C)C1CC1,0.3124
COc1cc(cnc1)O,0.207
CC1OC2CCC2(C)O1,0.3252
N=C1OC2CC2C1=O,0.1881
CC1OC2CC1OC2=N,0.2708
CC12OC1COC2CO,0.3332
C1NC11CN2N=CC=C12,0.2542
CN=CNC(C=O)C#N,0.2046
NC1(C#N)C2OC1C=C2,0.2311
C#CCC(=NO)CC#C,0.2519
O=CCC1CCCC=C1,0.2236
CC1=C([O-])ON=C1C[NH3+],0.2073
CC12CC3CC1C23C#C,0.2572
CC1(C)CC2CC1C2,0.3734
C1C(=CNC(=O)O1)C=O,0.1868
COc1cnc2n1CC2,0.2401
CC1C2C3(CC3)CC12O,0.317
NC12C3CC3C1OC2=N,0.2541
OC(C=O)C(O)C1CC1,0.2265
CC1OC1C1=CN=NN1,0.2432
CC(C)(C)CCO,0.334
CCC1OC2C1NC2=N,0.2524
CN=C1OC2CCC2=C1,0.1989
CC1(O)CCC1C1CO1,0.3308
CN(C)C1=COC(=N)O1,0.2365
OC1CC11N=CN2CC12,0.2177
CCC12CC3=CCC1C23,0.1768
CC1C(O)CCOC1=N,0.2773
Cc1c([nH]nc1O)C#N,0.2013
OC1C2CCCC12C#N,0.3019
CC1=CC(O)CC11CO1,0.2448
O=COC1C2COC12,0.2661
CN1C2C=CC1C1OC21,0.2047
CCC(OC)C1COC1,0.3148
O=CCN1CC1C#N,0.2261
C1N2CC3=CCCCC123,0.2365
OC12CC(O)(C1)CC2,0.3265
CC#CC(C=O)(C=O)O,0.1991
NC=N[C-](C#N)C(N)=[NH2+],0.1808
OC1(COC1C#C)C#C,0.2623
CC12OC(=N)C1C2C=O,0.2163
Cc1cc(ccc1N)O,0.1906
O=C(NCC1CN1)C#C,0.2272
CC1(O)C2OC(=O)C12,0.2688
CC#CC1CN1C(C)C,0.2611
CC1(CCO)CN1C=O,0.2526
CCC(=O)c1cn[nH]n1,0.2038
C(C#N)n1nnnn1,0.2663
COCCCCCCO,0.3306
C1C2C3C1C21C=CCN31,0.2119
CC12C3C(CCN13)C2O,0.3048
CCC(O)(C=O)C(C)O,0.2242
N#CCC1OC2CC12,0.2876
COC(C)C(C)OC,0.3385
CC1C2C(CC12O)C#C,0.2978
O=CN1C=NC2CC1C2,0.2183
CCCN1N=NNC1=N,0.2012
NC(=O)C12CC1CC2O,0.2657
CNc1c(non1)OC,0.2107
CC1(C(=NC)OCO1)C,0.2787
COC(CC=O)C#CC,0.2211
C1C(=O)CC1(C=O)O,0.2056
COCC1(C)OCC1O,0.3022
OC12C3CC(OC1=N)C23,0.2604
CC(O)C1OC(C)C1O,0.299
OC1C(O)C(=O)CC1=O,0.1927
CNc1cc(n[nH]1)O,0.2388
C1CC1C1C2CC1C2,0.3636
C1C2NC2C2=C1N=CN2,0.2329
CCC(CO)OC=NC,0.2714
CC1=C(CCCC1=O)N,0.192
CCC12CC(O)(C1)C=C2,0.2381
C1CC11OC2C3NC3C12,0.2861
OC(CCC#C)C=O,0.2198
CCC(O)C1=CCOC1,0.2403
c1(c(c(oc1N)N)O)O,0.2123
CC(O)C(N)(C#C)C#N,0.2697
CC(O)C1COC2CC12,0.2976
CCC1C2C=CC1C2O,0.2395
CC(O)CC1=NC=CN1,0.2478
c1cc-2ncnc2oc1,0.1669
CCC12CCCCC1O2,0.3361
C1C2NC2C11CCCC1,0.3086
Cc1[nH]nc(n1)N2CC2,0.2347
CCC(OC)C(C)C,0.3216
CC12CC(O1)C1(CO1)C2,0.3218
CC12NC1C1C(C#C)C21,0.2489
OCC1CC(C=C1)C#N,0.2627
CCC1OC1CC#CC,0.3018
CCC(C)C1(CO)CC1,0.327
CN=COC(CO)C#N,0.2707
CC12OC(C3OC13)C2O,0.2955
O=CC12CC3OC1C23,0.2158
CC1OC2C3CN3CC12,0.2967
CC1CC2CC(O1)C=C2,0.2464
CCC(O)C(O)CCO,0.3174
OC1CCCC2OCC12,0.3035
N#CC12CCC(CC1)N2,0.2786
OCC1CC2CC(C2)C1,0.3398
c1cc2ccoc2nc1,0.1971
C#CC1CCCC2OC12,0.31
CCCC1OCC2OC12,0.3425
c1c(ncnc1O)CO,0.2349
CC1C2C3C=CC1(C)N23,0.2153
O=CC12CC1C(=O)CC2,0.2083
CCC1OC2CC12C,0.311
Cc1ccc(c(n1)C)O,0.2045
OCC1C(CO)C1C#C,0.2882
N#CCCC1OC1C#N,0.2971
Cc1ccc(=O)on1,0.1821
c1[nH]c(c(n1)N)NC=O,0.1983
CC1=CC2(COC2)OC1,0.2453
OCC12C3OC1C(=O)C23,0.2234
C#CCC1=NCCO1,0.2659
CCOC(=N)CCC=O,0.2302
CC1C2CC2OC1=O,0.2766
C1OC2C3CC12C=CC3,0.2407
O=CC1C2C3CC1C23,0.2181
CC1C2C=CC1C21CC1,0.2344
COC1(C)CCC(C)=C1,0.2564
O=CC12CC3OC1CC23,0.2138
CC12CC3(O)C(C1)OC23,0.3083
N=C1NC(=O)C2CC1C2,0.244
CC1C2C3OC(=N)C1C23,0.2689
C1NC1C#CC1CCC1,0.2725
CC1C2NC(=O)COC12,0.2543
CC12CCC(OC1)C=C2,0.2485
CC1=C(COCOC1)C,0.2431
ON=C1C(O)C2CCC12,0.2383
CC1OCOCC=C1C,0.2575
C1C2CCC3OCC1C23,0.3086
CCC12CC1(CC)CC2,0.3208
CC1(O)C2C3OC3C12C,0.2798
CC12CC1CC1OC1C2,0.3274
CC12CC(C1)OC(=O)C2,0.2714
CCOC1CC=CC1O,0.2632
CC1(NCC1=O)C1CO1,0.2175
CC(C)(CN1CC1)OC,0.3162
NC1=NOC=C1OC=N,0.2172
CC1=CCC=CCC1=O,0.1844
C#CCCC1(CC1)O,0.3
CC12CC(O)C1N2,0.3151
Cc1c(cc[nH]1)C=O,0.1963
N=C1OC=CN1C1CC1,0.2125
c1c(nc(o1)N=CN)N,0.1638
CC(=O)NCC(F)(F)F,0.2785
OC1CC2(CC3NC23)C1,0.3063
NC=[NH+]C1CC1C([O-])=O,0.2336
CC1C2NC2C2C(O)C12,0.2781
CC1(O)COC=NC1,0.2727
CC1(CC1)OCCC#C,0.3046
CCC1(CNC1=O)OC,0.2587
O=CC1NC2COC12,0.2102
CCOc1ccccc1,0.2187
CC1C2C3CC4C3C1C24,0.3473
OC1C2C1C1CCC2O1,0.3178
CC1CC(CC1=O)C=O,0.215
N=COC12CC(C1)C=C2,0.2374
C1OC11CN2CCN=C12,0.2268
CCC12CC3C1C3(O)C2,0.3202
CC1CC=CC(=O)O1,0.2167
CCCCC(O)C1CO1,0.3482
C1OCC2OC2C2NC12,0.3092
CC1OCC2CC2C1O,0.3138
CCC1NC1(C)C(N)=O,0.2654
CC1C2CC1C1CC21,0.3488
CCn1c(=O)[nH]c(n1)O,0.253
O=C1COC2C3CC12N3,0.2031
CC12CN(C1)C2C1CN1,0.3027
CC1=COC(C[NH3+])=C1[O-],0.1653
CN=C1C=C(F)ON=N1,0.2168
CC1CC2CC3C1C23C,0.324
OC1CC2C3C(CN23)C1,0.2974
CC1NC2C1COC2=O,0.2439
CC#CCNC(=O)C,0.27
N#CC1OC1C1COC1,0.2517
C#CC1NC11C2CC1C2,0.2742
OC12C3OC1C3C21CC1,0.3067
CCOC(CC#N)C#C,0.2913
CC(=O)NC(=O)CN,0.2175
NC1=C(O)C(=N)C=CO1,0.1678
CC1C2CC1C(C2)C#C,0.3063
CCc1c(ncn1C)O,0.2218
O=CC(CC#C)C#C,0.2182
CC1(CN1)C(CO)C#C,0.2904
O=C1C2CC1CCCC2,0.2169
CC1=NOC=CC1=N,0.1915
CC1N(C)CCCC1=O,0.2041
C1CC(O1)C1CCCO1,0.3154
CC1=C(F)C(=N)NN=C1,0.1672
CCC(CO)CC1CC1,0.3362
C#CCC1OCC11CN1,0.2854
OC1CCOCCC1O,0.3069
CN1CC1(CC#N)C#N,0.2698
CC1CCCC(=O)O1,0.2711
CC(O)C(=O)C1(C)CC1,0.2302
O=C1OCC11CNC=N1,0.2357
NC(=O)OC1C(O)C1O,0.2876
OCC1CN=C(O1)C#N,0.2141
CC(O)C(C)(C)CCO,0.3262
C1OC2C3C4CC(C34)C12,0.3215
CC(C#C)C1CCC=C1,0.2631
CC(N)(CO)C(F)(F)F,0.3299
CC1C=CC2COC1O2,0.2532
N1C2C1C1C3C4C(C23)N14,0.2927
N=C1OCC2C3CC12N3,0.2601
CC(C)CCC(=NO)C,0.2558
CC1NC11CC(=O)C1O,0.2049
CC1C(O)C2(O)CC12C,0.3116
CCN1C(C#C)C1(C)C,0.2555
CC12CC(=O)C1(N2)C#C,0.2193
OCC1CC2C(O)C12,0.3212
CC(C)C1C2CC2C1O,0.3074
CC1CC23NC12CC=C3,0.2131
OC12COC1CC2C#C,0.2811
N=C1OC(C#N)C1C=O,0.2255
C1CC(C1)CC=O,0.2274
COCC12CC1OC2=N,0.2691
CC12CNC1(C#N)C2O,0.2447
CC12OC1CC(O)C2=O,0.2097
CC(C)C1(O)CCC1O,0.3222
NC1=C[N-]C(=N)[NH+]=C1N,0.1636
OC1C2C3CC3C12O,0.2791
CC12COC(C=C1)C=C2,0.2214
CCC(C)N1C=CN=C1,0.2545
CC1C=CCC(O)C=C1,0.2566
CCC1(OC1C=O)C=O,0.198
N=C1CN=C2CCN12,0.2228
O=CN1C2CC2C1C#N,0.2546
COCC1(O)C2CC1C2,0.3242
CC1COC11C(O)C1O,0.2528
OC1COC1C1CN1,0.3173
CCn1cnc(n1)NC,0.2201
CCCCC(C)(O)CC,0.3231
CC(C)(CN1CC1)C=O,0.2169
C(C1CO1)C1=CNN=C1,0.2598
CNC1=NON=NC1=N,0.1579
c1coc2c1CNC2=O,0.2122
CC(=O)C(CC#C)C#N,0.2252
COC1(C)COC(C)C1,0.3148
COC(CO)COC=O,0.2636
CC1CCOC1C1CC1,0.3194
OCC12CCC(CC1)C2,0.3367
O=C1C=CC=CC2CN12,0.1752
CCCC12CC1OCC2,0.3085
CC1(O)CCC11CO1,0.3203
c1c(=O)cnon1,0.1674
CCC(CC=O)C(C)O,0.2292
CC1OC(=O)C1C(N)=O,0.2557
CC1C2(C)CC2C1(C)O,0.3104
OCC1(O)CC1(O)C#N,0.2738
CC1(O)C2C3CC2C13O,0.319
O=CCC1OC1C1CC1,0.224
C#CCOc1ccc[nH]1,0.2094
OC12COCC1C2C#C,0.285
CC12C3C1C1(O)CN3C21,0.2824
COC1COC2CC1C2,0.3219
CC1(C)CC2C(CO)N12,0.2962
C1C2CC3C4OC(C24)C13,0.3172
CC1OCC2OCC2O1,0.3296
c1[nH]c2c(n1)nc([nH]2)O,0.2203
CC12CC3(C)OC1C2O3,0.3207
CN(C)C1CN(C)C1=O,0.2357
c1nc(on1)CN2CC2,0.2239
OCC1=CC(O)C2NC12,0.2398
NC1=COC(=N)C=C1N,0.1643
CCOC(C)C1OC1C,0.3299
CC(C)(CC#CCO)O,0.276
CC12CCOC1(C)CO2,0.3256
OCC1CC(O)C(=O)C1,0.2239
N=C1NC2=C(O1)C=CC2,0.1601
CCc1cncn1C=O,0.1875
CC(O)C#CC1(C)CC1,0.2747
CC1C2OC(C#N)C12,0.2588
CC#CC(C#C)(C#C)O,0.2536
CC1CC2(C)CC(O)C12,0.3145
CC(C)C(C)(O)CC#N,0.3098
CCC1(CN1)C(=O)NC,0.2677
O=COCC1CCOC1,0.2698
CC1=CCC2CC(=O)N12,0.215
CCC1CC2CC2C1=O,0.2202
C#Cc1c[nH]c(n1)O,0.211
C1C2C3OC1COC23,0.2994
CC#CCCOC=N,0.2736
C#CCC12CN(C1)C2,0.2766
O=C1CCC11CO1,0.2054
CNC(=[NH2+])NCC([O-])=O,0.2602
Cc1c(n[nH]c1N)C=O,0.1827
CNc1c(n[nH]n1)CO,0.2081
CCCC(CC#C)C=O,0.2255
CC1(CN1)C1CCC1=O,0.2193
O=CCC1NCC1=O,0.2075
CC12CC(C1)(CC2)C#N,0.3298
COCC1(NC1C)C#C,0.2772
CC1C2=CCC3C2C13O,0.1773
CCC12CCCC1(C)O2,0.331
CNc1cc(no1)OC,0.2363
OCC(O)COC1CC1,0.3132
CC12CNC(=O)C1O2,0.2504
c1coc(n1)CN2CC2,0.2399
CC(C)(O)C1NCC1=O,0.2173
Cn1nc(nn1)C(=N)N,0.207
OC1C2C=CC3(CO3)C12,0.2261
CN=C1OCC(C)C1O,0.2775
O=CC1CC2=CN=CN12,0.1766
OC1C2C3OC(C23)C1=O,0.2029
Cc1c(n(nn1)C)N,0.2305
CCCC(CO)CC#C,0.2927
OCC12CC3C1COC23,0.324
CC1(O)C2N3CC3C12C,0.2817
N=COC1=CNN=C1,0.2421
CC1CC1(CO)C(N)=O,0.273
CC1(NC11CCC1)C#N,0.2758
C1N2CCN=C3OCC123,0.2479
CC1(C)CC(O1)C#N,0.2807
CC(C)(CO)C1COC1,0.3074
C#Cc1cncnc1O,0.1942
CC(=O)CC1C(O)C1O,0.2315
C1C(CO1)C2COC2,0.3133
c1coc(=O)c(c1N)O,0.1679
CC(O)C(=O)CC=O,0.2083
CC1OC23CC4C2NC134,0.2582
CCC(C1CO1)C1CO1,0.339
CCCC1CC1C,0.3538
OC12CN3C1C2C31CC1,0.2851
OC12CN=C3OC1C23,0.1702
CN=COc1cnno1,0.2307
CCOc1[nH]nc(n1)N,0.2475
OC1C(=N)OC11CC1,0.2712
CCCC#CCC#N,0.2885
CC1=NC2CC(O1)C2=O,0.1959
OCC1CCCC(=O)O1,0.2707
CCN(C)C(=O)CC#N,0.2661
OC1C2C3C1C2C31CC1,0.3183
C1C=CC=CC(=C1)C#N,0.1827
NC(=O)C1(CCO1)C#C,0.2534
CC1NC2(COC12)C#N,0.2512
O=CC1CN=CO1,0.2187
CC(O)(CCC#C)C=O,0.2153
C#CCn1nnnn1,0.25
CCOC1C2OC2C1=O,0.1941
CC1OC2C1=CCC2=O,0.2117
CN1CC1CCCO,0.2989
CCCC(OC=O)C#N,0.2787
Cn1cnc2c1nn[nH]2,0.2113
O=C1CN=C2NCC2O1,0.2451
NC(=[NH2+])C(=N[O-])C1CO1,0.1376
NC1C2CC1(C#N)C2O,0.2683
C1C2OCOC3CC12C3,0.3329
C1N=C2NC3C4OC13C24,0.1943
CC1C2CCC12CC#C,0.2987
CCC1C2CC(=NO)C12,0.2435
CC1C(O)CC1(O)C=O,0.2182
NC(C#C)C1=COC=N1,0.24
C#CCc1c[nH]cc1O,0.2279
CCC(N)C#N,0.298
CCN(C)c1ccc[nH]1,0.2275
CC1(CC#C)NC1C#N,0.2828
OC1(CC1C1CC1)C#C,0.2718
CC1C(CO)C1CC=O,0.2253
CC1CC(C1)C(C)=O,0.231
CNC(=O)C(=O)NC=N,0.1907
OC12CC3C1OC=NC23,0.255
CC(O)COC1CC1,0.3374
OC1CC2CC(=O)C=C12,0.1935
CCCC#CC(C)(C)C,0.3034
OCC#CC(O)C#N,0.2686
O=C1NC2C3OC3C2O1,0.3129
Cc1[nH]cc(n1)NC=O,0.2142
CC(C)C1(O)CC(O)C1,0.3193
COCC(C)OC(N)=O,0.3179
OC1(CC2CC1O2)C#C,0.2692
C1CC2OC2C2OC12,0.3284
NC(=O)C1NC1C1CC1,0.2563
OC1C2N3CC2(O)C13,0.3146
C1CC11CC2CC1O2,0.335
Cc1nc2c(o1)C=CC2,0.1793
COCC1CN1CC#N,0.2779
CCCCC(C)C,0.3858
CCC1CC2CC(=O)N12,0.2343
N#CC12C3C4CC1C4N23,0.2547
OC1CC1N1CC1C#C,0.2533
CNc1cc[nH]c1CO,0.2092
CN=C1CC(CO)CO1,0.2752
CC12CC3C(N13)C21CC1,0.3109
OCC12C3CCC1OC23,0.3044
CC#CC#CCCC#N,0.2239
COC1COC(=O)O1,0.3295
C1OCC2NC12,0.3149
CCCN(C=N)C=O,0.2232
CC(O)C1CCC=C1,0.2592
CCC1CC1C(C)=NO,0.2486
CC1(COC1)CCOC,0.3146
COC1CC1NCC#N,0.2579
CCOC(C)C#C,0.2934
OCC12C(O)C1C1NC21,0.275
COC1=CC(=N)NN=C1,0.1647
CC1CC2CC(C2)O1,0.3181
OCC12CCC1(O2)C#N,0.2719
C1CNC(=O)C(=O)C=C1,0.1643
COC(CCCO)C=O,0.2131
CC#Cc1cnno1,0.1963
C1CC11C2CC3CC1C23,0.3364
CCC1C2CCC12CO,0.3156
COC(C)(CO)C(N)=O,0.2639
c1nc(c2n1CCN2)O,0.2136
CC1C2CCC1C2O,0.3145
COC1CCC1O,0.3251
CCC(=O)C1(O)CC1C,0.2232
C1OC11CN2N=CC=C12,0.2583
CCC#CC1OC1C#C,0.2545
CC(C)(C)C(CO)C=O,0.2237
CCC1=CCN(C1=O)C,0.2172
O=C1CNC2CNC12,0.1878
CC1OC2CC3(CN3)C12,0.3067
CC(OCCO)C(N)=O,0.2485
NC1C(CO)OC1=O,0.2475
C1CC=CNC(=O)C=C1,0.198
OCC1C2C3CN2C13,0.2988
CCC(C#N)C(N)=O,0.2769
CC(C)c1coc(n1)N,0.2372
C1N2C=NC3C=CCC123,0.242
C#CC1=CNC(=O)NC1,0.187
CC12C3CC1(CO)CC23,0.3006
CCC12NC1C1COC21,0.286
CC(CC#N)C(C)C#N,0.3387
ON=C1C2C3C4C2C1N34,0.2366
CCc1c(non1)NC,0.2099
CC12CC(C1)C(=O)CN2,0.2075
OC1CC2COCC12,0.3189
CC1(CC=O)COCO1,0.2236
CC1(CC1)C1(CN1)C#N,0.2934
OC1C2C3OC2C(O)C13,0.3075
CC1CCN1C(=O)C#C,0.2178
CC12OC3C4C3C1OC24,0.3363
[NH3+]CC1(COC1)C([O-])=O,0.2709
CC1C2CC1C21COC1,0.3217
C(C=O)NCC(F)(F)F,0.2172
OCCC1CC2CC1O2,0.3243
OC1C2NC1C2N1CC1,0.3109
O=C1C=CC=CC2NC12,0.1611
CC(OCC#C)C1CC1,0.2876
COC1C2OC3C2C13O,0.2906
CC(C1[NH2+]C1C)C([O-])=O,0.2772
CC12CC(O1)C(=O)C2O,0.1956
CC1=NCCOC(=O)O1,0.2605
CC1OCC11C2COC12,0.3022
O=CC1COCOC1=O,0.2249
c1coc(=O)nc1CO,0.1884
CC(C)C1CN1C(C)=O,0.2567
C1C2OCOC3CN1C23,0.2727
CC1C2C3NC1(C#N)C23,0.2433
c1cnccc1N(=O)=O,0.1776
COCCC1CCCC1,0.3294
CC12CC(C1)C2C1CO1,0.3483
CC(O)(C#C)C1CCO1,0.2754
N=C1C=C2CCN2C=N1,0.1795
N#CC12CCN3C1CC23,0.2721
NC1C2C(C#N)N2C1=O,0.2057
CN1C(CO)C1(C)C=O,0.21
OC12C3CN=C1OC23,0.1557
OC1C(=O)C2C3CC12O3,0.1738
CC1COC1C(C)(C)C,0.3115
Cn1c(=O)c(ncn1)F,0.1782
CCC1OC2CC1(C)C2,0.32
O=C1CC2CN2CC=C1,0.1797
CC1(CC#C)NC1C=O,0.2192
C#Cc1ccnc(n1)O,0.1906
Cn1c(cc(n1)O)OC,0.2491
OCC(O)CCC1CC1,0.3164
COC=NC1COC1=N,0.2619
NC1=NC=CC(=O)C=N1,0.1486
OCC1OC2(CC2)C=C1,0.2315
COC1CCC(O)CO1,0.3291
CC1(C)C2C3N2C1C3=O,0.2335
N=COC1=NNC(=O)N1,0.2132
CC1CC2CC(C1)C2O,0.3062
CC1CNC(=O)COC1,0.2534
CC1C(CC1C#C)C#C,0.287
OC1COCCOC1=O,0.262
CC12CC3C(CC13)C2=O,0.2258
O=C1C2C3N=CN1C23,0.2081
C1C=CCC(=O)C=C1N,0.1891
O=C1NC2(CC12)C#C,0.2374
COC12CC3C4C1C2N34,0.2961
CC1CC2OC(CO)C12,0.309
CCC1(O)CC11CCC1,0.3154
c1coc(n1)CNC=O,0.2429
c1nc(on1)C=O,0.1889
CCN1CC(=N)NC1=O,0.2472
CC(O)C1(O)CCC1,0.3139
OC12C3OC4C(CC14)C23,0.3014
C#CC12CC(C1)CC=C2,0.2463
C(C=O)N(C=O)C=O,0.1981
CCC(=O)CCC(=O)C,0.2344
CC12CC(C1)N=COC2,0.2685
CC1CC2CC2(O1)C#C,0.2686
O=C1NC2CC2C11CO1,0.2493
O=CC1CCCOC=N1,0.2213
CCC(COC)C(C)C,0.3308
CC1CN=C(O1)C#N,0.2192
CN=C1ON=CC=C1N,0.1668
CC1CC1(C)C#CCO,0.2679
OC1CC(C#N)C11CC1,0.2986
N=C1NCC1(C#N)C#N,0.2539
CC12CC(O)C1C2C#N,0.2884
OC1C2C=CC1(O)C=C2,0.2218
CCN1CC(C1)(C#N)O,0.2423
CC1C2C3C4C(N23)C14O,0.2846
CN1CCCN=C1C#N,0.198
OC1C=CN2N=NC=C12,0.203
c1coc(cc1=O)CO,0.1983
CCOC=NCC(C)C,0.2698
CC(CCC#C)C#C,0.2992
OC12CC3C4OC1C2C34,0.2921
OC1CC2C3CC2(C1)O3,0.2956
C1CC1NC(=O)NC=O,0.2414
C1C2CC1C1=C2OC=C1,0.2158
COC1C2CC1C(C)O2,0.3122
C#CCN1CC(C1)O,0.2673
OCC(=O)CC1CO1,0.2382
COCC1=NC2CC2O1,0.2496
COC1CC1C(C)(C)O,0.3021
OC(C#N)C1CCO1,0.2691
C#CC(=O)CC(F)(F)F,0.2091
O=C1CC2(CC2)C1C#C,0.2132
CCC12CC3C4C(C14)C23,0.3246
CC1OC11CCCOC1,0.322
OC12C3N=C4CC1N4C23,0.1763
CCCC1OC1C,0.3511
CN(C=O)C1CC=CC1,0.2479
OC1C2CN3C2C1C3=O,0.2247
CC(=O)C(=N)NCCO,0.1869
CCC1COCCC=C1,0.255
CC1(C)C2CC1C(=O)O2,0.2738
CC1NC(=O)C2OC12,0.2506
COC1C2COC1OC2,0.3277
OC1C=CCOC1C#N,0.2548
CC1OC2CC1(C)C=C2,0.2459
CC1C2C1C1C(O)C21,0.2745
c1cnc2c(n1)nco2,0.1922
Cc1c(cnnc1O)F,0.1989
CCC1(CCC1=O)OC,0.1977
CC1C2OC(=N)C1C2C,0.2839
CCc1c[nH]c(c1N)C,0.2385
CCC1OC2(CC12)C=O,0.2191
CC1OC2CCC2C=C1,0.2573
C1OC1C1CCOCC1,0.3386
CCOC(CC=O)C#C,0.2222
NC(=O)CC(C=O)C#N,0.2229
COCC(=O)C(C)O,0.2327
OCC1OC1CCC=O,0.2289
COC(C)C1OC1(C)C,0.3284
OCC1N=COC1=O,0.2407
CCC1CC(OC)C1C,0.3216
OC1COC2=NON=C12,0.2193
CC1CC23CC12COC3,0.3099
OCC1OC(=O)NC1=N,0.2633
CC12OC3CC1CC23O,0.308
C1C=C2C3OC3C3C1C23,0.2105
OC(C#C)C(=O)C1CO1,0.2109
CC1(C)CC1([NH3+])C([O-])=O,0.2646
CC1CC(O)C2C(O)C12,0.3051
CN=C1CC(O1)C#C,0.2631
c1cn[nH]c1C(=O)N,0.2194
CC1CCC=C1CO,0.2596
C1C=CC23NC12C1OC31,0.2484
OC(C#C)C1CN1,0.2643
CN=C1OCC11CCO1,0.2576
O=CCC1CC2(CC2)O1,0.2137
c1c(nc(c(=O)o1)N)N,0.1467
CC12COC3CC1OC23,0.3197
N=C1CC=CC(=O)CO1,0.1854
N=C1C=CN2CCC2=N1,0.1824
CC1(CC2CC2O1)C=O,0.2071
N=C1OC2(CC12)C=O,0.2187
[NH3+]C1CCC(=C1)C([O-])=O,0.2043
CN1CC=C(C)C1C=O,0.1847
c1c2c(n[nH]1)OC=NC2,0.233
CC1N2CC2C=C1C#N,0.1905
O=C1NCCC2CC2O1,0.2983
CC(NC(=N)C#N)C#N,0.2146
Cc1cc(n(c1O)C)O,0.2292
CN1C2C1C1N=COC21,0.2522
C(C(=O)N)OCC(=O)N,0.2304
CN(C)c1c[nH]nn1,0.2013
CC12C3C4N=C1OC2C34,0.1531
CCCOCC(=O)OC,0.2778
Cc1c(non1)COC,0.2399
N#CC12CCN1CC2,0.2399
COCC(NC=O)C#N,0.2776
OCC1COCC1O,0.3077
N#CC12CC3C(O1)C23,0.2514
c1ncnc(n1)CO,0.2167
C#CC1=CCCOCC1,0.2028
CC1C2CC(=O)C(=O)C12,0.1484
C1CN1C12CC3C1CC23,0.3191
CNC1=CC(=N)OC1,0.2109
[NH3+]C1C2NC2C1C([O-])=O,0.2726
CC1NC2COC2C1=O,0.1835
C#Cc1c(n[nH]n1)O,0.2078
CC(OC=N)C1CO1,0.2795
CCCCCOCC=O,0.2292
CN1C2C3C1CC23C,0.2946
OC1C(O)C2C1OC2=O,0.2742
CC(O)C(O)C(N)C#N,0.2743
CC1=CC2OCC2(O)C1,0.2526
COC(C1CN1)C(C)=O,0.2164
CC(CC=O)C(N)=O,0.2289
NC=[NH+]C1=C([O-])OC=N1,0.1198
CC1C2CC3C(CO2)N13,0.3071
COC(C=O)C#CC#C,0.197
O=COCC1(CO1)C=O,0.2188
NC(=[NH2+])C([N-]C=O)C#N,0.2454
CC1CC2OC3C(O1)C23,0.2889
CC1(NC=O)C2CC1O2,0.2699
CCC(C)(O)CC=O,0.2217
C1CN1C(=O)NC(=O)N,0.2533
CC1CCOCOC1C,0.331
CN1C2CC2OC1=O,0.2928
C1C2CCC3CC12CO3,0.3228
Cc1ccc(=O)[nH]c1O,0.1737
OC12COC3C(C1)OC23,0.3003
CC1CCC(C#N)C1O,0.3082
CC1CN2N=C(C)C=C12,0.2622
C1OC2CCCOC12,0.3317
CCC12OC1C1C(O)C21,0.2849
CCC(=O)C(C)(C)C#C,0.2284
OC1CC2C=CCCC12,0.2616
CCOC(=N)CNC=O,0.2584
N#CC1C2NC1C2(C)C,0.282
COC1C(C)NC1C=O,0.2034
CC(=O)Cc1ccn[nH]1,0.1996
CC1C2C3C(O)C1N23,0.3048
CC12OC3C1C2C3=O,0.2252
CC1CC=C(C)C1O,0.2597
N=C1NN=NC=C1,0.1644
CC1(O)COC(=N)OC1,0.2941
C#CC1C2C=CC1C2=O,0.2438
COC1(CC1)C2(CC2)O,0.306
COC1(C)OC=NC1C,0.2762
COC1CCC(CO)C1,0.3268
COCCO,0.3431
N=C1CC2CC2CCO1,0.2724
C1OC11CC2CCOC12,0.2995
CCC1NC(=O)CC1O,0.2722
CN=COCC(=O)OC,0.247
COC1CCCCC1=O,0.2129
O=C1C2CC3CCC2C13,0.2314
CCN(C)c1ccon1,0.214
OC12CC3OC=NC1C23,0.2506
c1cc(nc(c1N)O)F,0.1862
Cn1cnc(c1N)CO,0.2275
NC1=CC(=O)C=NC=N1,0.1462
CC12OC3COC1C23C,0.292
CCCc1cc([nH]n1)O,0.258
CC1CC2C3OC3C2O1,0.3109
OC1CNC(=O)CC=C1,0.2402
OCC1CCC(O)C1=O,0.2064
CCC#CC(O)C#N,0.2691
CC12CN1C1C(O)C21,0.2808
O=CC1COC(C1)C=O,0.2105
C1C2CC3(COC3)C12,0.3159
OC1(CCC=C1)C1CN1,0.2412
CC1(C)OC2C(C#C)C12,0.2765
COCCCCNC=O,0.2825
C1C=CC2CCCOC12,0.2597
CC1NC1(C)C(O)C=O,0.1989
CC12CC1CC(O2)C=O,0.2094
CC#CC1NC1C1CN1,0.2649
CN1C2COC2C1(C)C,0.2833
CC(O)C(C=O)C1CO1,0.2236
O=CCC1CC2OC2C1,0.2253
C(C1CN1)C1=CNN=N1,0.2279
c1cc2cc[nH]c2nc1,0.1915
CC1OCC11CC2NC12,0.3091
CC(C#N)C1(O)COC1,0.2984
CC1(O)CCC(O)C1=O,0.2056
OCCNC(=O)C1CO1,0.2643
OC1CCOCOC1,0.3233
CC1C=C(C)C2CC1C2,0.2493
COCC1=CCCCC1,0.2613
CC12CC3C1CC(O)C23,0.3363
N#CC12CC1C1(CC1)O2,0.2484
C#CC1(CC(C1)O)C#C,0.2788
C1C2C3CC1CN23,0.328
CC1CC23CC(C=C2)C13,0.2227
N#CC1CC2(CCC2)N1,0.2636
OCC(C=O)C#CC#N,0.2049
CCC(CC)(C(=O)N)O,0.2657
COC12CC1(C)CC2=O,0.2215
N#CC1CCOCCN1,0.269
C1OC1C1OCC2OC12,0.3399
CC(NC(C)C=O)C=O,0.2026
COc1cnc(o1)N,0.2305
OC(C#C)C1=CNN=C1,0.2562
C1OC23CN4CC(C12)C34,0.2834
c1cc(c(cc1N)N)O,0.1904
CC1C(CO)C(O)C1=O,0.2228
CCOC(C)C(O)CC,0.3286
CC12CC1CNC(=O)N2,0.29
CCC1CCC(C1)=NO,0.2509
CC#Cc1cc([nH]n1)N,0.2145
CC12CC=CC3C1CC23,0.2497
CC1=CC2CCC1(C)O2,0.2538
CCOC=NCCCO,0.2734
OC1CC2CCCCC12,0.3215
[NH3+]CC1(CCC1)C([O-])=O,0.2747
OC12CC1C(=O)NCC2,0.2609
OC1CC2(O)CCC12O,0.2991
OC1CC1C1CO1,0.3156
OC1C2CC3(CC3)CC12,0.3077
CNC(=O)CN1CC1C,0.2734
C1CC2(O1)C1CCC21,0.2958
CC1C(O)C2C1OC2=O,0.2749
CC12OCC1C2CC#C,0.2925
NC1=CC(=N)NN=C1F,0.159
CN1CC(=O)C1C#C,0.2086
C1OC11CCCOCC1,0.3278
CC(=O)NCC(C)(C)O,0.277
CC1CCC(C)COC1,0.322
COC(C)C1CN1,0.3146
c1c(nn(n1)CC#N)N,0.2123
CC1CCC2(CC2O)C1,0.332
COC(=O)C1C2CC1O2,0.2393
CC1(CO)N2CCC12C,0.3141
CCC1(O)CC(=O)C1C,0.2201
CC(O)CC#CCCO,0.3025
CC1C2CC(C2)C1C=O,0.222
c1c(nc([nH]1)O)C#N,0.2165
O=CNC1=CC2CC2C1,0.2034
CC1C=CCC1N1CC1,0.2584
NC(=O)C(=O)OC=N,0.1937
CN1CC1(C)CC#N,0.2747
Cc1cc(=O)cn[nH]1,0.187
CC1CC(C1)(C=O)C#C,0.2206
CCC1CC1(O)CC#N,0.2961
O=C1CCC2NC12,0.2152
CCOC1C2CC1O2,0.3138
CC12CN1C=NC2C=O,0.2098
CC(C#N)C1(CO)CC1,0.319
O=C1CCOC1C1CO1,0.2164
OCCC12CC3CN1C23,0.3154
CC(O)C1COC(C)=N1,0.2667
COC1C2OC3CC2C13,0.3147
C1OC11C2OC1C=C2,0.2394
CNc1ccc(=O)on1,0.1576
CCC12CC1(C)CCO2,0.3046
C[NH+]1CCC1CC([O-])=O,0.2703
CC1(C)CC1C(O)C#N,0.2966
CC12CC3OCCC1C23,0.3216
CC1(C[NH+]=CN1)C([O-])=O,0.2388
O=C1NC23CC(C=C2)C13,0.2212
CC1(CC#N)COC1=O,0.2773
CC(=O)CC1CC2CN12,0.2281
COC12CC(C1)COC2,0.3205
C1OC1C12OC3C1OC23,0.2903
c1cnnc(n1)N(=O)=O,0.1658
Cc1c(oc(=O)o1)CO,0.2444
CC12CCOC1OC=N2,0.277
CCC12C3C(CN13)C2O,0.2925
CC1=CC(C(=O)N1)(C)C,0.2168
CC1(O)C2CC1(O2)C=O,0.2082
Cc1cc(co1)N,0.22
OC1C2CC3C2C13C#C,0.2746
O=C1C2CC2C11COC1,0.2225
CC1C2(O)COC12C,0.2975
CC12CC3(C)OC1C23,0.3066
C1N2C3C4C5OC13C2C45,0.3058
COC1C2OC(C)(C)C12,0.3023
CN1C2C3CC3(C#C)C12,0.2722
CC(O)CC(=O)C(C)C,0.2256
CCc1ncc(cn1)O,0.204
C#CC1NC11CCC1,0.2755
CC1(C)CCC1C1CC1,0.3408
C(C=O)N=C(C#N)N,0.2065
Cc1c(n(cn1)C)C#C,0.203
C1C=CC23CC=CC2N13,0.2119
CC1CN2C(C#N)C12C,0.2616
CN1C(C2CC2)C1(C)C,0.2899
CCN1CC1(CO)C#N,0.267
c1c(c(c2n1CC2)N)N,0.218
O=C1C=CC2CCC1C2,0.1866
CCN=C(NC)NC=O,0.2193
CC1N2CC(=O)C12CO,0.2182
CC1CCC11CN=CO1,0.2688
CC1=CC2OC3C(O2)C13,0.2428
COC1C2C(=O)CC12C,0.2303
c1cnoc1C(=N)N,0.1996
c1[nH]c(c(n1)N)CC=O,0.1513
CC1OC(CO)OC1C,0.3242
CC12CC=CC3C1OC23,0.2431
CN=c1[nH]cnc(=O)[nH]1,0.2019
c1c([nH]nc1N)C(=O)N,0.1841
CC1(CO1)C(=O)C1CO1,0.2064
C#CC1=C2CC3C(C1)C23,0.1477
OC12CN3CC1C3C2=O,0.2128
CC1OC11CC(CO)C1,0.3268
CC12NC1CCC2=NO,0.2415
CCC1CC1(O)C1CO1,0.3238
CC1=CC2CN2C(=O)C1,0.2368
CC#CC1COC1=O,0.2587
CC1(O)C2OCC12C#N,0.2697
CC#Cc1ncnn1C,0.213
N=C1CC(N1)(C#C)C#C,0.248
COCc1c(c[nH]n1)O,0.2294
C1CC11C2NC2C11CC1,0.3043
O=C1CC2CC1CO2,0.2236
Cc1cn(c(c1O)O)C,0.2313
CC1(CO)OC2CC2O1,0.3164
CCCC1=NC(C)CO1,0.272
COC1C(O)CC11CN1,0.3008
O=C1CNC(CN1)C#C,0.2445
CCC(C)C1CC1C#C,0.2904
CC(C=O)C(=N)NC=O,0.1994
CC12NC1C1OC2C=C1,0.2472
OCC(O)C1CCC1O,0.3029
CC(C#N)C1CC1C=O,0.228
CC1CC(C#N)C1C,0.3324
c1c(nc([nH]1)CO)O,0.2251
CC1OC(=O)C(N)C1C,0.2539
COc1cc(=O)ocn1,0.1867
OC1CC1OC(=O)C#C,0.2041
COC(C)C1(CO)CO1,0.3373
CC(C)C1(C)OCC1C,0.3138
CC#CC(C=O)C(N)=O,0.2017
O=CNC1CCC1C#C,0.2756
COCC12CC(O)(C1)C2,0.3355
COC1(CC2OC12)C#C,0.2788
CC12COCC1(C)N2,0.3013
CC1(O)CC1(C)C1CO1,0.317
CCOC(=O)C(=O)NC,0.207
COC1C2OC(CO)C12,0.2959
COCC(=O)C#CCO,0.2098
c1c(oc(=O)o1)CC#N,0.2518
CC(C)(CC(=O)N)C#N,0.2743
C#Cc1c(=O)oncn1,0.1502
CN1CC(C1)(C=O)OC,0.1805
CC1(O)CC(C1)N1CC1,0.3028
CC(C)(C)C(C)(C)CO,0.3319
CC12CC1(CO)C(=N)O2,0.2717
CC(=O)C#CC#CC#N,0.1657
NC1=NON=C(F)C1=N,0.1605
CC(N1CC1C)C(N)=O,0.2703
OC1C2(O)COCC12O,0.2748
CC1(CC(=O)N1)C#C,0.2735
c1cc(nc(c1)O)C#N,0.1909
OCC#CC1COC1=N,0.2728
COCC1(C)OC1C#C,0.2761
Cn1ccc(c1)CC#N,0.2436
NC1=CC(=N)OC2CC12,0.1992
CNC(=O)NCC=O,0.2201
CC(O)C1=CC=C(C)N1,0.23
O=C1NCC2CCC12,0.268
Cc1nc(c(o1)CO)N,0.2029
CC1OC1C(C)=O,0.2217
OCC1C2NC1C2=O,0.2508
CC1C(O)COC1=N,0.284
CC1OC(C)(C)CC1O,0.3128
CC1COC(=N)C1(C)O,0.2884
CC(NC=O)C#N,0.2762
CC1OCC1C#N,0.285
c1c(=O)c(n[nH]c1O)N,0.1876
N=C1CC2(CC2)C(=O)N1,0.2515
CC1C23COC12C=CC3,0.2286
OC1CC2OCC=C12,0.2332
CC(C=O)C1NC1C=O,0.2214
CC12C3N1CC2OC3=N,0.2538
OC1C=CC2(CC12)C#C,0.2296
CC1(C[NH3+])OC1C([O-])=O,0.2689
CCC(=O)C12CN1CC2,0.2168
CC1(CC2OC2C1)C#N,0.3148
Cc1c(cnn1C)CO,0.248
C1C(O1)(CO)CO,0.3136
CCC(C#C)N(C)C=O,0.2694
CN=COC1CCOC1,0.2699
c1c(nco1)CCC#N,0.2476
CCC1CCC11CO1,0.3297
C1C2C1C13CC21CCC3,0.2743
CC1OC2CC12CC=O,0.2074
C#CC1=C(COC1)CO,0.2046
NC12C3NC1C3OC2=O,0.2412
CC1C2NC2C2(O)CC12,0.302
N=C1OC=NC(=C1)C#C,0.1618
CC(C#N)C1CCC=C1,0.2641
NC1CC1[NH2+]CC([O-])=O,0.2486
CCOC1CC2C(C)C12,0.3242
CNc1cncnc1F,0.1925
OC1(CC2COC12)C=O,0.2191
N#CCC1C2CC3C2N13,0.2905
c1[nH]c2c(n1)CCCO2,0.2351
C1C=CC2N=CN3C1C23,0.239
O=C1NC2COC2C=C1,0.2067
C1C(CO1)(C#CC#N)O,0.2136
CC(C=O)C(=O)CO,0.2071
CC1C2C3CC3C(O)C12,0.3006
C#CC12CN1CC21CN1,0.2376
CNC=O,0.2851
c1c(c2cn[nH]c2[nH]1)N,0.2087
O=C1CC2CC1C(=O)O2,0.2141
CC1(C)CC11CC=CC1,0.2638
O=CC#CC1OC1C=O,0.191
CCN1C2CC2CC1=O,0.2578
CC1C(O)C=CC1C#C,0.2568
CC1(C)OC11C2CC1O2,0.3151
CCN1C2CC2C1C=O,0.1845
OCC1=CCOC2CC12,0.2472
CC12COCC1CCO2,0.3096
ON=C1C=CC2NC12,0.1882
COC1C2CC2C11CN1,0.3174
CC1C(O)C2=NCCN12,0.2396
OC12CC1CNCC2=O,0.2022
c1c(nc([nH]1)OC=O)O,0.1901
c1nc2n(n1)CC=CC2,0.2535
NC(COC1CC1)C#N,0.2775
O=C1CC2(CO2)C2OC12,0.2156
O=CNC1CNC(=O)C1,0.2673
CC1N2CC1(C)OCC2,0.2863
CC1(C)OC2C1OC2=N,0.2646
CC1COC2=NC=NN12,0.2573
C1C(=O)COC(=O)O1,0.217
CC1(CC=CN1C=O)C,0.2102
ON=C1CC2NC1C2O,0.2437
C1CC23OC4CN(C12)C34,0.2649
CC(=O)C(C=O)C1CC1,0.199
c1c(ocn1)C2COC2,0.2369
CC1CN(C)C(C=O)=N1,0.1539
c1c(c(=O)c(co1)O)N,0.1723
CC#CC1=CNC(=O)C1,0.1793
CCCOC=NC(C)C,0.2716
C1OC2CCCC12,0.3217
C#CC1=CC2(CN2)CC1,0.1929
CC1C2NC(C)(C#N)C12,0.2568
COc1cc(c([nH]1)N)O,0.2346
c1c([nH]c(=O)o1)CO,0.2425
CC1OC(=O)C2CC1C2,0.2749
CC1OCC2OCC=C12,0.2435
N=C1CC2CC(C2)O1,0.2746
CC1CCC=CCC=C1,0.2443
CC1C2C=CC3CC2N13,0.2214
CC1OCC(C#C)=C1C,0.2041
c1c[nH]c2c1COCO2,0.238
O=CC12CC1CC=CC2,0.2269
O=CC1=C2CCC2CC1,0.1893
OCCCC1OC1C=O,0.219
CCC12C(O)C3C1CC23,0.3193
CC(=O)C1CC2NC12C,0.2195
CC1C2CN1CC2C#N,0.2735
[O-]C(=O)CC1CC[NH2+]C1,0.2729
CC1CC2C3CC12CO3,0.299
CC1CC2=CON=C2C1,0.2426
CC1OC11CC=CC1C,0.2664
CC1C(OC1C#N)C=O,0.2193
CC1C(O)C1OC(N)=O,0.292
CN1CC11CC(CO)C1,0.2994
CCOC12CC3C1OC23,0.306
O=CC1=CN2CCC2C1,0.1731
CC(O)C1(O)CC1C#N,0.2927
CC(C)c1ncn(n1)C,0.2632
CC1C2OC=NC1C2O,0.2562
CC1CC(C)C(=O)C1C,0.2182
OC1CC2C3CC(O3)C12,0.3173
CCC1(CC1)C(N)C#N,0.295
CCCCOC(=N)C=O,0.1938
OC1C2OC(=N)C12O,0.2547
CC(C)CCC(=O)C=O,0.1568
COC1CC1C1CCC1,0.3167
C#CC1OCCC=C1,0.2633
COC1C2C3N2CC13O,0.2961
OC12CCC3C1N3CC2,0.2932
CC(O)(CO)CC#C,0.3013
COc1c(cco1)O,0.2198
CC12C(CO)C1C1CC21,0.2799
CC1CC2C3CC3(O)C12,0.3192
OC1CC23CNC2C1O3,0.2674
CC(C)(C)CNC=O,0.2812
CC1C2NC(C1O)C2=O,0.2328
C1C(CN1CCO)O,0.2865
CN=C(C=O)NCCO,0.1611
CC1OCC(C=O)C=C1,0.209
COC1C2C3C2N2C3C12,0.2949
COC1(C)CCC2CC12,0.3251
OCCC12CN(C1)C2,0.3022
OCCOC1CC(O)C1,0.332
OC1(CCC1C#N)C=O,0.2203
C1C=Cn2c1nc(n2)O,0.1908
c1coc2c1CCC2,0.2303
CCC1C(CC=O)N1C,0.1985
CCc1ccoc1C=O,0.188
C1C2CC11OCC=CC21,0.2515
C#Cc1cc([nH]c1N)O,0.1964
CC1C2OC1C2C(C)=O,0.2113
OC(C=O)C12CC1CO2,0.201
CC1CCOCC(C)=C1,0.2474
CCc1c[nH]cc1NC,0.2278
CC1CCC(O)CC1O,0.3002
CC1=CC(CC1)(C)C,0.2596
CCC1(C)OC1C1CC1,0.3397
C1CN1C1C2OC1C=C2,0.2285
C1C23COC=NC12CO3,0.2324
CC1(C)C=CC2OCC12,0.2505
CC1=CCC(C1)OC=O,0.2547
C1C2CC1C21OCC=C1,0.236
OC1CC2(O)CC12C=O,0.2066
CCc1c(n(cn1)C)O,0.2387
CC1=CC2CC1(C)CO2,0.2471
c1cc(nc(c1F)O)F,0.2055
CC1C(CC=O)NC1=O,0.2155
N#CC(C1CC1)C1CO1,0.3107
CC1C(OC11CC1)C#N,0.255
c1(nnon1)C(F)(F)F,0.2551
CC#Cc1[nH]nc(n1)O,0.1987
O=C(C#N)C1C2COC12,0.1805
O=CC12CC(C1)C2=O,0.2097
CCC1(CN1)C(C)=NO,0.2429
C1NC11C2CCCC1O2,0.313
c1c(noc1N2CC2)O,0.2333
CC1C2C3C(=O)C1C23C,0.242
O=C1CC2(CN2)CO1,0.275
CC(=O)C(=O)NC=O,0.1636
CC1(CCC=CC1)C#N,0.2679
CN=C1C(=O)OCCN1,0.1855
COCc1c(nco1)N,0.2067
CN=C1C(=NCCO1)N,0.2022
N=COCC1(CO1)C=O,0.2103
OC1CC23NC(C12)C3=O,0.2396
C1C2C1C13CCCC21N3,0.3322
CC1CC2(O)COCC12,0.3134
CC(O)C(C)(O)C1CN1,0.2912
Cn1ccc(=O)[nH]c1=O,0.2036
CC1CN=C2OCC=C12,0.2058
CC1CC=CC2NC12,0.242
O=C1CC2CC2N2CC12,0.2044
COCc1ncno1,0.2443
O=CC1C2N1CC21CC1,0.2151
NC(C#N)C1C2COC12,0.2695
C1C2C=CC3CCC3C12,0.2457
CCC1(CO1)C=O,0.2204
COC1CC1(C=O)C#C,0.2117
OC1C=CC2COC12,0.255
CC1C2C3N1CC23C#N,0.2614
CCC1(C)OCC11CN1,0.3092
N#CCC12OC1CC=C2,0.2486
NC(=O)OC1C2CC1O2,0.2933
CC1C2(CO)COC12C,0.2973
CC12C3C4C(CN13)OC24,0.2886
OC12C3CC1C1(CC1)C23,0.3043
OCCCC1NC1C#N,0.2842
CC#CC1NC1CO,0.2742
CC1C2OCOC(=O)C12,0.2618
CC(CC(C)=O)C1CC1,0.2333
CCC1(CC1)OC=O,0.2762
C#CCC1CC2(CO2)C1,0.3083
OCC12CC(O1)C=C2,0.2373
O=C1CC2CN2C1C#C,0.2
CC1C2C1C1(C)CC21C,0.2891
CC1(C)C(C=O)C1C#C,0.2183
C1OC2C3CN4CC3C124,0.2762
C1OC2C3CCC=C1C23,0.2304
CC(O)CC(O)C#C,0.295
CC1C=CN(C=O)C1=N,0.2021
CC12CC3C1N2C3CO,0.3262
c1cnoc1C#CC#N,0.1796
O=C1CC2(CC3OC23)N1,0.2826
CCN1C2CC(C)(C)C12,0.3054
CN=C1ON=NC=C1O,0.1629
NC(=O)C1CCC1C#N,0.2606
c1cocc1NC(=O)N,0.2237
OC1C2C3OC2C(=O)C13,0.2093
OCC1N=COC11CC1,0.2513
c1noc(=O)n1C=O,0.2198
OCCCCC(O)CO,0.317
OC1CC11COC(=O)C1,0.2753
CCC(C)OCC#CC,0.2831
O=C1C2CCC11OCC21,0.2104
O=C1CCC2=CCOC12,0.1941
C#CC(C#C)NCC=O,0.2212
NC12COCC1C2C#N,0.2889
CC12CCC1C1OC1C2,0.3415
Cc1ccc([nH]1)CC=O,0.1712
CC12OC1(CO)CC2=O,0.2168
CCOC1(CCC1)CO,0.3272
CC1C(CO)C2CCC12,0.3149
NC(=O)CC(C#C)C#N,0.2702
CC1OC(CO)C11CN1,0.3075
C1CC1OC1C2COC12,0.2994
Cc1c(cco1)N,0.2175
CCOCC(=O)NC=O,0.2221
C1N2C3COCC=C1C23,0.2174
C1C2OC3C4COC13C24,0.2929
C#CC1=CC2CN3C2C13,0.1946
C#CC(C#C)C#CC#N,0.2352
O=CCN1CC1C=O,0.2086
CC1(O)C2CCOCC12,0.3147
O=C1CC(NC=C1)C#N,0.1909
OC1CCC1C1(O)CC1,0.2913
O=C1OC2CC1N=CO2,0.2527
N=C(C#N)N1CCN=C1,0.1849
COCC1CC1(O)C=O,0.2207
N#CC1CC2CCC1O2,0.3044
C#Cc1cc(on1)C=O,0.186
C1CNCc2c1non2,0.2053
C1CNCc2c1onn2,0.2087
CCC1CC2OCC12C,0.3126
O=C1CC2C3OC3C2O1,0.2825
CC(O)CC1(O)CC1C,0.3018
O1C2C=CC3C=CC2C13,0.2204
CC1C2OC3(C)CC2C13,0.3232
CC1(CC1)C1COC1=N,0.2889
CC(C)C(C)C#CC=O,0.2051
CN=COC1CC1C#N,0.268
CC1CC1CC1CC1O,0.3312
CC1NCC(C)=CC1=O,0.18
CCC12COC(C)C1O2,0.3331
CC(=O)C(C)(O)C#N,0.221
C1CC1COC2CC2,0.3354
c1conc1N(=O)=O,0.2023
C1C2C3C4C(C5C1N45)N23,0.263
CCC#CC1OC2CC12,0.2601
CN1C2C3C4C1C2C34C,0.3048
O=CC1CC2OCOC12,0.227
C(C#N)C(CC#N)C=O,0.2245
C1C(CO1)(C(=O)N)O,0.2708
OC1C2C(O)C1C21CC1,0.3073
O=CC1CCOCO1,0.226
CCOCC#CC#C,0.2216
CC12CC1(CO)OCO2,0.3145
NC1=NC(=N)C(N)=NO1,0.2016
CCN1CC1C(C)C#N,0.2649
C1CN1CC(=O)CC=O,0.2096
CC1OC2C(C#N)C12C,0.2809
O=C1CC2CC3OCC123,0.2146
O=CN1CC(N=C1)C#C,0.2237
CN1C2C(=N)OCC12C,0.2539
C1CCC(=C2CCC2)C1,0.2384
CC1C(C#C)N2CC12C,0.2631
OC1CC2COC=NC12,0.265
COC1C2OC1C1NC21,0.3047
OCC1NC(=N)C1O,0.2569
Cc1c(c(oc1O)N)N,0.2228
NC1=C(N=CN1)C1CO1,0.2288
N=C1CCCC2CC2O1,0.2666
CCC(O)C1COC=N1,0.2663
COc1ncc(cn1)O,0.1855
CCC1(C)OC1C(C)=O,0.2204
CC(=O)C1=CCCC1=O,0.1717
CCN=C1CNCCO1,0.2427
CC1(C)CCC(=O)C1O,0.226
CCc1c(non1)C#C,0.2159
O=CCC12CC1OC2=O,0.2247
[NH3+]C1C2CN2C1C([O-])=O,0.2656
CC(C)C(=NO)CC=O,0.2118
CC#CC1OC1(C)C#C,0.2548
CC(CC#C)C1CO1,0.3143
OCC(O)C1C2COC12,0.3043
Cn1cccc1COC,0.2417
CC1(C)CC2(O)COC12,0.2966
CC1COCOC=N1,0.2586
CC(=O)C(C)(C#C)C#C,0.2173
CC1(C)OC11COC1=O,0.2571
COCCCC(=O)N,0.2795
OC1C2CCCC(O)C12,0.3029
c1cc(c(=O)oc1)O,0.1717
Cc1c([nH]c(n1)O)C=O,0.1818
OCC1(CC2CC12)C=O,0.2192
CC12OC3CC1OC23,0.3173
CC1(O)COCC1C#N,0.2938
CC(C)(C=O)NC=O,0.2163
CC12CC(=CC1O2)C#C,0.1972
c1c(cn(c1N)C=O)O,0.1693
c1cnc-2noccc12,0.1455
CC1=C(C)C2CC(C1)O2,0.2379
O=C1NCC2CC3C2N13,0.276
O=C1NC2CN3CCC123,0.2362
OCCC(O)C#C,0.2962
CCCC12CC(O1)C2C,0.3227
FC(F)(F)C12CC(C1)O2,0.325
Cc1ncc(c(n1)F)F,0.2213
c1c(c(c(cn1)F)N)F,0.2208
CCCC(O)C(F)(F)F,0.3588
CCC1CC11CCC1=O,0.2182
CC1OC2C(C)C(=O)C12,0.2146
CC1=C(C)C(=O)C2NC12,0.1828
CCN(C)C(=O)CC=O,0.2266
CCC#CC(=O)N(C)C,0.2238
CN1C=NCC1=O,0.2296
CC(O)C12CC(C1)O2,0.3207
CCC1OCC11CO1,0.3239
NCC(O)(C#N)C(N)=O,0.2393
CC1NC(=O)OCC=C1,0.2538
CC1C2OC(=O)OC12,0.3207
c1cc(cnc1)C=O,0.1819
CC1C2C3C(C)C1N23,0.3106
CC1C2CC2C2CC1C2,0.3343
CCCC(=O)OCC,0.286
CC1=CC23CC(O2)C3C1,0.2286
CNC1COCOC1=N,0.2581
CCc1c(con1)C,0.2483
O=C1NC2C3CC2(C3)O1,0.3042
COC(=O)C1(N)CC1O,0.2321
CC(=O)C1CC1(C)C,0.2292
CC1C=C(C)C(O)C1O,0.2572
CCC1(OC1CO)C#N,0.2851
CC1CCCCCCC1,0.3666
c1nc2c(o1)CCCN2,0.2067
COC1(C)CC=CC1=O,0.173
N=C1NC(=O)CC2CC12,0.2421
CCC12CN(C1)C2C,0.3015
CC1(CC=CC1O)C#C,0.2506
COC1CC11CCC=C1,0.247
O=C1CNCC1C#N,0.2015
CC1(C)COCC1C#C,0.2914
CC1N2C(=O)C(O)C12C,0.2226
CC1CC2CN2CC1=O,0.2024
N#CC1OC2CCNC12,0.2493
CCC(O)CC#CC,0.2938
c1c(c(c[nH]1)O)NC=O,0.216
CC1OC(=N)CC(C)=C1,0.2595
COCC12CC(C)C1O2,0.3268
OCCC1N2CC2C1=O,0.2196
C1CN2CCCN=C2O1,0.2763
CC1(O)CC1C(=O)CO,0.2343
C#CC1NC1(C#C)C#C,0.2396
C#CC12CN(C1)C2C#N,0.2606
CN=C1OC2(C)CCC12,0.2733
CN=C1OC(C)C2CN12,0.2749
OC1C2N3CC3C12O,0.2802
CC#Cc1ncncn1,0.1991
C1CN1CCC#N,0.2886
CC1C2OCCC12C#N,0.2891
OC1C2NC(=N)C(=O)C12,0.176
CC1CCC11CCC1O,0.3259
Cc1ccc[nH]c1=O,0.1793
COCC(C)(O)CC#C,0.3072
c1c(c(co1)N)C2CC2,0.2238
COC(=O)NCCC#N,0.3021
COCCC12CC(C1)O2,0.3275
Cc1cc(c(nc1)F)N,0.1963
CNC12CC1OC2C#N,0.2354
CN1CC2CC1(C)C2=O,0.2041
C1COCC=C1,0.2671
CNC1=CC(=N)ON=N1,0.138
CC1OC(CCO)C1O,0.3056
c1cc(n[nH]c1=O)F,0.1692
CC(=O)NC(=N)CC=O,0.2174
O=C1CCC2OC12C#N,0.2115
CC1(CN1)C12CC1CO2,0.3056
CN=C1CC(CO)O1,0.2784
FC(F)(F)C1OC1C=O,0.2193
NC(=[NH2+])C1=CC=C([O-])N1,0.1468
CCc1cnc(cn1)N,0.1823
COC1(C)C(C)C1(C)C,0.311
CC12CCC1CN2C=O,0.2632
C1C2CCC3COC1C23,0.3079
CC1NC11C(O)CC1O,0.2928
O=CC1(C#N)C2CC1C2,0.2165
OC(CC#C)C(=O)C#N,0.1656
CCC1C2CC1(C2)C#C,0.2996
OCCC12CC(=O)C1O2,0.2167
Cc1cn[nH]c1COC,0.251
C1C2C3CC(N12)C31CO1,0.3251
CC1CC2CC2C1=O,0.2225
C#CC1(CCOCC1)O,0.2821
CC(=N)Nc1ccon1,0.2203
CC1(CC1(O)C#C)C=O,0.2231
O=CC1COCC=CC1,0.2182
CC(C)C1(O)C2CC1C2,0.3261
CC(=O)OC=N,0.2533
NC(=O)C1C2CCCN12,0.2425
O=CC1C2CN2C11CC1,0.2074
CCCC1OCC1=NO,0.2449
CC12COC1C2O,0.2928
CC(C)(C)N(C)C=O,0.271
CCCNC(CN)C#N,0.2676
CC12OC(C=C1)C1NC21,0.2483
CC1(CO)COC1C=O,0.214
CC1(COC1)C(=O)OC,0.2563
O=C1ON=NC(=C1)C#C,0.1628
Cc1[nH]c(c(n1)O)C=O,0.1737
COCC12CC1CC2=O,0.2332
OC1(C#C)C2CC1O2,0.2744
OC12CC1N=COCC2,0.2511
CCC12C3CCC1OC23,0.306
C1CC23CC4C(CC24)C13,0.3522
CCOCC(C)C#CC,0.3057
c1c([nH]nn1)CO,0.2505
CC(C)C12CC3CC1N23,0.3215
C1CC1C#CCCC=O,0.2112
CC1C2CC=CC12C,0.2455
CC(C)C(=O)C(F)(F)F,0.2216
OCC1CCOCC=C1,0.2605
C1CCC2=C(C1)CCC2,0.2525
CC1CCC11NCC1=O,0.2134
CCC12CC1OCCC2,0.3197
N=C1NC(=O)C2COC12,0.2386
O=C1CN2CC3OC3C12,0.2075
CCC1C2OC2C=C1C,0.2407
CC1C(CO)OCC1=O,0.221
CCC(=O)CCC#CC,0.2261
CC(CO)(C=O)C=O,0.1961
CNC1=NCC2(C)OC12,0.2405
OC12COCC3C1OC23,0.3135
CC1CC2(CC12O)C#N,0.267
CCC12C3CC1(C)OC23,0.3029
COCCC(C)CO,0.3267
OC1C=CC2=C1C=NN2,0.1808
CC1(CC1)C1COCO1,0.3373
C1C2OCOCC3C2N13,0.3065
OCC1(OCC1=O)C#C,0.2087
CC1C2C=CCC2C1=O,0.2187
c1[nH]nc(n1)NC(=O)N,0.2372
CCc1c(cco1)CO,0.2339
CC#CC(C)(C#C)C#N,0.2808
CC1=CC2(CO2)CC1=O,0.1924
CC1(C)NC(C=O)C1O,0.2087
CC(=O)CN=COC,0.2254
CC1COCC2(CC2)O1,0.3241
Cc1c(ocn1)N(C)C,0.2399
CC(C)N1C(C)C1C#C,0.2574
O=CC12CC1C1CC1C2,0.2285
CCC1OCCCO1,0.3503
O=C1CC2OC12C1CN1,0.2131
c1c2c(c([nH]1)N)CCN2,0.2185
C1C2CN3C4C=CC12C34,0.205
CCC1=NC(CO1)C#C,0.2718
CCOC=NCCOC,0.2577
CC1CCCCC(C)O1,0.3217
CCC1(C)CC1CC#C,0.3109
CNc1cnc(nc1)O,0.1692
CCCNc1cnn[nH]1,0.2294
CC1=CC2CCC(C2)C1,0.2558
CCC1(C)CC1C#N,0.3117
CC1CN(C)C=CC1=O,0.1834
CC1(CC#C)CC(=N)O1,0.2855
COC1CC1(C)C1CC1,0.3145
CCOC1C(C)C1C#N,0.2876
CC(O)C12CC1CCC2,0.3262
O=CC12COC1C2C#C,0.2069
CC(C)CC1CCC1=O,0.2204
CCC1OC(C)C1(C)C,0.3162
O=C1NC2C3CN3C12,0.2505
CC(CO)N1C(C)C1C,0.2973
C(=O)c1c(oc(n1)N)N,0.1754
N#CC12CN1C1CC21,0.2434
C1OC11CCC2NC12,0.3112
CC(CCO)N1CC1C,0.3054
CC1(C)C2C=CC(=O)N12,0.1951
C#CC1C2C3N2CC=C13,0.1645
CCC1C2CCC1(C)O2,0.3206
CCC1(O)COC1C#N,0.274
CC1CCC2COCC12,0.3154
CC(=O)C12CN1C1CC21,0.2096
CC1=CCC2OCC12,0.2588
CC1C(O)C1N1CC1C,0.3037
COC12CC3CN(C1)C23,0.2788
OCC1=CC(NC1)C#N,0.2396
CC12CC1C1(CC21)C#N,0.2471
CC1C2N3CC3(C)C12C,0.3115
[NH3+][C-]1C=CC2=NON=C12,0.1463
COC1(C)CN2CCC12,0.2832
N=C1OCCC2NC12,0.264
O=CC#CC1(CO1)C#N,0.1966
CC1=CCC(=O)NC1,0.2543
CC1(C=O)C2OC(=N)C12,0.2182
C#CC(=N)NC(=N)CO,0.2021
COc1c[nH]c(n1)N,0.224
FC(F)(F)C(=O)C1CO1,0.2121
CC(C)C(=O)C(=O)NC,0.177
CC(C)CCCCC#N,0.348
CC(O)C(=N)OCC#N,0.2532
CC(=O)C1=CNCC1O,0.1853
CC1(C)OC2C(O)C12,0.3015
C#CCNc1c[nH]nc1,0.2207
OCC12NC1C(=O)C=C2,0.1777
CC1CC(CCO1)C#C,0.2925
COC1CC(O)C=C1C,0.2494
CC1CC(C)(O)C1C#C,0.2945
[NH3+]CCC1=CC(=O)O[CH-]1,0.2247
OCCC12OC1C1NC21,0.2786
CC(CO)(C#N)C1CO1,0.3054
C[NH2+]CC1=COC([O-])=C1,0.2233
O=CC1COC=N1,0.2157
OCCOC=N,0.2847
CC1CCC2OC2(C)C1,0.3361
OC12C3CC1C3OC2=N,0.2724
CC1C(C#C)C1C#C,0.2686
CC1CC1(C)C#N,0.317
CC12OC1C1(OC21)C=O,0.2059
OC1C(O)C1C1CC1,0.2805
CC1CC(C1)(C=O)C#N,0.2292
CN=C1OCC1N1CC1,0.2536
C1CC2(C1)C1C3CN1C23,0.3077
C#Cc1nccnn1,0.1643
C#CC12CC1C1OC21,0.2499
C1OC11C2C3CC1C23,0.3445
CCOC(=O)CN(C)C,0.2311
O=CCCC1NC1C#C,0.2267
CCc1[nH]c(cn1)C=O,0.1874
COC(C#N)C(C)O,0.3048
O=CCCC1C2COC12,0.2248
CC1CC(C)(C)OC1=N,0.2823
CC1(O)CC2NC1C2=O,0.2334
O=CC1CCC2CN2C1,0.2017
O=C1C2CC1C1CC1C2,0.2233
c1c(nc2n1cno2)N,0.1861
CC1CC23OC(C2C)C13,0.2807
CC1=C(N)OC(=N)N=C1,0.1647
CC1CC2=CON=C2O1,0.2405
CC1C2C(N=CN12)C#C,0.2366
CC1C2N1CC1CC21O,0.2979
CN1CC1C1(C)CC1O,0.2909
OC1CC23OC12CC=C3,0.2344
OCC1=CC(CC1)C=O,0.2145
CCCC12CC1(O)CO2,0.2988
CC(=O)OC1(CCC1)C,0.279
CC1=CNC2=C1N=NO2,0.1308
CC1[NH2+]CCC1C([O-])=O,0.2748
CC12COC1C(CO)C2,0.3114
CC(C#N)C(N)C#N,0.2913
N=C1OC(=O)NN=N1,0.189
C1C2C3C4OCC24CN13,0.2829
CC1NC2(CC12O)C#N,0.2363
N=C1OCC2CCC2=C1,0.2135
CCCC(CO)N1CC1,0.3264
CCC1OC(=O)C(=O)O1,0.2103
CC1N=CNC1(C)C#C,0.245
CC(CO)(C#N)C#N,0.2949
CC#CCN=C1CCO1,0.2591
CC12C(O)C3(O)C1OC23,0.3003
OC1C(O)C1CN1CC1,0.2741
CC#CC1CC(=O)C=C1,0.1902
CCn1cc(c(n1)C)N,0.2218
C1C2C1N1CC1C1CN21,0.2919
O=C1OC2CCN=C2O1,0.2708
C1C(CO1)CCC(=O)N,0.273
c1ccc(c(c1)N)N,0.2056
CC12N=COC1C2C=O,0.2197
CC(=O)C1NCC11CN1,0.2123
CC(C)CC(=O)CC#N,0.2357
O=C1CCCC1CC#N,0.2209
CC1CC2OC2CO1,0.3395
CC(CO)OCC=O,0.2284
CC1=CC(C)(CO)CC1,0.2501
O=C1NC2C=CCC2=C1,0.2136
C1CC2NC2C2NC12,0.2925
Cc1cncc(c1O)N,0.2036
O=C1OC2C3CCN3C12,0.223
CC12NCC1OCC2=O,0.1993
CC1OCCOCC1=O,0.2122
CC#CC1(CO)CC1O,0.2743
CC1C2C3OCCN2C13,0.2999
O=CC1CC(O1)C1CN1,0.2151
COC(N)=NC1CC1O,0.2684
CCCCCC(O)C#N,0.3123
CCC1=CC2CC2CC1,0.24
CCC12OC3CC1C23C,0.31
OC1C2OCC12OC=N,0.2583
OC1C2NC2CC1C#N,0.2989
CC#CC1(C)CC(C)C1,0.2967
O=CC12CC3C(N13)C2=O,0.2052
c1cc-2ccc[nH]c2c1,0.135
CC1OC11C2CC1C=C2,0.2414
CC(C)c1n[nH]nn1,0.2615
OCCC1(CO1)C1CC1,0.3322
NC1=CC(N)=C2CCN12,0.2013
CN=C(C#C)NC=O,0.1973
C#CC12C3CC4C(C14)C23,0.254
CN(C)C(CC#N)C#N,0.2548
OC1CCOC1C1CC1,0.302
CC(C)C(C=O)C#C,0.2193
CC(O)C(C)CCC=O,0.2286
CC1=CC2OC2C1=NO,0.1884
CC(C#C)(C#C)N1CC1,0.2645
CC1(CC1(C#C)C#C)C,0.2625
CC1(Cc2n1ncn2)C,0.275
CNC(=O)NCC#N,0.2805
N=C1CCC=CCO1,0.2504
OC12CC1(NC2=O)C#C,0.2254
CC1=CCOCC2CC12,0.2466
c1c2c([nH]c1O)CCO2,0.2185
Cc1c2c([nH]n1)nco2,0.2148
CCN=CNC(=O)CO,0.2343
CC1=NC(=N)N=CN1,0.1968
CC(C)(C#N)N(C)C,0.2622
C1OCC2OCOCC12,0.3364
OCC1C2OC(=N)C12,0.2791
C1NC11CC2N=COC12,0.2624
c1cc(c(=O)[nH]c1)F,0.1795
CC1C2C1N(C)C2C=O,0.175
OCC12CN1CC2=NO,0.233
CCN1CC1(C)CC=O,0.2112
CC1C2CC3(O)CC3N12,0.2895
CC(C)C(C)C(C)=NO,0.2556
O=C1CC2CC(C2)C=C1,0.1846
CC#CCC1CC1(C)O,0.2983
CC1C2C(C)OC(=O)N12,0.2805
OC1C2CC3NC3C12O,0.2752
CCCN1CC1(C)C#N,0.2776
COC1C2COC(C)C12,0.3061
CC1CCC(C)=C1C#N,0.2156
CN(C)C(=O)NCC#N,0.2646
COC(CN)(CO)C#N,0.2595
Cn1ccn2c1ncn2,0.2308
C(C#N)n1c(=O)[nH]nn1,0.228
c1coc2c1onc2,0.2048
C1C=C(C(=O)O1)CO,0.2335
CC1N=COC1C#N,0.269
OC1(CC1)C1(CO1)C=O,0.2074
CCC12C3C4N1C2C34O,0.2711
N#CC12CC(N1)C21CN1,0.2582
Cc1c(c([nH]n1)C#C)N,0.1879
CC(O)C(CO)C1CC1,0.3164
N=C1ON=C2OCCN12,0.2523
C1OC2CC3CC=CC123,0.2447
COC(C#C)C(F)(F)F,0.2932
C#CC12CN3C1CC23,0.2744
N=C1OC=CN=C1C=O,0.1413
CC1CC(CC=C1)C=O,0.2243
CC1C=CC(CO)C1=O,0.222
CC1(C)C2CC11COC21,0.2925
CCC1OCC11CN1C,0.3091
OCC(C#C)C#CC#C,0.226
CCC12CC1(O)CN2C,0.2736
CC(=O)C(=NC1CC1)N,0.1753
Cc1cnc([nH]1)C#N,0.2039
OCCOC1COC1=O,0.2536
CC(O)C1C2NC1C2=O,0.25
CC1OCC1(C)OC=N,0.2729
C1C(CC1=O)C#CC#N,0.2186
c1coc(n1)N=CN,0.1861
C#CCCC1COC=N1,0.2674
CC#CC1C2OCC12C,0.2744
CC1C2C1C(=O)CC2C,0.2227
Cc1c(non1)NC,0.2113
NC1=NC(=[NH2+])[N-]N=C1O,0.1755
Cn1ccc(n1)N,0.2302
CC1(C)CNC(=N)C1=O,0.186
CC1OCC1=NO,0.2454
C1CC11OCCN2CC12,0.3108
c1c(c(oc1N)CO)O,0.2097
O=CC12CC(C1)C(=O)N2,0.2031
CNC1COC1(C)C#N,0.2492
C1C2OCC3OCCC123,0.3202
c1c(c(c(=O)[nH]n1)N)F,0.1743
CC(C)C1CNC(=O)O1,0.3149
FC(F)(F)C1(CN1)C#C,0.2882
CC1C(=N)OC1(C)C,0.2881
CC1OC(C)C1(O)C#N,0.2713
CCC12CN3C1CC23C,0.3076
COC1=NC=COC1=N,0.1708
NC(C#N)C(CO)C#C,0.2822
CC(O)C(CO)C(C)=O,0.2231
N=C1NC=NC11CCC1,0.2212
CC12CC1CN2C=O,0.2572
CC(=O)CC1COCO1,0.2297
OC1C2OC3(CC3)C12,0.2899
OC1C2CC(O2)C11CO1,0.2916
N=C1OC2(CC2)C11CC1,0.2689
O=C1OC=NCC1C#C,0.2343
c1nc(=O)nc(o1)C#N,0.1814
C1C2N1CC1=C2C=CN1,0.232
CN1C2C3C2C1C3CO,0.2789
CC12OC1C(=O)C2CO,0.2103
OC1C2NC1(C#C)C2O,0.264
CC12CC1CC(=O)C2O,0.2224
CC12OC1CN=C2N,0.2488
c1c[nH]nc1C=O,0.2005
COC(C=O)C1(O)CC1,0.2068
Cc1nc2c(o1)NCC2,0.2057
CCC1OC(C#C)C1C,0.2755
CCCC(O)C(N)=O,0.2781
CC1OCOC1CC#C,0.307
CC(=O)C1CC(O)C1O,0.2268
CC1CCC2CCOC12,0.3126
CC1(C2(CC2)N=CO1)C,0.2528
C(=O)Nc1c(non1)N,0.1938
O=C1CN2C(C3CN3)C12,0.2182
CC12OC1CC2C(N)=O,0.2624
N#CC1NCC11COC1,0.2631
CC1=CC2(CC1O2)C=O,0.1991
CCCC(O)CC(C)O,0.3226
CC1C2NC(=O)N(C)C12,0.2802
OCC1(CC=O)CO1,0.225
N#CC12CC(C1)C1NC21,0.2741
CC1CC23CCC2OC13,0.2966
Cc1nnn(n1)C2CC2,0.2437
CCCn1cnc(n1)O,0.244
CC(C)CC#CCO,0.2783
CC12CC3C(O1)C1C2N31,0.3177
O=CC1OCC2COC12,0.2197
CC1C(C)N(C=O)C1C,0.2608
C(=O)NC(=O)C(=O)N,0.1858
CCCCN1CC1C=O,0.2099
CC1CCC2CCC1O2,0.3111
CC(=O)C(C)(C)CC#N,0.2304
CC#Cc1cnncn1,0.1565
C1CN2C3C4OC4C2C13,0.3075
CC1=CC=NOC1=N,0.1683
O=C1C2CC2N1CC#N,0.2481
Cc1c(ccoc1=O)N,0.18
CC(CNC=O)CC#C,0.2804
N=C1OC2CN3CC12C3,0.255
OC1C2OC1C21CC1,0.3187
C1COC(=N1)C(=O)C=O,0.1514
CN1C2C1C1(O)CC21C,0.2733
CC1CCC2(CN2)CO1,0.3075
CC1(C)CC2C(=O)CN12,0.2003
CC#CC12CC1NC=N2,0.2426
CC(O)C1=C(N)NN=N1,0.2276
CC(C)C(C)(C)NC=O,0.2767
N#CC1C2CC(C#N)C12,0.3095
CC(C)(C)C12CN(C1)C2,0.2847
CCC1(C)CC11CCO1,0.3014
OCC12CC1CC(=O)N2,0.266
CC1(COC1)O,0.3076
c1c(=O)c(c[nH]c1N)O,0.1962
CC1CC(O)C(C)O1,0.3029
CC1(O)CCC1(O)C=O,0.2297
CC1=NC(=N)NC(=O)O1,0.2189
COC1C(C)CC1CO,0.3125
c1c(=O)c(c(on1)F)F,0.187
CC1(C=C(CO1)C#N)C,0.2058
NC(=O)C1C2COC12,0.2635
CCC(NCC=O)C=O,0.2025
C1C2N1CC1=C2C=NN1,0.2349
CN1C2CC1C2N1CC1,0.2887
CC1COC2C3CC12O3,0.2932
CC(CC#N)C1CC1,0.3287
O=C1OCC2CC=CC12,0.2485
CN=C1NC=NC1C=O,0.201
CN1CC(C1)(COC)O,0.2809
OC1C2(O)CC2C11CC1,0.3005
CC1CC(O)C=C(C)C1,0.253
CCc1ccnn1C,0.2549
N=C1OCCOCO1,0.2929
C1C2OC2C2=C1N=NN2,0.2327
CC(O)C(O)C1CN1C,0.2871
CCC1CN2C(C#N)C12,0.264
COC1(CC1O)C1CO1,0.3068
CCC(OC=O)C=O,0.2247
C#CC1CCCCOC1,0.3003
CCNC(=O)C(=O)C,0.179
C1C(CNC(=O)N1)C#N,0.2758
Cc1c(=O)[nH]cc(n1)F,0.1598
NC1=CC(=N)OC(=O)O1,0.21
OC1CC(C=O)C=C1,0.2134
CCC1CC1(C)C(N)=O,0.2764
NC1C(OC1C#N)C#C,0.2415
N=C1OC(=O)C2COC12,0.2489
C1OC2OC1CC=C2,0.2495
CC12OCC1=CC1NC21,0.2294
OC1CC11C(O)CC1=O,0.2105
CC1C2CN2CC1O,0.2863
C#CC#Cc1cnoc1,0.1876
CC12CCC3OC1C23,0.3105
COCCc1ccco1,0.2359
O=CC12CC=CC1N2,0.2153
CC1=CC2OC11CCC21,0.2201
O=C(C#C)C1CCOC1,0.1956
OCC1C(CO)C1C=O,0.2222
CC12CC(CO)(O1)C=C2,0.2367
O=C1C2NC1C1OC21,0.239
CCC1OCC2CC2O1,0.3337
N=C1NC=C(CC=O)O1,0.167
CCC1OC1C#CC,0.274
CC1(CC2(C1)CCC2)O,0.3227
CCC1CC(O)CC1C,0.3305
CC#CC1CCC=CC1,0.2658
CC1CC11OC=NC1C,0.2569
OC(CC1COC1)C#C,0.2669
CC(C#N)N(C)C,0.2563
COCC(C#N)C1CN1,0.2858
CC12CC3(C)OC1C3O2,0.311
CC12C3NC3C1NC2=O,0.2555
NC1=NC(COC1)C#C,0.2483
CCOC(C)C(=O)C#C,0.1976
C1OC1C1CCCCO1,0.3319
C1CC(=O)CNC(=O)C1,0.2068
CC1=CC2CC(C1)C2=O,0.2145
CC12CC1(C)CC(=O)C2,0.2228
Cc1c(noc1N)C=O,0.1646
CC1C2NC2(C#N)C1O,0.2669
CC1=CCC2(O)C(O)C12,0.2351
CN1CC(=O)NCC1=O,0.2621
Cc1c(nc(cn1)O)C,0.1945
O=CC12CC3NC1C3O2,0.2146
Cc1nc(on1)CC#C,0.2545
OC1C2OC1C1(O)CC21,0.3218
CC12CC=CC1C2C#N,0.2452
O=C1CNC(=O)C2CC12,0.2179
COCC1C(C)N1C,0.2909
CCC1COC1CO,0.3094
CCOCCOC,0.3361
OC1C2C3C4NC4C2C13,0.3092
C1CN=COCC1=O,0.2166
OCC1CCC1CC#C,0.3111
C#CC12CC=CC1O2,0.2397
N=C1OCC1C#N,0.2848
CC(O)C1(CCC1)C#C,0.2971
Cc1c2c(c[nH]1)CC=C2,0.1958
Cc1ncn(c(=O)n1)C,0.204
CN(C=O)C(=O)C1CO1,0.2171
C#Cc1ccco1,0.1969
Cn1c2c(cco2)cn1,0.2236
c1c2c(cn[nH]2)[nH]c1N,0.2041
OC1C(O)C1C#N,0.2797
CC(O)(CO)CCC#N,0.3167
N#CC1CC=C2CNC12,0.2293
O=C1CC(O1)C1CN1,0.2587
O=C1NC=CC1N1CC1,0.2096
CN1C(=O)CC=C1C#N,0.177
C#CCCN1CCC1=O,0.2759
CC1(CO1)C#CC#N,0.2289
CC1C2OC(C)C12C,0.3102
C1COCOCC1=NO,0.2474
c1c[nH]c(=O)nc1O,0.1967
OC12COCC1NC2=O,0.2626
C(#N)c1c([nH]nc1N)N,0.2185
c1cc(ccc1C#N)N,0.1914
CCOC1(C)CC1C#N,0.3017
N=COC1COC=NC1,0.2682
COC(C)C1CC1OC,0.3319
CCN=C(CO)OCC,0.2671
c1nc-2nconc2n1,0.1682
C(COC=O)C#CCO,0.2632
CC1CC(C#N)C1C=O,0.2206
O=CC1C2CN1C2C=O,0.2056
CC1(O)CC11CCC1=O,0.2079
NC1=CC(=O)CC1C=O,0.1725
CC(C)(C#C)C#CC=O,0.2047
CC1(CO)COC1=N,0.2849
N=C1CC(=O)CCCO1,0.2185
N#CC12CC3C4C(C14)C23,0.2841
CN=C1NN=CC=C1O,0.1626
OC1C(CC=O)C1C#N,0.2275
CC(C)C1CN1CC#C,0.2736
CCC(C=O)C1CN1,0.2094
CC(=O)C(CCO)C=O,0.1993
CCN=C(C(=O)C#C)N,0.1645
CC1COC(=O)C2CC12,0.2633
CC1CC2OC3(C)C2C13,0.3051
Cc1cc(nc(c1)O)N,0.2007
CC12C3CN(C13)C2CO,0.2943
C(=O)n1c(nnc1N)N,0.1663
CCC12CC1CC2=NO,0.246
CC1CC(=O)C=CC1C,0.1866
OC1CCC(NC=O)=C1,0.2135
CC1=CN(C(=O)CC1)C,0.2064
c1nc(nn1C2CC2)N,0.2269
CC(C#N)C1(N)CC1O,0.2802
CC1C(=O)C2NC12C#N,0.2114
CNCc1ncnnn1,0.1429
COC1C2CC(=O)C12C,0.2326
CC1C=CCOCC1O,0.2632
CC(=O)C12CC3C1N3C2,0.2199
CC12C3C=CC(C13)C2=O,0.2059
c1cnc(nc1)F,0.2149
CC1C=C(CO)CC1=O,0.223
C1CC2C3C=CC2C13,0.2321
Cc1c(non1)C#C,0.2159
C#CC1CC2CN12,0.2647
CC#CC(C)(C)CC=O,0.2157
OC1CC2OC12C#C,0.2618
c1cc(=O)occ1O,0.1617
CC(O)C(C)(C#C)C#C,0.2821
OCC1C2CC3(CO3)C12,0.3154
[N-]1[NH+]=CN=C2C=CN=C12,0.1515
OC1CCC2COC1C2,0.2903
OC12CC(C1)CN1CC21,0.2913
CCOCC(C)OC,0.3381
OC1C=C(NC1=O)C#C,0.1833
CC(=O)c1c(cco1)O,0.1785
CNc1cocc1C#N,0.1872
CC1OC(=O)C(C)(C)O1,0.2736
CCC1N=COC11CC1,0.257
CC1C2(CN2)CC1(C)O,0.304
CC1OC2C3C(O)C3C12,0.2928
C1CC2CCC12,0.3476
N=C1NC(=O)CC2OC12,0.2367
CN1C2C3OC2C13C#N,0.241
CC12CCC(CCO1)O2,0.3248
OCC1=CC2OC1C2=O,0.2471
CC1CCN2N=NC=C12,0.2554
C#CC1(COC1)C#N,0.2741
OC1CC1(CC=O)C#C,0.22
OC(C=O)C(C#C)C#N,0.2209
CNC(=O)C#CC1CC1,0.2336
C1C=C(NC1=O)CC=O,0.17
CC1(C)OC1CC#N,0.3091
NC(C#N)C1=CCCC1,0.2439
CC(C)OCC=O,0.2285
CC12OC3CCOC1C23,0.2868
C(=N)NC(=O)NC(=O)N,0.2266
C1C(CO1)N2CC(=O)C2,0.2089
N#CC#CC12CC(C1)N2,0.2077
CCCC(C)CCC=O,0.2293
OC1(CCC1)C1CO1,0.3317
CCc1c(n[nH]n1)C=O,0.1964
OC12CC(C1)OC2=N,0.2871
CC(C=O)C(C)(O)C#N,0.2209
[NH3+]C1CC=CC1C([O-])=O,0.2473
O=CN1C2C3NC3C12,0.2635
CC(=NC)OCCC#C,0.2779
O=C1NCC2C3CC1N23,0.2563
COC1(CC1)CCC#C,0.307
C1CC(=C(C1)C=O)C=O,0.1601
NC1=CC(=O)C2CC1O2,0.187
OC1C2OC1C2C1CO1,0.3225
CN=C(C(=O)NC=O)N,0.1965
CC12CC3C(CC1=O)C23,0.2244
c1cc2c(cn[nH]2)nc1,0.194
CC12OC3C1COC23C,0.3133
COC(=O)C(C)C(C)C,0.2821
O=CC1NC2CC12C#N,0.2051
CCCOC1CC1(C)O,0.3134
C1C2CC11OCOC21,0.324
C(=O)Nc1c(nn[nH]1)O,0.1942
CC12C3OC1C3C2C#N,0.2747
CCC(C)C1OCC1=O,0.2232
O=C1OC2C1NC21CC1,0.238
C1C=CCNC1=O,0.2529
N=C1COC(=N)C(=O)N1,0.2127
CC(O)C1CCCC1O,0.3056
CCc1cc2n(n1)CC2,0.262
c1c(nco1)CCO,0.2431
c1cc2cn[nH]c2nc1,0.1945
CC12CC3C(OC1=N)C23,0.2724
CC1OC2CC(C#N)C12,0.2762
CC#CCN(C=N)C=O,0.2228
CC1C(C)(C)C1(O)C=O,0.2117
N#CC12CCC(CC1)O2,0.2916
CC1CC2CC12C#C,0.2697
c1c(coc1C(=N)N)N,0.184
OC12CNC1C2NC=O,0.2542
CCCCC1CC1OC,0.3327
OCC1OCCC(=O)O1,0.2697
CC12COC1C2(O)C=O,0.2184
CC1(C)CCC(O1)C#N,0.2956
CCC1CCC1NC=O,0.2776
CC1OC2CCC1CC2,0.3029
CC12CC1C(O)C2CO,0.2982
COC1C2NC1(C)C=C2,0.2208
CC1CC(=O)NCC1O,0.2648
[NH3+]C(C(O)C#C)C([O-])=O,0.2532
CC#CC1C2CC2C1=O,0.2156
N=C1ON=CC(=N)C=C1,0.1804
CC(C#C)C(C)(C)C#N,0.2999
COC12CC1CCC2,0.332
COC1CC2(C)OC12,0.3256
CCC12NC(=O)C1C2C,0.2524
CCC1NC1C#CCO,0.2661
CC(=NC)OC1CCC1,0.2742
CC(CO)OC(=O)C=O,0.1807
O=C1C=CC2C3CC1N23,0.1749
CCC(=O)OCC1CC1,0.2863
O=CC12CC1(OC2)C=O,0.1881
CC1C2N3CC3C12C=O,0.2095
C1OC11COCC=C1,0.2454
ON=C1C2CC=CC1N2,0.2356
O=CCC1C2CCCN12,0.2035
CC1CC2(C)N1CC2=O,0.2006
CCOC1(CC)CC1C,0.3246
COCCC1OCC1C,0.3276
COC(CCO)C#N,0.2893
C1NC11CCCC2OC12,0.3189
CC#CC1OCC=C1C,0.2533
OCC1COC1C1CC1,0.3102
C1CN2CC3OC(C2)C13,0.2739
CC1=CCC(=O)CC1O,0.221
CC1C=CC2NC12CO,0.2447
COCc1cc([nH]c1)N,0.2392
CCC1CCC2CC1O2,0.3123
CCCC1(C)COCO1,0.3331
CN=COCC=O,0.2204
OCC1OC2C(C#N)C12,0.2841
CC1(O)CC2CC(=O)C12,0.2165
c1c2c(on1)OCCC2,0.2312
CC1C2C3NC3C1C2O,0.2905
FC(F)(F)C1CC2CC12,0.3505
CC1(O)C2NC(C#N)C12,0.2443
CC(=O)C1CN1C1CC1,0.2057
OCC12C(O)C3C1CC23,0.3128
COC(C)C#CC(C)C,0.2875
O=CNC(C=O)C#C,0.2133
OCC(=O)C1(O)CC1O,0.2099
COCC1C=CC2CN12,0.2319
CC1CC(C)(O)C=C1C,0.2543
O=CC(CCC#N)C#N,0.2296
CCCCCC1CO1,0.3532
CC1COCCOC1=O,0.2493
CC1CC=CC2(C)CC12,0.2457
COCC1OC1CCO,0.3301
CCCCC(OC)C#N,0.3043
OC1C(CC1C#N)C=O,0.2295
CCC1CC(C1)C=O,0.2264
CN(C=O)c1cc[nH]n1,0.2189
COCC(C)OCC=O,0.2288
C1C2CCCC1O2,0.313
C1C2N1CCC21CCC1,0.3053
OC1CC2CCOC1O2,0.3392
CCCC(CO)C(N)=O,0.2712
COCCOC(=N)C#N,0.2153
CC1CCC2=CNN=C12,0.2502
CCN(CC=O)CC=O,0.1996
CN1C(CC11CC1)C=O,0.1726
CCN1C(C)C1CC#N,0.2633
O=C1COCC2CC2C1,0.2102
O=C1CC(C=C1)C1CO1,0.1927
CC(C)C(CO)(CO)O,0.3024
CCN=C(C(=O)OC)N,0.2018
CC(C)C1(C)CC(C)O1,0.3184
CC1CC(C)(O)CO1,0.3029
c1c(nc[nH]1)C2CCC2,0.2506
O=C1C2CC1COC2,0.2238
CC1(CC1(C=O)C=O)C,0.2028
CNC(=O)C1(O)CC1C,0.2685
CC1C(C=O)C2(C)CN12,0.2071
OC1C2C3OC3C1C2=O,0.2267
O=CC12NC1CC21CN1,0.2002
FC1=NOC(=O)NC1=N,0.2111
c1c2c(co1)COC2,0.2363
COC(=N)C(CO)C=O,0.223
C#Cc1cnc(cn1)N,0.1729
CCC1=CC(=O)C2OC12,0.1755
c1c[nH]c(c1C=O)O,0.1895
Cc1cc(c([nH]1)CO)O,0.218
CCC1CC2CC1C2=O,0.2298
COC12CC1C(C)C2O,0.3073
O=C1C2CC(C2)C1C#C,0.22
CC1OC23CC(C2)CC13,0.3225
Cc1c(nnn1C)N,0.2163
CC1C2C3CC(C3O)N12,0.284
OC1C2CCC3OC3C12,0.3042
N#CCN1C2CCCC12,0.2715
N=C1OCCC1N1CC1,0.2648
CC12CC(C)(C#N)C1N2,0.2933
CC1=CC=CC=C(C1)C,0.1793
CC1CN=C2NCC2O1,0.2515
CCC12CC1CN1CC21,0.2969
N=C1CC(=O)C(=O)CO1,0.1514
CC1C(O)C11COC1C,0.3005
CN1CC2OC3C1C23O,0.2646
CCC(O)C(C)CCO,0.3323
N1C2C3OC2C13,0.2929
CC1CC2C1N2CC#C,0.2854
c1cn[nH]c1NCCO,0.2381
COC(=O)C1CC1C=O,0.2184
CC12CN1CCOC2=N,0.2529
OCC1CC2(OC12)C#C,0.2633
OC1CC2OC2C(O)C1,0.3299
OC12CCC1OC2,0.2989
COC1(C)C2CC1C2=O,0.2482
C(C1CC1)C1CC2CC12,0.3386
CC12COC1=NCCO2,0.2607
CCN1CC(=NO)C=C1,0.1675
OCC1OC1C#N,0.2759
CCN1C(CC1=O)C#N,0.2706
OCC1CC2OC12C#N,0.2731
CCC(CC(C)O)C#N,0.31
CC1=COC(=N)C(C)=N1,0.1626
CCCC1=CCOC1=N,0.2185
O=C1NC2CC(O1)C=C2,0.2329
CC1(C)CC1C1(O)CC1,0.3116
c1(nc(nc(n1)O)N)N,0.2528
CC1C(O)C1(O)C#C,0.2514
C1CC23CC(C2)CCC13,0.3474
Cc1c(noc1C#C)C,0.2022
COC=NCCN1CC1,0.2524
CCC1=CCC(C)C1O,0.2582
NC(=N)C(=O)C(O)CO,0.1727
C1C(=O)C(=O)C(=O)CN1,0.1257
CC#CCN=C(C)OC,0.2634
NCC1=C(N)OC(=N)N1,0.2116
CCC1CN(C=O)C=N1,0.2211
CC12C3C4CN1C2(C)C34,0.3027
N=C1OCC1NC=O,0.2713
COCC1CCC1=O,0.2161
OC1CC2(CC12)OC=O,0.2692
NC1=NCC2(O)COC12,0.2482
C1CC12C(=O)CO2,0.219
CC1C=CCCOC1=N,0.2595
O=CC12CC(C=C1)C=C2,0.2061
CCCC1(NC1C)C#C,0.2746
CC1OC1CN(C)C=O,0.2716
OCC1C2OC2C1C#N,0.2779
CN1CCC1(C=O)C#N,0.194
CCC1OC(CO)C1=O,0.2166
c1cnnc(n1)C=O,0.1552
C#CC1CCC1C1CC1,0.3002
CN1C=NC2CC2C1=O,0.2208
O=CC1OC1(C=O)C#N,0.1845
CCC1C2CC(O2)C1C,0.325
OCC1C(O)C1C1CC1,0.2952
CC12NC1(C)C1C(O)C21,0.3159
CC1COC11CC2NC12,0.3001
COC1C(O)CC1(C)C,0.3107
CC1OC2C=CCC12C,0.2499
O=C1OC=C(O1)C1CO1,0.2359
CC12C(CO)C1N1CC21,0.2824
CN(C=O)C(C#C)C#N,0.2593
OC12CC(=O)C1C1NC21,0.2069
CC(=O)COCC1CN1,0.2206
c1c(nc[nH]1)OC=O,0.2349
C#Cc1c(nc[nH]1)CO,0.2045
CN1C(=N)OC=C1CN,0.2096
COC12CC(C)(C1)CC2,0.3235
COCCc1cnc[nH]1,0.2494
C#CC1OCCC11CN1,0.2785
CC1CC1C1=CNN=C1,0.248
c1cnc(c(c1O)F)F,0.2377
c1ccc(cc1)N,0.2077
c1cnc-2[nH]cncc12,0.1555
C1Cn2c1c(nc2O)N,0.2243
O=C1CC2CCCC2=C1,0.1949
O=C1CC2CC2C(=O)C1,0.2147
N#CC1C2CC1O2,0.2761
C#CC1C2CC3OC2C13,0.285
C1OC1C1C2OC1C=C2,0.2362
CCC(=NO)C1NC1C,0.25
C1CC1(C#CCC#N)O,0.2657
CC1CCC1C(=O)C=O,0.153
CC(O)C1=C(N)OC=N1,0.2164
CCC1C2CC1C(C)=C2,0.2381
C1C=CC(=O)C(=O)CN1,0.1561
Cc1c(cc[nH]1)CC#C,0.2364
CC1NC11CCC1(C)O,0.2961
Cc1ccn(c1C#N)C,0.2072
CC(=O)C1OCC1(C)O,0.2191
N#CC1CCC2CN2C1,0.2695
CC12CC(O)C1(O2)C#C,0.2584
CC1OC2CCC1C=C2,0.2479
CC12CCC(O1)C2CO,0.3165
Cc1cncc(c1C)N,0.1994
Cc1cnoc1CCO,0.2386
CC12CCC(O1)C=C2,0.2571
CC12CC1C(O2)C(N)=O,0.2637
OC1C=CC2CC1C=C2,0.2277
CCC(C#C)C(C)C#N,0.3031
CCCC12CC3CN1C23,0.321
CC1OC2C3CC1C23O,0.2899
CC1COC=NC1C,0.2693
C#CC1C2C3CC1CN23,0.2861
N=C1OCC2CC2CO1,0.2828
c1[nH]c2c(n1)non2,0.2062
OC(C#C)C1=CNC=C1,0.2404
OCC12C3OC(C13)C2O,0.3059
C1C2OC2C2OC12,0.3201
Cc1c([nH]c(n1)C#N)O,0.1907
O=C1CCC2CC(C2)C1,0.2245
C#CCC(=O)NCC#N,0.2697
CC(CC#N)OC(N)=O,0.3082
O=CC1CC2CCC=C12,0.2113
COCC#CC1CN1C,0.2515
COCC12CC1C(C)C2,0.3273
CC1CN1C(=N)C=O,0.1742
CC(O)C1CN1C1CC1,0.2825
CC12CC(C1)C1(CO1)C2,0.3384
c1c(c([nH]n1)CC#N)O,0.2343
CCOC(CO)C=O,0.2132
CCC(CO)CC(N)=O,0.2799
c1nc2n(n1)c(no2)N,0.2345
CC12CC1CC(O2)C#N,0.2776
c1c(nn[nH]1)N=CN,0.2077
O=C1C2COC2C1C#N,0.2165
CC1CC(O)C(O)CO1,0.3235
CC#CCC(O)C(C)O,0.295
CCCC(O)CC1CO1,0.327
COC1CC(CO)C1,0.3204
NC1=NC(CO1)C1CO1,0.279
ON=C1CC2OC12C#N,0.2383
CCC1C(C)C2CC12C,0.3221
CC1(C)COC(=N)CN1,0.2472
CN1CC1C1OC1C=O,0.1978
CC(=O)C12NC1CC2O,0.2169
c1cn2cncc2cn1,0.1664
C1CN=COCOC=N1,0.2491
c1cnn(n1)C(=O)N,0.2408
CCC12C3C4C1CC2N34,0.2973
C1C2CC3=C(NC=N3)C12,0.2333
c1nc(c(n1C=O)O)O,0.1553
C#CC12CC3CN1C23,0.2692
OCC(O)C1CC(=O)O1,0.2689
CC#CC1COC(=O)N1,0.286
CN(C=O)C(=N)CC=O,0.1972
O=C1CC2COC2CN1,0.2706
CC12CC1C(CC2)=NO,0.2437
O=C1CC2OCC2=CN1,0.2057
O=C(C1CN1)C1CCO1,0.2159
CC12C3C1N1CC2(O)C31,0.2776
CC1CC(O)CC1C#N,0.3043
C1OC1C1C2CC3C2N13,0.3246
CC(O)C12CC1OC2=O,0.2742
CC(O)CC(O)CC#N,0.3069
OCC(OCC=O)C#N,0.2295
COc1ncc(o1)C=O,0.1864
CC(C#N)C1CC1O,0.3161
Cc1c([nH]c(=O)o1)CO,0.2275
CC1C2(C)C3NC2C13O,0.3044
CC12CC3(C)C4C1C2C34,0.3002
c1cn2c(c1N)OCC2,0.2165
CCC(C)C(C)=O,0.23
C1C=C(CC1=O)C(=O)N,0.2097
c1c2c(cnn1)COC2,0.1886
CC1CC2=C(N1)N=NO2,0.1762
CC1CC2(C)CC2(O)C1,0.301
CC(C)OC(=O)C(=O)C,0.1815
CC1OCOCC1O,0.3325
N=COC1CC(C1)C#C,0.281
CC1C2C1C1CCC2O1,0.3313
CC(C)c1nc(co1)N,0.2151
c1c(nc([nH]c1=O)N)N,0.201
OCC1CCC(O)C1,0.3245
OCC1NC1C1CO1,0.3136
CC1C2C1C(C#N)C2C,0.3023
Cn1c(c(c(n1)O)O)N,0.2293
NC1=C(O)C=COC1=N,0.1561
COC1=NCCC1CO,0.2797
C#CCc1ccno1,0.2446
NC1=CC(=N)NC1=O,0.1683
CC(CC#C)CC1CO1,0.3115
CCC(C(C)C)C(C)=O,0.2282
C1OC11C2CN3CC2C13,0.2995
C1Cc2c(oc(n2)N)C1,0.2269
OC1(CC11COC1)C#C,0.2668
OC1C2C(C#N)N2C1=N,0.2429
CC12CC3(C)NC3C1N2,0.2965
OCC(O)C1=NOC=C1,0.2358
C1CC23COCC2(C1)O3,0.3343
CC12CC1C(C)(O2)C=O,0.2075
[NH3+]C(C1CN1)C([O-])=O,0.2651
O=CC1CNC(=N1)C#C,0.1911
COC12CC3CC1OC23,0.3199
OC(C#N)C1NC1C#C,0.2775
CCC1CC2(CN2)CO1,0.316
CCN(C=O)C(=O)C,0.2154
O=C1CC2CC3C1N23,0.2223
CN1CC1C1CN=CO1,0.246
CC(C)N(C)CC#N,0.261
Cc1cccc(n1)F,0.2222
CC12CC(C)(C=O)C1O2,0.2158
CC1C2CC(=O)OC12C,0.2755
NC=[NH+]C1=CC=C([O-])O1,0.1063
C#CCC1(CC1)C1CO1,0.311
CC1(N)C(N)C1(C)C#N,0.2702
C#Cc1cncnn1,0.1614
CC(C)C(=O)NCC#C,0.27
NC(=[NH2+])C1=C([O-])C=CN1,0.158
CC12CC(C#C)C1C2O,0.2845
CCCOC(C)(C)C#N,0.3005
CN=C(C)OC(C)C=O,0.2255
CC(O)CCOC1CC1,0.3121
Cc1ncc(cn1)F,0.2036
C1CC(C1)CC#N,0.3408
C1CC23CC4C(OC24)C13,0.3123
CCC12CN3CC(O1)C23,0.2714
CC(O)C1=CCCC1,0.2567
CCC1CCN=C1OC,0.2793
CC1=NCCCC(=O)O1,0.2397
CCOC(C)C=O,0.2268
C(=O)c1c(nc([nH]1)O)O,0.1746
OCC(O)C1=NON=C1,0.2145
O=C1C2OC2C1C1CC1,0.2078
OC1CN(C=O)C11CC1,0.2519
CNc1c(onn1)C#N,0.1618
CC#CC12CC1C(O)C2,0.2646
O=CC12CC(C1)C1CN21,0.2165
O=CC12OCC1C2C#N,0.2062
C1C2COC3=CC=C1N23,0.1688
O=CC1NC2C1NC2=O,0.1974
OC1C=CC2OC12,0.2399
CN1CC2OC3CCC123,0.2692
CCC12CC(C1)(C2)C=O,0.2185
O=CNC1CCC=CC1,0.2672
CCC(C)(C)CC(=O)C,0.2292
CC(C)OC(=O)CO,0.2746
CCC1C(OC1=N)C#N,0.2766
OC1C2CCC1(O2)C#N,0.2694
CCCCC#CCC=O,0.2185
CCCOC1CN(C1)C,0.2958
COC=NC1CCOC1,0.2598
Cn1cc(cc1C=O)N,0.1558
CC1=C2C(O)CN2C=N1,0.2455
CC(O)C(C)OC(N)=O,0.318
CN1CC1(C)CCCO,0.3015
CC1CC2(O)C1OC2=N,0.2818
CCCC(OC=N)C=O,0.215
CC12CC1(OCC2)C=O,0.2127
CCC1(C)C2C(O)CN12,0.285
CN=c1c(cnn[nH]1)N,0.1653
CC(CO)NCC#N,0.2677
CCCC1(O)C2CC1C2,0.3271
O=C1C2CC3CC1C2O3,0.2162
Cc1c(ncn1C)OC,0.2196
CN(C=N)C(=O)C=O,0.1702
OCCC12CC3C1OC23,0.3065
CC(=N)OCC(=O)C#N,0.1866
Cc1coc2c1OCC2,0.213
O=C1CC2(CC=CC2)N1,0.2578
CN=C1OC2C(C)OC12,0.2585
COCC1(C)CC(C)C1,0.3322
CN1CC(O)C(C=O)=C1,0.1727
CCC(=O)CCC1CC1,0.234
OC1CC=CC(=O)C=C1,0.1774
c1(n[nH]nn1)N,0.2194
CC1C2C(=N)OC12C,0.2774
CN=c1n(cno1)C,0.2195
CC1CC11C2CC1O2,0.3154
CC1=C(CC(=O)CC1)C,0.2212
CC1COCC(C)C=C1,0.2593
CCn1c(c(nn1)O)C,0.2202
OC1CCC23CCC12N3,0.2802
CCCNC(CC)C#N,0.2743
N#CC1CC=CC=CC1,0.1897
CC#CC1=CCC(C)C1,0.2059
CCC1=NC(C)C(C)O1,0.2674
N=C1OC2C3CC2C1C3,0.282
COC1CC2CC12CO,0.3195
CC(C1CCO1)C(C)=O,0.2206
C1CC23OC4CC(C12)C34,0.3034
CCC12CN=C(N)C1O2,0.2464
CC1C=CC(=N)N1C=O,0.1976
CC(C)C#CCC1CN1,0.2931
N#CCC1CC2NC12,0.2863
OCC1(CN1C=O)C#N,0.2498
CC12CC(C1)C2C#C,0.297
CC1CC(=O)OC2CC12,0.2697
C#CCc1ncon1,0.2424
CC1C2C(=N)OC12CO,0.2756
C1C2OC3CCCC3C12,0.3097
COC1C2OC1C2C=O,0.2007
COCC(C)C1CO1,0.3437
CC1OC1C1=CN=NO1,0.2197
NCC1(COCO1)C#N,0.2668
CCC1(O)CC(=O)C=C1,0.1867
Cc1ccoc1N,0.2209
CC1CNC1C(F)(F)F,0.3068
CC1C(=O)CCC11CO1,0.2186
c1c2c([nH]c1N)COC2,0.2313
CC1(CC1C(N)=O)C#N,0.2606
CC1CC2CN2C1C#C,0.2751
CN(C=NCC=O)C=O,0.2155
CC1C2CC(OC=N)C12,0.2813
CCOC1CC1(C)C,0.3319
N=C1CC(=CCO1)C#C,0.2086
N=COCC1(CN1)C#C,0.2593
OC12C3COC1=NCC23,0.2124
CC12OC3CC1(O)C23,0.282
CC1C2COC2C2CN12,0.29
O=CC1N2CCC12C#C,0.1973
CNc1nccc(n1)N,0.2018
O=CC1C2C3C1C2C3=O,0.2106
C(C#CC1CN1)C1CN1,0.2629
Cc1coc(n1)CO,0.2415
CC1N=COCCC1=O,0.2112
COC1(CC1)C#N,0.2923
N=COC1CN(C1)C=O,0.2583
c1c(c(c[nH]1)O)NC=N,0.2142
CC1=C2C3C4C(C1)C2N34,0.1574
O=CC1NC2C3OC2C13,0.2041
CNc1cc(c(o1)O)O,0.2129
CC1C2OC2(C)C1CO,0.3171
CC1COCC(=N)OC1,0.2762
CC1=CC2C3OC2C3C1,0.2415
NC(CC(N)=[NH2+])C([O-])=O,0.2541
COC1CN2CC(C)C12,0.2706
OC1C2CC11OCC1C2,0.304
CC(O)C1COCOC1,0.3246
CC(CCC1CC1)C#N,0.3237
C1CN=C(OC1)CO,0.2751
O=CCC1C2OC1C2=O,0.2255
CC1CC1CCO,0.3424
COC1CC2OC2C1,0.3281
NC1=CNC(O)=NC1=N,0.1884
Cc1c([nH]c(=NC)o1)N,0.2245
CC(=O)Oc1ccc[nH]1,0.1892
CC1CC1(C)C1COC1,0.321
CC(C)C12CC1C1NC21,0.2816
[NH3+]C1(C(O)C1O)C([O-])=O,0.2675
COC1=NNC(=N)N=C1,0.1362
C#Cc1cnc[nH]1,0.208
CC1(CC1)OC(=O)CO,0.2725
CC1(NC1C#N)C1CO1,0.2864
CC1C2CC(O2)C1C=O,0.2193
OC1COC11C2CC1N2,0.2829
[NH3+]CCC1OC1C([O-])=O,0.2603
CC(=O)C1CC2CN12,0.2179
OCC1C(NC1=O)C#C,0.2755
CC(C)CC1(C)CCO1,0.3149
CC(O)C(CO)C=O,0.2302
CC(=O)N1CCC1=NC,0.228
CC12CCC(O1)C(=O)C2,0.2144
CCCCc1cnno1,0.2337
CC1=CC=CC(=O)OC1,0.1785
N=COC1=CNN=N1,0.2248
CC1C(CCC1=O)C#N,0.2201
C1CC(=O)C2(C1)CCC2,0.2161
O=C(CC1CN1)C1CC1,0.2256
CC1(CCOCC1)O,0.3023
C(C#CC#N)OCC#N,0.2319
C1OC1C1OC2CCC12,0.303
CC(O)C1C(O)C1C#C,0.2857
ON=C1C2NC3C2OC13,0.2305
CN1C2CC(C12)C(C)=O,0.2234
O=C1NC23CCC2C1C3,0.2475
[O-]C(=O)C12CCC1[NH2+]C2,0.2557
CC1COC1C1CC1,0.3227
CC1CN2C1C(C)C2=O,0.2342
C1OC1C1COC11CC1,0.3055
OC(C=O)C1=CON=C1,0.21
Cc1c(c(=O)cno1)N,0.1602
CC1(OCC1O)C1CN1,0.2985
OCC1(COC1=N)C#N,0.2739
CC1=CC2CN2C1CO,0.2323
CC1COC(=N)C1(C)C,0.2873
CCC#CC1(CC1)C,0.2838
N=C1NC2CC(=O)OC12,0.2514
CN1CC1C1CCCC1,0.2957
c1cocc1CC=O,0.2063
COC(=N)OC(C)CO,0.3027
N=C(CC#C)OC=O,0.242
CC(C#N)C#CC(C)=O,0.2066
OCC12CC1CCCO2,0.3095
CC1(C)C2OC(CO)C12,0.3052
COC1CC(=O)C11CO1,0.2023
COC(CO)C#CC=O,0.2036
COCC(C)C#CC,0.3057
CCCOc1cn[nH]n1,0.2337
CC12CCC(C=O)C1N2,0.2191
CN=c1cncncn1,0.1604
CC12OC3C1CC23CO,0.2955
O=C1C=CN2CC12C#N,0.1918
CC1(CO)CC1C1CC1,0.3198
CCCNC(=O)N1CC1,0.282
CCC1C2CC(C)C12,0.3323
C1C(=O)NC(=O)N1C=O,0.2306
C1OC11CCCC2OC12,0.3372
C1C(CNC(=O)N1)O,0.2916
CC12CC(C1)C1OCC21,0.3211
CC1CC2CCC2(C)O1,0.3121
c1c(c(n[nH]1)N)C#N,0.2094
Cc1c(c(co1)N)N,0.2236
CC1=CC2CC2C(=O)N1,0.2111
CC1(C)C2CC2C11CO1,0.3351
CC12CN3C4C1C4(O)C23,0.2873
OCC(O)C(O)CC#C,0.3039
C#CC12CC1(NC2)C#N,0.2182
COCC1(O)CC1C,0.3211
CC1CCC=C1C=O,0.1938
O=C1C2CCC1O2,0.2354
OC12CCC1C(=O)CC2,0.2173
FC1=CC(=N)OC(=O)O1,0.2228
OC1COC11COC1=N,0.2657
NC(=O)C1CCC1C=O,0.2034
CC1N(C)CCOC1=O,0.2435
COC12CC1OCC2=O,0.2042
OCC(CNC=O)C#C,0.2784
Cc1cnn(n1)C,0.2501
CC1=CNC=NC1=N,0.1932
CC1CN(C1)C(=N)C=O,0.1612
CC1(C)C2CCCC12O,0.3061
CC1=C(CO)CC2NC12,0.2379
CC(=N)OC1=NOC=C1,0.245
Cc1cnoc1N(C)C,0.2126
CC1C(O)C2OC(=N)C12,0.2778
c1cnn2c1CC2,0.2683
CCC1=CC2NC1C2=O,0.233
OC1C2CC1N1CC21,0.2935
O=C1CC2C(O1)C2C#C,0.261
CCC1CC1C(C)(C)O,0.3265
CC1C2C=CC3(CC3)C12,0.2329
OCCC12COC1CN2,0.2782
CC1OC2C1C2C(N)=O,0.2632
OC1CC2CC1C21CN1,0.3134
CNc1ccc(=O)oc1,0.1517
C1C(=O)CN=C(N1)CO,0.2033
CCCCC1=CCOC1,0.2484
CC(C#CC#C)C1CC1,0.2305
Cc1cnc(cn1)C#N,0.1899
CC(C)C1OCC1C,0.318
NC1=NOC(=N)C(F)=C1,0.1628
CC1C(CC11CN1)C#N,0.285
CC1(C)N2CC1(O)C2,0.309
CCC1(CN1)C(=O)C#C,0.1933
O=CC1=CC2OC1C=C2,0.1673
C1OC1C12CC3C1N3C2,0.3091
O=C1CC2(COC12)C#N,0.2009
Cc1[nH]c(c(n1)N)C#N,0.1908
NC(C#N)C1(CO1)C#N,0.2787
Cc1c(n(nn1)C)O,0.2402
C#CCc1cc(oc1)N,0.2211
c1c2c([nH]c1N)nc[nH]2,0.199
COc1cnoc(=O)n1,0.1877
O=C1CC2C(NC12)C#N,0.2028
[O-]C(=O)C1=CC[NH2+]C1,0.1468
NC1=C(N)C=NC(=O)O1,0.1765
OC1C2CC1C(=O)C2,0.2249
CC1OC2CCOCC12,0.3155
CC(C#N)C1=NC=CN1,0.2484
COCC1CCOC1C,0.323
C1CC1C1C2CC=CC12,0.2431
C#Cc1c(n[nH]n1)N,0.1973
CC(OCC1CC1)C=O,0.2262
OC1C2CCC2C11CO1,0.299
O=C1NC2CC3C(C2)C13,0.2686
CC12COC1(CO)CO2,0.2952
CC(C(O)CO)C1CC1,0.3161
CC12CC1(CO2)OC=O,0.242
CC1=CC2COC1C2,0.2491
CC1(C)C(O)C1CO,0.3
N#CC1COC2(CC2)C1,0.2839
CC1CC2NC12CC=O,0.2035
C(C=O)C#CC=O,0.2012
O=C1C2[NH2+]CC2[C-]1C#N,0.1653
CC1C2CCC1(O)C=C2,0.2587
Cc1c(nnn1C)C=O,0.2038
CCc1ccc(cn1)O,0.2046
OC1CCNC(C1)C#N,0.2797
CC1(O)CC1C(O)C#N,0.2812
CC1(CC2CC12)C1CO1,0.3428
OC1CC2=C(C1)C=NO2,0.2328
Cc1c([nH]nn1)CC#N,0.2483
CC12NC1CC(=C2)C#N,0.205
CC1C(O)C2OCC=C12,0.2393
c1c(c2cnoc2[nH]1)N,0.1978
CNc1ncc(n1C)O,0.2345
CC12COCC1(O)C2O,0.2783
O=CC1CNC(C=O)=N1,0.1603
CN=COC(C)CC#C,0.2726
CC12CN3C(CC13)C=C2,0.2217
CC1CCC2(C)CC2C1,0.3346
CC1(Cc2n1ccc2)C,0.2518
N=COC12CN3CC1C23,0.2465
CC(C#C)C1=CNN=N1,0.2513
CCC(CO)(C=O)C=O,0.1994
C1C2CC3=C(NN=C3)N12,0.2419
CC1C2C3N2C1C3(C)O,0.3091
c1c(c([nH]c1N)C#N)O,0.1927
CCC12C(O)C1CC2C,0.3155
Cc1c(cc(o1)N)NC,0.2104
C1OC1C12CC1C=CC2,0.2469
CC12OC3C1NC2C3O,0.291
CC1C(CO)N1C,0.2823
CC1OCC(=N)O1,0.2903
CC(C)C(=O)C1(C)CN1,0.2264
C#CC(=O)c1cnco1,0.1815
CC1CC2OC2(C1)C=O,0.219
CN1C=NC(=N)C(N)=C1,0.1822
CNC1CN2C=CN=C12,0.253
O=C1CC2CCC=C2C1,0.2122
CCc1c(cco1)NC,0.2067
CN1CC2C=CC1C2=O,0.2071
CC(=N[O-])C1=[NH+]C=CN1,0.1397
CC1CCCC(CO)=C1,0.2586
CC1C2CC3C(O)C3N12,0.2763
CCC(CO)C#CC#C,0.2305
C#CCN1C2C3OC2C13,0.2649
NC1=CC(=O)C(C1)C=O,0.2005
CC12OCC1C2OC=O,0.2625
CC1C2CC(C)(O2)C1C,0.3221
N=C1NC=NC1C1CO1,0.2265
CC1(OCC(CO1)O)C,0.3121
OCC12C3C4CC1C4N23,0.3057
O=CCC12OC1C1OC21,0.2153
FC1=NC(=N)C(F)=CO1,0.2102
CNC(=O)N(C)CC#N,0.2735
[NH3+]C12CC1C(C2)C([O-])=O,0.2544
CC1CCCC(=O)OC1,0.2627
C#CC1CCCC=C1,0.2617
O=CC1C2C3CC3N12,0.1991
CC(C)C1=NOC(=N)O1,0.2447
OCC1=NCC(O)CN1,0.2588
C1C=C(NC(=O)N1)C=O,0.1618
N=C1N=NOC=C1C#C,0.1438
OC1CCCC(=O)C1,0.2233
CC(=N)OC(C)(C)C=O,0.2256
Cc1cnn(n1)CC#C,0.2488
CC1C(OC=O)C1C=O,0.221
CN(C)C1=NOC(=N)O1,0.2515
CC#CC12CC3OC1C23,0.2572
CC12CC(O)C1(C)N2,0.2943
NC1(CCC(O)C1)C#N,0.2935
CN1C2C3OC(=O)C1C23,0.2232
CC12CCC1C(O)CC2,0.3189
CN=C(C#N)OC(=O)N,0.221
C1Cn2c1nc(n2)C=O,0.1966
OCC1=NCCC2CN12,0.2412
CC1CC=C2CCC2C1,0.2555
C1CC1C1C=CC2OC12,0.2451
O=C1OC2CC(C2)C=C1,0.2138
CC1=CCC(=O)NC1=N,0.2158
NC(=O)OC1CC2CC12,0.3183
CC1CC2OC2(C)C1=O,0.2096
CC12C=CCC1CC2=O,0.2063
CC1CC2(C1)CC(O)C2,0.3332
CC1(O)CC(=O)C1CO,0.2188
OCC12NC1CC1NC21,0.2792
CC1C2CC1C(CO)O2,0.3226
CC(CC#C)OCC#N,0.2788
CCC(N)(CC#C)C#N,0.2861
FC1=CC(=O)N=NO1,0.2092
OC1CC2C3OC3CC12,0.3182
Cc1c(cn[nH]1)O,0.2306
C#CC12CN1C=NC2,0.2401
CCC1C(C)COC1=O,0.2718
c1cnc(=O)cnc1O,0.1652
CCCOc1nnon1,0.2185
FC1=COC(=N)C(F)=C1,0.1621
CCC(=O)CN1CC1,0.2166
CC1(O)C2CC3CC2C13,0.3264
CCOC12CC1CC2O,0.3135
CC1C2C3CC(C)C2C13,0.3795
OC1CC11CC2OC12,0.318
OC12C3C1N1C=NC2C31,0.2114
OCCC1OCC=C1,0.2495
CC1=CC2OC1C21CN1,0.2316
C1CC2(O1)C1C3CC1C23,0.3248
CC1C2C3OC(C23)C1O,0.2966
CNC(=O)OCC1CO1,0.3151
NC12CC(C1)C2(O)C#N,0.2683
C1C=CC(=O)NC(=O)N1,0.1987
C1OC2=NCCOCC12,0.2635
COC1=NC(=N)C=CO1,0.2119
CC1(O)C=CC2OCC12,0.2436
OC1CC11CCC1C=O,0.2195
CC1C2OC1C2=NO,0.2552
CCCC1(CC1)C1OC1,0.3469
NC1=C(CC(O)C1)C=O,0.1821
CC12OCCC1OC2=O,0.2547
CC1C2COC11CCC21,0.3005
CC1C2C(O)CCC12C,0.3228
C1N=C2NC=CC22NC12,0.1896
CCC1COC(=O)N1,0.3107
C#CC12C3CC1C1C3N21,0.2492
CC1(CCCC1)O,0.3274
CC(=O)C(CO)CCO,0.2265
OC1(C=CC2OC12)C#C,0.234
O=CC1CC(=O)O1,0.2263
O=CC1(CN1)C1COC1,0.2037
OCC1OC2CNC12,0.2896
OC12C3CCN=C1OC23,0.1933
OC1CC11OCOC1=N,0.2568
OC1C2C3C1CC23C=O,0.225
CN=C1OC2C3CC1C23,0.2641
CC1C2N=CNC=NC12,0.2033
C#CCC12CC3CC1N23,0.2954
CC1(CC(CO)C1)C=O,0.2278
OC1C2C(C=O)C2C1O,0.2159
c1cnc([nH]c1=O)N,0.1962
CC1N(C)C1(CO)C=O,0.2028
OCC1C2C(O)C1C2=O,0.2413
c1c(cn2c1OCC2)O,0.2266
COCC1(CN1)COC,0.3147
CC1C(CN1C)C#N,0.2594
O1C2C1C1C3C4C2C4C13,0.2879
COCC1(O)CC1(C)O,0.3004
c1nc2n(n1)C=CCN2,0.1896
O=C1CN2CC12C1CC1,0.2197
CCC1OC2C(C#N)C12,0.284
C(CO)NCC(=O)C#N,0.1645
CC1(CO1)C1=NC=NO1,0.2443
CC1(O)C2CC1C1OC21,0.3226
CNc1noc(=NC)o1,0.2535
CC(=NO)C(=NO)C#C,0.1792
CC1C2C3CC(O)C2C13,0.3379
CC([NH3+])(C1CN1)C([O-])=O,0.2617
CCOC1C2CCC1O2,0.3232
OC1C2CC2C1(O)C=O,0.2203
CC1=C(O)N=NOC1=O,0.1697
O=COC1CCOC1=O,0.2576
CC1(O)CC1(C#C)C#N,0.2618
CC1NC2C1=CCC2=O,0.2108
C#CC1(CCC#N)CO1,0.2861
CC1C2OC1C2N(C)C,0.2902
CCCNc1ccon1,0.222
CC1=CC(=N)OC1=O,0.1983
CC1OC23CC(C2)C13,0.3026
O=C1OCCCC11CO1,0.251
O=CC12C3C(CN13)C2=O,0.197
COC1CCC1OC,0.3154
CC12OC1C(CO)C2O,0.3012
OC12CCC1C(C2)C#C,0.2872
CC1(O)COCC1=NO,0.2504
N=CN1C(CC1=N)C#C,0.2246
CCC1C2CCCC12,0.3351
O=C1C2CN2C11COC1,0.2141
CCC(C)C(C=O)C#C,0.219
C1CC(O1)C1=NOC=N1,0.2263
OC1COCCC(=O)C1,0.2237
CCN1CCNCC1=O,0.2467
C#CC1CN2C=NC=C12,0.2496
CC1C(C)C2C3CC3C12,0.3013
CC1CCC(CO)CC1,0.3391
C1C2OCC3COC3C12,0.3013
CC1(CC1)C(O)C1CN1,0.3014
C1CC1(CCC=O)C=O,0.2204
Cc1c[nH]c(c1CO)N,0.2229
CC1C2COC3CC2C13,0.3135
Cc1cc(ncn1)OC,0.2323
O=CN1C2CC1C1CC21,0.2646
CC1=CC(=O)NC(=N)O1,0.2086
CC1CC(=O)C=C1CO,0.1935
CCC(CCC#N)C=O,0.2243
Cn1cc(cn1)COC,0.2531
C1C2OC3=C(C=CN3)C12,0.2317
CC1C2C3CC2(C)C13,0.3751
CC1C23COC12CCC3,0.2889
CC#CC1(CCO)CO1,0.2775
O=C1CC2C3C=CN1C23,0.1973
ON=C1CC(O)C2CC12,0.2454
OC1(C2C[NH2+]C12)C([O-])=O,0.1826
CC1(C)CCCC1CO,0.334
CC1CC=CC(C)(O)C1,0.2661
CNc1ccn(n1)C,0.2205
c1c(nn[nH]1)CC(=O)N,0.2508
CC(C)C(C)NC(N)=O,0.3011
CC(C)(COC)OC,0.3285
CC1C(O)C11CCC1O,0.305
CC1=CC2NC2C2OC12,0.2377
CCCC(CC)C#C,0.3143
CC1CC2(CN2C)CO1,0.311
N=C1ON=NC=C1C#C,0.1473
CC(C)(O)C1(C)CO1,0.3367
NC1=NC2(CC2O)CO1,0.2562
CC1OCC1(C=O)C#N,0.212
C1CC2C=CC3OC1C23,0.2441
CC1=CC2(C)C3OC1C23,0.2243
c1cc(c(cc1O)N)O,0.1943
N=C1OCC=CC2OC12,0.2232
CC#CC(N)C(C)C#N,0.2703
CC12CC3OCC1C3O2,0.3207
OC12C3CCC(C13)C2=O,0.2415
NC1(C#N)C2C3NC1C23,0.2684
CC1CCCCC(C)C1,0.374
CC1=CC=C2C(O)CN12,0.2335
CNc1cc(cnc1)F,0.1919
c1c(nc(cn1)O)N,0.1855
C1CC2(OCC=C2)C=C1,0.235
N=C1OC2C3CC2C1N3,0.252
ON=C1COCOC1=N,0.2108
OC1CC2CC2C(=O)C1,0.225
N=C1NC(=O)C2CCN12,0.2298
CC#CC1OCC1C#N,0.268
N#CC1CC(C1)C#N,0.3194
OC1C2CN2CC1C=O,0.219
C1C2CC3CC(CO3)N12,0.3055
O=CN1CC(C#N)C1=O,0.2178
CC1OC2C3OCC1C23,0.2992
COC1(C)C(C)OC1=O,0.2538
OC1C2(O)COC12C=O,0.2146
CC12C3N1C1C2OC31C,0.3067
CCC1CC(CC#N)O1,0.2919
C#CC1C2OC2C2OC12,0.3039
OC1C2OC2C2CCC12,0.3185
Cc1[nH]cc(n1)C#C,0.2185
CCC1(C)CCC(=O)O1,0.2785
CC(C)C1CC(C1)(C)C,0.3561
CCCC1(C)OC1C#C,0.2787
O=CC12CC(C1)O2,0.2091
CN1C2CC1(C)C2=O,0.2486
CN=C1C=CC(=O)N1C,0.1677
COC12CC(C1)CC=C2,0.2529
CC12CC3CC(C1)C23C,0.3288
COc1coc(n1)CO,0.2171
N=C1NCC2=C1N=CO2,0.2167
Cc1c(=O)nc(on1)N,0.192
C1OC2C3C4C(CN34)C12,0.2995
CC1CC(C)(O)C(C)=C1,0.2607
C1OCC2OC2CC=C1,0.2453
c1c(nc(o1)N)NC=O,0.2037
CCC(=O)C(O)C1CO1,0.2327
C1C=CC2C3NC3CN12,0.2261
CC1=CC2OC1C21CC1,0.2295
C1NC1C1=NC=NN=N1,0.1632
CC(=O)CCO,0.2348
N#CC12CCC(CO1)C2,0.2838
CC#Cc1ccnn1C,0.2085
C1C=C2COCC3C1C23,0.2321
Cc1ccc(nc1N)F,0.2022
OC1C=C2CCN2C1=O,0.2013
CC(C)(CO)C(=O)N,0.2765
Cc1nc([nH]n1)CO,0.2672
O=C1C2C3OC(C23)C1=O,0.1492
CC1=CNC(=O)C1C=O,0.1857
CN(C)C(CO)CC#N,0.2582
OCC1C2CCC1OC2,0.3039
CC1C(OC1=O)C(C)=O,0.2267
CC12C3CC(OC1=N)C23,0.2762
CN=C1NCC1(O)C#N,0.2372
NC1C2CC1(CO2)C#N,0.2613
CC1COC2CC2CO1,0.3114
CC1CCC11OCC1=O,0.2196
C1OC2C3C4OC3C24O1,0.2987
C1C2N3CC22CC=CC132,0.2159
N#CC1=CC2CN(C2)C1,0.1861
CC(C#N)(C#N)NC,0.2473
CCC1CCC11CC1C,0.3341
CCC#CC(C)O,0.2904
CC1=CCC2CC1C=C2,0.231
O=C1N2CC2C2CN12,0.2392
c1cn[nH]c1CCC=O,0.2078
COC1CC1(O)C#CC,0.2559
CN1CC(=NO)C=C1,0.1695
OC12CC3OC1C23C=O,0.1984
CC(O)C1(C)CC2OC12,0.3175
CC1CC2NC2C1C#N,0.2936
CCCCC(O)COC,0.3296
CC1CC(C=O)C11CC1,0.2203
CC(O)C1C(C)C1(C)O,0.3143
C1CC23CC(C=CC2)C13,0.2402
CC1=C(CC(=O)C1)C=O,0.1838
OC1C2COCC2C1=O,0.2158
CN1C2CCC(CO)C12,0.291
OC12COC1COC2,0.3114
OC12CC3C1NC23C#C,0.2591
CC(O)C12CC1C(C)C2,0.3177
C1COCC=CC1=NO,0.1929
CC1CC2(CN12)C(N)=O,0.2565
O=CNC1C2NC1C2=O,0.233
CC12CC3C4C1C2CN34,0.3122
O=CC1(CCC1=O)C#N,0.2004
O=C1OCC1CC1CO1,0.2747
COCC(O)C=O,0.2275
CCC1CC=C(C)C1=O,0.1937
Cn1cc(c(c1O)N)O,0.2106
C1OC23CC(OCC2)C13,0.2893
CCC1CC(=O)O1,0.2862
C1CC1C1CCC=C1,0.2636
NC1=NOC(O)=NC1=N,0.2011
COC(C#C)C(C)C=O,0.2246
CCC1(C)C(C)C1C#N,0.3084
NC1=CNC(=N)C(=N)O1,0.1724
CCC(O)C#CC(C)C,0.2865
CC1OC2CC1NC2=O,0.25
CCC(CC)OCCO,0.3304
CC#CC1CCC1(C)O,0.2913
CCOC12CC1OC2,0.307
O=C1OC2COCC12,0.2738
COC1(CC2NC12)C=O,0.2036
OC1C2CC1C(O)CO2,0.3057
C(C(C#N)(C#N)N)O,0.2742
CC(=O)CCCC(=O)N,0.2287
CC1C2C1C1OC2C1=O,0.2396
O=C1C=C2C3C4C3C1C24,0.1498
COc1cc[nH]c(=O)c1,0.1902
CN=C(C(=O)N)NC=N,0.1953
C1C=CC(=NCC=O)O1,0.1974
CC(CCO)OC(N)=O,0.3199
N#CC1CC1C1CCO1,0.2937
OC1C2C3C2C2(CC2)C13,0.3299
O=CCC1CCC=C1,0.2232
CC1CC(CO1)NC=O,0.2773
OC1C2CC=CC(=O)C12,0.182
CC1NC1CNCC#N,0.2693
[NH3+]C1(CCOC1)C([O-])=O,0.2708
CC1NC11CC(=O)C1,0.2162
CCC1(CO1)C(O)C#C,0.2821
CC[NH+]1CCC1C([O-])=O,0.2578
CC1(CC(C1=O)(C)C)C,0.2117
c1cncc(=O)[nH]c1=O,0.1504
CC#Cc1c(ocn1)C,0.21
CC1=NC(C#C)C(=N)N1,0.2314
CCC1CC1(C)C#CC,0.2853
CC#CCOC1(CC1)C,0.2852
c1(nc(no1)O)N,0.2517
C#CC12CC3C(CC1)N23,0.2717
c1cc(oc1)CCO,0.2359
N=COC1=CNC=N1,0.2307
CC1C(CC11CO1)=NO,0.2468
Cc1c(cn[nH]1)COC,0.2502
c1c(=O)oncn1,0.1594
C(C#N)N,0.2855
CCCn1cnoc1=O,0.2459
OC12CC3(CC(=O)C13)C2,0.2156
CCC1(C(=O)CO1)CC,0.2214
CCC12CC1OC(C)O2,0.3283
O=CC1OCCN=CO1,0.2169
CCC12C=CCC1C2C,0.2451
C1C(CO1)(C(=O)CO)O,0.2281
CC(=N)OC1CC1(C)O,0.2778
CC(=O)CC12CN1CC2,0.2193
CC1CC1(CO)C#C,0.2913
CCC1(O)C2OCC12O,0.2682
CC1C2OC2C2NC12C,0.3036
CC12CC1(C#C)C1CC21,0.2707
C1CC=CC#CCCO1,0.1972
CNC1=NOC=NC1=N,0.1875
CC1NC11CCC1O,0.3092
CC1C2C3C(N13)C21CC1,0.3191
OC1CCC(C=O)=CC1,0.1976
CC#CCCNC(=O)N,0.2916
CC1=NC(=N)NN=C1F,0.1501
COC1COC1CO,0.3055
CNc1c([nH]cn1)C=O,0.1651
OCCC12CC=CC1O2,0.2448
CC1C2C3C1C2N3C,0.2954
CC#CC(O)CC#C,0.2824
COCCOC(=O)C#N,0.2077
CC(O)CNC(C)C#N,0.2646
CC1CCOC(C1)C#C,0.2932
COC1CC2(CC2)C1C,0.3211
CC1(CCO1)C1CN1,0.3117
CC(C)C1(NC1C)C=O,0.2217
CC12CCC(C1)OCC2,0.3137
CC1=NCC(CC#N)O1,0.274
c1c(c(c([nH]1)C=O)O)O,0.1805
CN=C1OC2(C)CC12,0.2722
OC1C2OC2(C#C)C1O,0.2526
CN1C2C1C1(C)C2N1C,0.2561
CC(=O)NC1C2CC1O2,0.2713
CC1C2C3C(CC2O)N13,0.2985
O=CCN1C2CC(=O)C12,0.2072
CN=C1C(=NO)CCO1,0.201
COC1C2CC(=N)OC12,0.2765
CCCCC,0.403
CNc1cc(cn1C)O,0.2242
CC(C)(C#C)C(=O)C=O,0.1537
[NH3+]CC1=NC(=O)N=C[N-]1,0.2037
CC12CC1(CCO2)C#N,0.279
OC1CC2(CCO2)C1=O,0.1966
CC(CC1(C)CC1)C=O,0.2251
CCC1(O)CC1CCO,0.3229
c1nc(=O)c(c(o1)N)O,0.173
CC12NC1C1OCC21C,0.2899
ON=C1CN2CC12C#N,0.2337
OCC1CC1C(O)C#C,0.2902
OC1CC2(CC2)C2CC12,0.3196
c1cnc(=O)c(=O)oc1,0.1777
O=C1COC2CC2OC1,0.215
Cc1c(=O)c(con1)F,0.1879
OC1CC2(NC12)C#C,0.2583
CC1(CO)OC1C#C,0.2747
C1OC1C1C=CC2CC12,0.2462
C#Cc1c(n[nH]n1)C=O,0.1924
C1CC2OCC=CC2=C1,0.1971
OCC(CO)OC=N,0.259
c1cnc([nH]1)CCC=O,0.2036
C1CCNC(=O)C=CC1,0.2163
OC12CCC1CCC2=O,0.2182
CC1OC1CN1CC1C,0.3026
OC1C2NC2C1C1CC1,0.3077
OC12CN3C1C=CC23,0.219
CN1CC2(C1)C(=O)CO2,0.1903
CNc1cc(=O)[nH]cn1,0.1825
CC12CCC(CC1)CO2,0.3013
CCC1(CC([O-])=O)C[NH2+]1,0.2736
CC1C2C1C1(C)CN21,0.2903
CC1CC1(C#C)C#C,0.2647
CCCNC(C=O)C=O,0.2023
c1conc1NCC#N,0.2302
CC(C)NC(=O)CC#N,0.2791
N=C1OC2COC1C2,0.2726
CC12CC3CC1C2C3,0.3439
CCCC#CC#CCC,0.2249
CC(C)(O)C(C)(O)C=O,0.2174
O=CC12C=CC3C1OC23,0.2045
CC(C)(O)C1(C)CN1,0.291
c1(c(noc(=O)n1)N)N,0.1821
N#CC1NC1CN1CC1,0.2555
CC(C)CC(C)(C)CO,0.336
C(CC(=O)C=O)C#N,0.158
CC1CN1CC1CN1C,0.3031
CC1=CC(=O)C2(O)CC12,0.19
CN=C1N(C)C2CC12O,0.2225
CC1CC2CC2CC=C1,0.2578
CC1(C=O)C2OCC12O,0.2215
c1c(c(=O)[nH]nc1F)N,0.1771
CC1(C)C2C3N2CC=C13,0.1671
OC1C2C3OCC2(O)C13,0.3006
CC1=C(N)C(O)CC1=O,0.2004
CC12CC1(CC#C)CC2,0.2966
CCC(O)C#N,0.3145
CC1OC2C=CC1C2C,0.245
c1cnccc1C(=O)N,0.2006
NC1=NC(CCO1)C#C,0.271
O=C1CNC11C2CC1C2,0.2062
CCC1CC(C)C1C#N,0.3281
O=CC12NC1CC2=O,0.2004
CCN(C)CC#CC=O,0.17
COC1CC(C)OC1=N,0.2697
CC1CC=C(C)C(=O)C1,0.1926
CC1CN2C3C4NC13C24,0.2718
CC1=CC2CC2N1C=O,0.2036
NC(=N)C1OCC(=N)O1,0.2543
CC1C=CNC(=O)C=C1,0.175
CC1(COC=N1)C#C,0.2695
OCC1CC(C1)C#C,0.303
CC(C)Nc1cnco1,0.2182
CCC1C2CC3OC1C23,0.3071
CC(C#N)C#CC#C,0.228
OCC(O)C(C=O)C#N,0.2266
C1CC2=CCCOC2O1,0.2537
COC=NC(C)C(N)=O,0.2485
CCC1C2C3CC3C12,0.2831
[NH3+]C(C#CCO)C([O-])=O,0.261
O=CC12CC(=O)C1CO2,0.2056
N#CC12CC3C(CC13)C2,0.318
CC1(C)CC1CCO,0.3393
COCC(=O)C(=N)N,0.1956
O=C1OC2COC1C=C2,0.2165
OC12CCOC3C1NC23,0.3186
O=CC1=CC2CCC2C1,0.1929
C1C2CC3(CC4OC34)C12,0.3248
CC(C)CC(C)(N)C#N,0.2998
OC1C(OC1C#N)C#C,0.2568
C1CN1CC2(COC2)O,0.3156
COC1C2CC(C=O)C12,0.215
O=C1CC2C3OC2C3N1,0.2646
OCC12C3C4NC1C4N23,0.2879
CC1CC11C2CC1C2,0.3526
NC(=N)C(=O)C1CCO1,0.1793
OC12C3N4C1CC4C23O,0.2796
CC1OCC2(CN2)C1=O,0.2046
CC12OC3=NCC1C23C,0.1622
CC1CN2C=NC=C12,0.2553
OC1CC(O)C2(CC2)C1,0.3117
O=CC1C2CC3OC2C13,0.2188
CC1(CC(O)C1=O)C#C,0.2089
NC(=[NH2+])C(CO)C([O-])=O,0.2369
CCOC1=NCC2CN12,0.2702
CC12CC3(C1)OC=NC23,0.2593
CN1CC(C)=CC1C=O,0.1874
CCC(=O)OCC(=O)N,0.2725
OC1(C=O)C2CN2C1=O,0.1913
OC1CCCC1C#N,0.2991
Cc1coc2c1CCN2,0.2153
O=CC1CCCO1,0.2188
c1coc(n1)COC=O,0.2364
OCC12CC(CO1)C=C2,0.2511
O=CNC12CC1CC2,0.2672
CC1OC2CC3C2CC13,0.3199
CC12C=CC3OCC1C23,0.2334
OCC1NC(=O)NC1=N,0.255
CC1(O)C(O)CC11CO1,0.3141
C1C2NC2C2=NC=CN12,0.2364
CC1(CO)CC1C=O,0.2277
OC12COC1C1OCC21,0.2762
CCC1(OC)C2COC12,0.3068
OCC1(O)C2C3CN3C12,0.2787
CC12NCC(=O)C1C2O,0.2002
CCN1CC1(C)CC#C,0.2803
CN1C2(C)CC1(C)C2=O,0.246
COC1C(C#C)C1C#N,0.2695
COC(=O)n1ncnn1,0.2286
C1C(CO1)N=C(CO)N,0.2589
CC(C)(C)CC#CC#N,0.2442
CC1CC2(C)CCC2O1,0.3148
CC12C(O)CC11CN2C1,0.2469
CC1C(C)C1OCC#N,0.2633
OCCC1(CO1)C1CN1,0.3183
O=CN1C=NCC1C#N,0.2273
CC1CCC=C(CO)C1,0.2615
CCC12CC(C1)C2C=O,0.2174
c1c(=O)[nH]c(cn1)F,0.1737
N=C1OCC(=O)NC=C1,0.1887
C1CC1C1CC1C1CC1,0.3179
CCOC(=N)NC=O,0.247
CC1CC2OC2C11CO1,0.3276
Cc1nn(c(=O)o1)C,0.2394
O=C1C2CCC22CCC12,0.2167
C1CC(C1)C2(CC2)O,0.3008
OCC1=CON=NC1=N,0.1657
C#CC1=CCC2CC12,0.2024
CCCC(=O)N1CCC1,0.2682
CC(=O)NC(=O)C=O,0.1581
Cc1c(c(n(n1)C)O)N,0.2493
OC1C2OC2(C=O)C1O,0.2115
CC1(O)C2CNC12C#N,0.2379
COC1CC1N1CC1C,0.288
CC(=O)C1(CN1)C#C,0.2225
C1OC2C1C=C1COC21,0.2364
C1CC2C3NC22C1OC32,0.1923
FC1=CC(F)=NNC1=N,0.1611
CN=C(C(=O)C=O)N,0.1392
c1coc(n1)C(=O)C=O,0.1426
CC12CC1C1(CN1)C=C2,0.2356
Cc1[nH]c(c(n1)C=O)N,0.1896
CC1C2C(C1C=O)N2C,0.2157
CC1=NCC2(O1)COC2,0.272
CC#Cc1nc(co1)C,0.1961
CC1OC(C)C11CC1,0.3231
CC1CCC1(C)C1CC1,0.3458
C#CC1CC=CC11CN1,0.2446
CCc1ccc(nc1)F,0.2195
CC1(COC1C=O)C#N,0.2136
CC1CC=CCOC1=N,0.2525
CC1(C)C2C(CN12)C#N,0.2717
NC1=C(OC=C1)C1CN1,0.2137
CCN1C=NOC1=N,0.2255
O=CC1OCC(=O)C=C1,0.179
CC1C2CC1N2C=O,0.2498
N#CC12CC3CN(C1)C23,0.2421
CC1=C(C#C)C(=N)OC1,0.1925
C#Cc1ccccc1N,0.1796
CCC(CC)(CC)OC,0.3244
N#CC(C1CN1)C1CO1,0.2757
CC1OCC(O)CC1=O,0.2112
c1c(nn2c1OCC2)O,0.2456
O=CC1CC(C=O)C=C1,0.2131
CC1(C)OC(=N)CC1O,0.2843
CC1CNC(CO1)C#N,0.2558
O=C1CC2C(CC12)C#C,0.2171
CCOC(=O)C(O)CO,0.2568
CC(O)C(C)(C)OC=N,0.2843
CC1C(=O)N2CCC12C,0.2365
CC(O)C12CC1C1NC21,0.277
CCC12CCC1C(=O)C2,0.2176
[NH3+]C1CC2OC12C([O-])=O,0.249
Cc1nc(co1)C(=O)N,0.2273
CC1COC1C(O)C=O,0.2164
O=CC1(CC1C#C)C#C,0.2081
C#Cc1c(ocn1)N,0.2067
CC12C=CCC1C1CC21,0.2632
c1c(c([nH]c1O)O)C#N,0.2052
CC1OCC=C(C)CO1,0.2567
CC1C2CC1(C)CC=C2,0.2535
CN1CC2(C1)COC=N2,0.2336
CC1=NC(=N)C=C(F)O1,0.2049
CC1CCC2NC12C=O,0.2151
OC12COC3OC1CC23,0.2961
C1C=CC2OC2C2NC12,0.2332
O=C1COC1CN1CC1,0.2064
NC1(CCC1C#N)C#C,0.269
CC12CC1NCC(=N)O2,0.2576
CC1(CO)C2C3CC2N13,0.3105
FC1=CNC(=N)C(F)=C1,0.1547
COC(=O)C1CC(=O)N1,0.2512
CC1CC(O)(C#C)C1C,0.2845
C#CC12CC1C1CC2C1,0.2798
c1c2c(on1)C=CCO2,0.163
OCC1CCCN1C=O,0.2673
CN1CCOC2(C)CC12,0.2861
CC1C(CO)CC1C#N,0.3009
C1C2CC3C4CC1C2C34,0.3296
CCOC12CC1OCC2,0.3148
O=C1CC2C3NC=C1C23,0.1783
CC1CC=CCC(=O)N1,0.2362
OC1CC11CCC11CO1,0.3155
CCc1cccc(=O)o1,0.1763
CC(OC1CCC1)C#C,0.2876
CCC(CN1CC1)OC,0.3134
CC1C2C(O)C1C2(C)O,0.3135
CCCC1CCC2OC12,0.3421
CCCCc1c[nH]nn1,0.2509
CCC1OCC1C#C,0.2882
OC1C2OCC1N=CO2,0.2654
CC1(OC2CC12O)C=O,0.2056
CC(C)CC1NC1CO,0.3148
CC1CC1C1CC(C)C1,0.3423
CC(C#C)C1COC=N1,0.2671
CC([NH3+])(CC([O-])=O)C#C,0.267
CC1(CO1)C1CC(O)C1,0.3169
NC1CNC1(CO)C#N,0.2652
CC(C=O)C1(C)CC1,0.2202
COc1coc(n1)CN,0.2148
OC1(CC1)C1OC1C#N,0.2661
CC1(O)C2CC3(CN3)C12,0.3078
CC1(C)N2CC1(CO)C2,0.2872
CN(CC1CO1)C(C)=O,0.2669
CC1C2NC2CN1C=O,0.2647
CC1OCC11CC1(C)O,0.3023
COC(C)C1CCC1=O,0.2209
OC12CC1COC2C=O,0.2146
CC(C)(C)C(=O)C#N,0.2059
O=CC12CC(CC1)O2,0.218
CCC1OC1C(C)O,0.3409
CC1=C(C)CC(C)(O)C1,0.2542
Cn1c2c(cn1)COC2,0.2455
C[NH2+]C(C(C)C)C([O-])=O,0.2662
ON=C1CC2CC1C2,0.2583
CC1N=C(C)OCC1O,0.2617
O=CCC1N2CC2C1=O,0.209
O=C1OCC2C(C#N)N12,0.2688
CCC1CC(C)(CC)C1,0.3526
CC1C2C3C4CC2C1N34,0.3293
c1c(cncnc1=O)N,0.1546
CC(=N)Nc1cn[nH]n1,0.2082
CCC1C(O)C2CC12O,0.3018
C1CN(C1)CC(=O)C=O,0.1345
CC12CC(=O)C3CC1N23,0.2184
OC12CCC1C2OC=O,0.2659
CC1CC2C(CO)OC12,0.305
CNC1(COC1)C=O,0.1964
CC1N=C2OCC2C1=O,0.2081
OC12C3CC(C13)C2=O,0.2364
CC1COC11CC1(C)O,0.2886
CC12C3OC1C(N)=NC23,0.2251
CCC1(CN(C1)C)OC,0.2916
c1c(c(=O)ocn1)O,0.1833
CC1C2C1C1OC2C=C1,0.2421
CC1CC11C=CCC1C,0.2441
CC(=O)CCC(O)C#N,0.2361
NC1=NOC(=N)C(O)=C1,0.1716
OCC1CN1C(=N)C#N,0.2039
NC1=C(C=CN1)C1CO1,0.2405
NC1=NOC(=N)C=N1,0.1458
CCc1c(nno1)NC,0.1824
C#CC1C2OC1C1OC21,0.2825
CNC(=O)NC=N,0.2423
OC12CC(=O)C3C1NC23,0.2118
Cc1noc(=O)c(=O)o1,0.2026
CC1(O)CC11CCC1,0.316
O=C1OC2CNC2C1=O,0.1605
CCc1cnc([nH]1)C#C,0.1986
O=CCC1C2C3CN1C23,0.2137
CCC(C)CCC#N,0.3496
c1c(nc(c(n1)N)O)N,0.1632
CCCCC(C#C)C#C,0.2952
CC12CC3(O)C(O1)C23,0.2909
CN(C=O)C1C2CC1O2,0.2645
OCC12OC3CC1C2O3,0.3277
O=CCC12CC3C(C1)C23,0.2233
CC1OC1CNCC#N,0.2712
C1CC1OC1CC2OC12,0.3193
CC1CN2C3CC12C=C3,0.2177
OCC1NC1C1(O)CC1,0.2963
CCC1OC2CCC12,0.3161
COCC1CC11CCO1,0.3057
CC(C#C)C1=CC=CO1,0.234
CCC1(CCC=C1)C#C,0.259
ON=C1C=CC(O)C1O,0.1958
CC(C)C1(CC1C)C#C,0.2924
C#CC1OC1CC1CO1,0.2801
N=C(C#N)N1CC1C#C,0.2111
CC(C)(CO)C(F)(F)F,0.3417
c1cn(nn1)C=O,0.2063
CC1(CC1O)C(O)CO,0.3133
CCN1N=C(C)OC1=N,0.2168
CC1(C)OC2OC1C=C2,0.2406
CC(C)C#CC(=O)C#N,0.1901
CC12OC1C1OC2C=C1,0.2425
CC1C(C)C1CC(C)=O,0.2329
COc1c[nH]c(=O)o1,0.2418
OCC1CCC(=O)N1,0.2747
CC1CC1C(C)(C)CO,0.3323
OCC1CN2CC2C=C1,0.2324
CC1C2C1C1C(C)OC21,0.3108
CCn1c(cc(n1)O)O,0.2537
O=C1C2CC(=O)CC1O2,0.2046
CN=CN1C2CC1C2=O,0.2256
CN1CC(C1)(C#C)C#C,0.2498
CCC(CC)CCC#N,0.3477
C1CC1(C(=O)CCO)O,0.2255
COC(C#C)C(=N)OC,0.2623
CN=c1[nH]nn[nH]1,0.1965
CC1(O)COC1C(N)=O,0.265
CCC#CC(O)C#C,0.2674
CC1C(O)C(CO)C1=O,0.2145
C1N2C3C4C5OC5C13C24,0.2856
FC1=CN=NOC1=N,0.1698
C(CO)C(=O)C(=O)N,0.1784
C#CCC(=O)NCC=O,0.2202
OC12CNC1COC2=N,0.2526
c1c(nc(o1)C=O)N,0.152
CCC12CCC3OC1C23,0.3081
OC1CCC11OC2CC12,0.3057
CC(=N)OCC(N)C#N,0.2794
CC1OC1C(C)(O)C#N,0.2958
CC1OC(C)C2NC12,0.3121
ON=C1CN2CC12C=O,0.194
N=COC1CC2CC2O1,0.2749
CC(=N)NC(=O)C#C,0.2113
c1cn(nc1C=O)C=O,0.1784
OC1=NC(=O)NC(=N)O1,0.2385
N#CC12CCC3CC1N23,0.2753
OC(C#C)C1=CNC=N1,0.2547
CC1(CCOC(=O)O1)C,0.322
CN(C=O)C1CC2CC12,0.2702
NC(=O)C1NC1C#C,0.2514
OC1COC11CC1C=O,0.2172
CC1(C)C2CN2C1=O,0.2315
OC12CC(C1)(OC2)C=O,0.2194
OC1(C=O)C2COC12,0.1994
OC1C2CC2C1NC=O,0.2621
C1CNC(=O)C=CC1=O,0.1736
C1C2C3C4CC3(C4)CN12,0.3111
CCC1C2CC1(C)C=C2,0.2396
ON=C1CC=CC(O)C1,0.251
CN1C2CCC(C#N)C12,0.2696
CCC1CC1C1CCO1,0.3256
OCC1CC(CO1)C#N,0.2973
CC1(N)C(OC1=N)C#C,0.2561
CC1NC11CN(C1)C=O,0.2651
CC(=O)C1C2OCC12O,0.212
O=C1OC2C=CC3C2N13,0.223
O=C1COCC1CC#N,0.2172
CC1C2(C)C3CC1(O)C23,0.3055
O=CC1(NCC1=O)C#C,0.1877
O=C1CC2(CC12)N1CC1,0.2256
C1CC2C3C4OC3C24C1,0.3011
CCOCCC#CC,0.305
OC1CNC(=O)C1,0.2766
O=C1CN2CC3C(O1)C23,0.2347
OC1C(O)C(C#N)C1O,0.2777
CN=c1[nH]nnc(=O)o1,0.1763
CC1(O)COC(=N)C1=O,0.184
CC1NC(=O)OC11CC1,0.3134
O=C(C#C)C1CC2CN12,0.1778
C1C2OC3C=CC1CC23,0.2352
CC1CC(C)C11CO1,0.3272
CC1=CCOC1C1CN1,0.2522
NC1=C(C=O)N=NO1,0.1819
CCC12CCOCC1O2,0.3285
CC1C2OCC12C1CO1,0.3004
c1c2c([nH]c(n2)O)[nH]n1,0.2299
C1C2OC3=C(N=CN3)C12,0.2273
C1CC(C1)CCNC=O,0.2835
CCC1C2COC12C,0.3092
N=C1OC=CC(C=O)=C1,0.1393
Cn1nc(nn1)CO,0.2452
C(C#CCO)NC(=O)N,0.2786
c1c(c(n[nH]1)N)OC=O,0.2161
CC1(C)C(CO)CC1=O,0.2182
c1c(cn[nH]c1=O)N,0.1799
CC1C2CC2C2CCC12,0.331
OC1C(C#C)C1C#C,0.2639
CCC#CC(C)C,0.3002
CCC1(C)OC11CCC1,0.3296
COCC1NC(=O)C1C,0.2816
COC12CC1C(O)CC2,0.319
O=CC1NC=NC1C#C,0.2013
OC12C3OC4C(C13)C24O,0.2686
C1C2N3C1C21CCCC31,0.2966
CC12CC1(OC2=O)C=O,0.2163
c1cocc(c1=O)C#N,0.1961
N#CC1NCCC2NC12,0.2658
C1OCC2OC12,0.3521
CC(=O)CCC#CC#C,0.2189
CN(CC#CC#N)C=O,0.2113
C(C1CC1)C1COC=N1,0.2683
N#CC12CC1OC=N2,0.2617
CC1(CC(=O)N1C=O)C,0.2189
C1NC11C2CC1O2,0.315
CC12CC3N1CC2C3=O,0.208
CC1NC1C(C)(C)C#N,0.2991
CCc1nc(c(o1)C)N,0.2068
CC12C3CCC1(O)CN23,0.2828
OCCN1CC1C1CC1,0.3145
CNC(=NCC#N)C=O,0.1579
CCC(C#CC)C(N)=O,0.2694
O=CC1CC2C3CC3N12,0.1956
c1c(nc(c(n1)F)N)F,0.1844
CC#CCC(C)CCO,0.2994
OCC1CC=C(CO)C1,0.2599
CCc1cn[nH]c1CO,0.2489
CC(O)C1C2CC1OC2,0.3084
CC12C3CC1C3NC2=O,0.2516
CCC1C2C3C=CC1C23,0.2342
COCC12COC1CO2,0.3025
CCNC(=O)NC=N,0.2558
CC1(CC=CCCO1)C,0.2455
CC(OC=N)C(=O)C#C,0.188
CC(OC=O)C(C)C#C,0.277
CCC1=NCC(=O)CO1,0.2026
CC1OC2(CC=O)CC12,0.215
COCC12CC1C1NC21,0.2822
Cc1coc(n1)C(C)C,0.2417
CC1N=CN2CC(=O)C12,0.2052
CC1(CC(=O)N1)C1CN1,0.28
NC(=[NH2+])NC1=NC=N[N-]1,0.1841
CC(=O)C12CC1CO2,0.2177
CC1CCC2CC12,0.3484
FC(F)(F)C1CCCN1,0.3094
C#CC1OC1(C#C)C#C,0.239
C1OCC2COCC1C2,0.2973
Cc1c(n[nH]n1)OC,0.2321
c1cc(oc1)NCC#N,0.2132
OCC1CN1CC#C,0.2768
COCCC#CC#N,0.2353
OC(C#C)C1(CO1)C=O,0.2081
CC(O)CC12CC1CC2,0.3046
CC12CC1N=CNC2=O,0.2252
CC1OC(C)C(CO)O1,0.3303
OC1C=CC2C=CCC12,0.2489
CC1OCC11CCCO1,0.3132
CC12CC1N=C(CO)N2,0.2353
CCC(C)CCC1CC1,0.354
CC1CC2COCC12,0.3252
N=C1COCC(O1)C#C,0.2691
CCN1CC(C1)(CO)O,0.2931
c1c2c(on1)CCC2,0.2333
Cc1c(non1)CC=O,0.2118
CC1OCCC1C#C,0.297
CC1C2C3C1C(=O)C23O,0.2368
COc1c([nH]c(n1)N)O,0.2213
NC(=O)C12CN1C1CC21,0.2464
OC12C=CC3C1CC23,0.2268
OC1C(=O)C2CN2C1=N,0.2016
CC1(O)CC11C2CN1C2,0.3058
CN1CC2CC11COC21,0.2585
CCC#CC1(O)CC1C,0.2657
OC(C=O)C1C2CCN12,0.1976
C1OC2COCC1C=C2,0.248
CC(=O)CCC(=O)C=O,0.1577
CC(C)OCC(=O)C,0.2323
c1cncc(c1C#N)F,0.2021
C1=CC=CN(C=C1)C=O,0.1409
COC12CC3(C)OC1C23,0.2965
CC12CC(C1)(C2)N1CC1,0.3154
OC1C2CC(=O)CC12,0.2282
CCCC1CC2(O)CC12,0.3277
CC#CC1COCCO1,0.2705
CNC1=NCC(=O)C1=O,0.1183
CN1CC(O)(C#N)C1=O,0.2518
NC12COC1C2(N)C#N,0.2609
CC1OC2C1OCC2=O,0.1979
c1c(c(co1)N)CCO,0.216
CC(=O)C1CN1CC#N,0.2082
CCC12CC3(O)C1CC23,0.3326
O=C1COCC2CN12,0.2297
Cc1ccc(c(n1)C)N,0.1943
CC(O)CC1OCC=C1,0.2492
CC(O)COC=N,0.2787
CC(C1CO1)C(C)=NO,0.2566
O=C1CC2(CC2)C1C#N,0.2202
CC(=O)C1OCOC1=N,0.2195
CC(CC(C)=O)C1CO1,0.2341
ON=C1C2OC2CC1O,0.2355
CCC1C2NC2(C)C1O,0.3039
CCC(C=O)C1OC1C,0.2201
CC12OC3CC1C2C3O,0.321
CC1(C)OCCC1O,0.3094
CC1NC1C1(O)CC1,0.2936
C(COCC#N)C(=O)N,0.2706
N#CCOC1CC2NC12,0.2505
CC1C2C3C2C1(O)C3=O,0.2462
c1cocc1CCO,0.2419
C1C2C3COC2C13,0.3438
NC1CN=COC1=O,0.2268
CC1C(O)C1COC=N,0.2828
CC(C)C(C#N)C#N,0.3255
CC(C)C1C2CC=CC12,0.2444
CCC(O)(CCO)C=O,0.2253
CNc1c([nH]c(n1)O)O,0.2202
CC1C2OCCN(C)C12,0.2721
OC1COC1C1CCO1,0.3103
CC1C2CC1OC(=N)O2,0.2911
CC1CC1(O)C(O)C#C,0.2718
OC1C2CC3OCC2C13,0.3074
CC12CC1C(=O)C1OC21,0.2039
CCC1CC1CC1CC1,0.3482
CCCC1C2OCOC12,0.3322
CC12C3N1CC2C3(C)C,0.3147
COCCC1OC1CO,0.3342
Cc1c(n(cc1N)C)C,0.2245
C1C2C3C4C5C1C2C5N34,0.2956
CC(C)C1(COC1)C#C,0.2922
CC1CC(C)C(O)C=C1,0.2604
CN(C)C(=O)OC,0.2995
CC1(CCC(=O)N1)C,0.2731
O=CCC1N=COC1=O,0.2165
CC1C(O)C11C2CC1O2,0.3024
CC(C)C1OCC(C)O1,0.3382
O=CC12NC3=NCC1C23,0.1702
COCC1(C)OC1C=O,0.2168
CC1C2OCC2NC1=O,0.2704
OCC1OC1CO,0.34
C1C2CC3(CCC3)C12,0.3376
Cc1c(cc([nH]1)C=O)N,0.16
CN1C(CC1C#C)C#C,0.245
CCC1(C)OCC1CO,0.3073
c1c(c(no1)N)NC=N,0.2148
C1C2C3COC4C3C4N12,0.2922
CC12CC1(CC2O)C=O,0.2172
N#CC12CC3OC3C1O2,0.2809
C(C1CO1)N1C=CN=N1,0.2571
CC1C2OC(C2O)C1=O,0.2098
CC1C2C3CC3C12CO,0.2752
O=C(C#C)C1CC1C#C,0.1906
C#CCCNC(=O)C=O,0.1749
Cc1cnnn1CCO,0.2493
ON=C1C2OC1C2C#C,0.2535
OC1C2CC(O)CC12,0.2771
OCC#CC1NCC1O,0.2618
N=C1OC2COC2C1=O,0.1722
C(=O)C(C=O)(C=O)O,0.1853
CC1(NCC1=O)C=O,0.1929
c1c(n[nH]n1)C(F)(F)F,0.2667
CCC1CCC2CC2C1,0.3378
COCc1nc(no1)O,0.2415
CCCC(C)(C#N)C#N,0.3237
C1CC2(CO1)OCC=C2,0.2444
c1cnc-2ocncc12,0.1488
CC1NC1C(C)(O)C=O,0.214
CCCC1C(CO)N1C,0.2764
CC1=CC2OC1C(=O)O2,0.2259
CC12OC(=O)CC1C2O,0.2793
CC12CC3C4C1C4C23O,0.2789
CC1C(CO)C=CC1=O,0.1932
CN1C2C3C(C2=O)C13C,0.216
CCC1(CO1)C1CC1O,0.3133
CC(=O)CC(O)C#C,0.2275
C1C(=O)CN=C1OC=O,0.2106
O=CC1COC1=O,0.2247
O=CC12NC3CC1NC23,0.1945
O=CC(C#C)C(=O)C#C,0.1797
C1CCc2c([nH]nn2)C1,0.2419
COCC1COC1C#C,0.2711
OC(C#C)C12CC(C1)O2,0.2614
c1cnn2ccnc2n1,0.1577
CC1(CC(=O)CO)CN1,0.2268
CCCC1OC1C=O,0.2193
CC(OC=N)(C=O)C=O,0.1894
C1CC11C2C3C4C3N2C14,0.2952
CNC1(CNC1C)C#N,0.2635
C#CCN=C(C=O)N,0.1884
CC1(O)CC2(OC12)C=O,0.2184
O=C1NC2CC(C2)N1,0.2861
CC(=O)c1c(cno1)N,0.1643
C1CC1CCOCC=O,0.229
CC1CC1CCC=O,0.2278
CC1OC=NCC1CO,0.274
CC1CC1C1OC1C,0.3374
CCC12OCC3CC1C23,0.3155
OCC1(CC1)C1CN1C,0.2866
C1NC11C=CC2CCC12,0.2439
CCN1CC2NC2C1=O,0.2536
C#CCOCC#CC#N,0.222
CN=C1C(=O)C=CCN1,0.1511
CCC1CCC2(C)CC12,0.3377
CC1(CC(=NO)C=C1)C,0.1925
O=C1NCC2(OC12)C#C,0.2398
O=CC1C2CC2N2CC12,0.2107
CC(C)CC(O)C1CO1,0.3422
ON=C1C=CC2(O)CC12,0.1864
NC1=C(OC=N)C=CO1,0.2087
CC12CC1CC(=C2)C#C,0.1991
ON=C1CCC1CC#C,0.2466
C(CO)c1nc([nH]n1)N,0.2537
OC1CC2(COC2)C1=O,0.2093
OCC1OC(C#N)C1O,0.2554
C1OC1C1OC2COC12,0.2992
CC1(O)CC2COC1C2,0.3143
CC(O)C12CC(C1)C2=O,0.251
CCC1(C)C(C)C1C#C,0.2864
CC(=O)C1CC(CO)O1,0.2177
CCC(O)C1(CN1)C#C,0.2785
CCCCC(CO)OC,0.3232
CN1C2CC2CCC1=O,0.2536
OC1C(NC11CC1)C=O,0.1939
OCC12CC(CC1O)O2,0.2836
CC1(O)C2NC(=O)NC12,0.2759
CC1=CC=CCCC1=O,0.1644
CC1C(O)C2(CN12)C#N,0.2582
C1C=CCC(=O)NC=C1,0.2111
CC1CC=C2CC3C1C23,0.2197
CC1C2(O)C3CC1(C)C23,0.312
COC=Nc1cc[nH]n1,0.2079
CC#CC1(CO1)C(C)C,0.2782
OC12CC(OC1)C2C=O,0.2125
N=C1OC2CC11COC21,0.2669
N=CN1CC=CC1=O,0.1967
O=CC(CC#N)C1CC1,0.2224
C1CC23CN4C(CC24)C13,0.3073
CN1CC=CCC1C=O,0.2022
CC12CC=CC1N=CO2,0.2551
CC12CCC11CCC1C2,0.3274
CCC1(CCC#N)CN1,0.2996
O=C1OCCC11CCO1,0.241
CCOC1CC1(C)C#C,0.2806
C#CC1C2CC1C=C2,0.2307
Cc1[nH]c(=O)nc(n1)N,0.2124
Cc1c(n[nH]c1OC)N,0.2391
COC1C2CC2C2CC12,0.3118
c1c(=O)c(c[nH]c1O)O,0.1993
CCC1(CCO1)C1CO1,0.3125
CC(O)CC(C)(C)C#C,0.314
O=C1N2CC2C11CCO1,0.2099
CCC(=O)C(CO)OC,0.2189
CC1(CCC2CC12)C#C,0.3142
C1C2N1CC1=COC=C21,0.2319
CN1C2C3C1C2N3C=O,0.2493
CC1CN1C(=O)CO,0.2579
OCC1C=CC2COC12,0.2599
CC12C3C4CC1CC2C34,0.329
CC1C2CC1(C)C(C)=C2,0.2376
CCCCOCCC#N,0.3051
C(CC(=O)N)C=O,0.2305
COC1=NC(=N)C=NN1,0.1893
Cc1c(n(nc1N)C)C,0.2276
CC12C(C#N)N1CC2=O,0.2196
Cc1c[nH]cc1COC,0.2516
O=CC12CC(CCC1)O2,0.2116
CCCCCC(C)O,0.3346
CC1C2C=CNC(=O)N12,0.2086
C1CC1(C(=N)NC=O)O,0.2273
CC(O)C1OCC11CO1,0.3085
CC12OC3(C)C1OC23,0.3024
OC12CC34CCN(C13)C24,0.3052
O=C1CNCC2CC12,0.2013
CC1=NC2C(O)C2CO1,0.2452
COC1CC1(C)C#N,0.292
O1C2C1C1C3C4C2C4N13,0.2835
C1CC(C1)(CC#N)C#N,0.3269
C1CC23CCC2CCC13,0.3404
O=CNCC12CN(C1)C2,0.2507
OC1CC(O)C=C1,0.2611
c1coc(c(c1=O)O)O,0.1848
CC(=O)C1OCC=C1,0.2054
C1COCCOC(=O)N1,0.2833
Cc1[nH]c2c(n1)n[nH]n2,0.2131
CC(=N)OC1C2CC1C2,0.2892
CC(CC#N)NC(C)=O,0.276
CC12NC1C1C(C#N)C21,0.2525
CC1OC2C3CC3C=C12,0.2326
O=CC1CCOCCO1,0.2231
N=C1NC2=C(OC=C2)O1,0.2013
CC(O)C12CC(N1)C2=O,0.2436
CC(C)(c1ncco1)O,0.2443
N=C1NC2=C(N1)N=NO2,0.1301
CC(NC=O)C(C)(C)C,0.2813
CC1C2OCCC12O,0.3027
OC1(C#N)C2CC(=O)C12,0.2244
Cc1cc(c(o1)N)C=O,0.178
ON=C1C=CCN2CC12,0.1847
C1C=CC2C3C=CC1N23,0.2166
OC1CCC2OC3C2C13,0.3044
O=CC12CC1OCC=C2,0.224
C1OC1C1=NOC=C1,0.2511
CC1=CC(=N)OC1(C)C,0.2162
NC1=C2CCN2C(O)=C1,0.2115
COC1CC2OC=NC12,0.2638
CC(=O)N(C)CC#C,0.2688
CN=C1C=CN=NN1C,0.1542
CCOCCCOC=O,0.2713
OC1CC(C1)OCC#N,0.2728
O=CCOC1COC1=O,0.2281
C#CC(=NO)C#C,0.1816
CCC(NC=O)C=O,0.2173
C1C=C(CC1=O)CCO,0.2241
C1COC(=O)C=CC1=O,0.173
CCc1c(n[nH]n1)N,0.2227
C1CC12CC(=O)OC=N2,0.2307
CC(O)C#CC(=O)C=O,0.1549
Cn1cc[nH]c1=O,0.2293
N=C1CC2=C(N1)N=CO2,0.1934
CN=COC(=O)COC,0.2448
CC#CC12CC(=O)C1O2,0.2065
CN(C)c1ccc(o1)N,0.2186
CC1=CCC2(CO2)CC1,0.2627
O=C1OCC2OC12C#N,0.2399
N#CC12CCOC1CN2,0.2664
OC12COC(C1)COC2,0.2999
Cn1ccc(=O)nc1O,0.2098
CC1N(C)CCOC1=N,0.2479
CCC1CC2C(C#N)N12,0.2612
OCC1CC2CN12,0.3106
CC1(CC=CCO1)C=O,0.2116
OC12CC=CC1C=CC2,0.2532
CCC1(O)C(C)CC1C,0.3187
CC1OC2(CC2)CC1O,0.2952
c1cnc(nc1N)CO,0.2167
NC1(CC1C#N)C#N,0.2759
CC1(C)C2C3C(C2O)N13,0.2985
CC1(O)C2C3C=CC2C13,0.2251
CC1(O)CC(O)C1C=O,0.2213
CCN1CC2(O)C(O)C12,0.2604
CC(C)C(O)(C=O)C#C,0.2114
OC1CCC2(NC12)C#N,0.2704
CC1CC(C)C1(O)C#C,0.286
CC1C2C1C1CC2C1C,0.3454
C#CC1C2CCC1C2=O,0.2276
O=C(C#N)C1CCOC1,0.1837
N#CC1(CN1)C1CCN1,0.24
Cc1cn(c(n1)O)C=O,0.1712
OC12CN3C1C2(O)C3=O,0.2397
CCC(O)C1=CON=N1,0.2315
Cc1coc(n1)N=CN,0.1812
CN1CC2OC2(CO)C1,0.2642
Cc1cc[nH]c1C(=O)N,0.2012
c1nc(nnn1)F,0.1672
COC1CCC1N1CC1,0.2996
c1nc(c(o1)N)O,0.2146
CC1=CCCC(=O)OC1,0.2516
CCOC1=NCCNC1,0.2445
CCCN1C2C3OC3C12,0.2629
c1c(=O)cc([nH]c1N)O,0.2127
c1coc2c1OCCC2,0.2201
CC(O)C#CCC1CO1,0.2876
c1cc(oc1)N(=O)=O,0.1793
CC1CN=C2NC=NC12,0.2267
O=C1CC2(CN2)C=C1,0.1914
CC1CNC1(C#N)C#N,0.2498
CC1C2(O)CC1(O)C2O,0.3012
C1CC23COCC2CC13,0.3293
CCCC1(O)C(C)C1O,0.3105
NC(=O)N1N=COC1=N,0.2178
CC1(C)CC2(CO)OC12,0.3266
OC12C3CN3C1CC2=O,0.1954
COCC1CN1C1CC1,0.3013
O=C1CC(=O)C2OCC12,0.1874
O=CC1COC(O1)C#N,0.2247
OCC1OC2C3CC3C12,0.2988
CC1OC2CC1C2C#C,0.2819
OC1CNC2=C1ON=C2,0.1964
OCC1C2C3N1CC23O,0.2932
N=C1NC2CCOC2O1,0.293
NC1=CC(=O)CC2CC12,0.194
CC1CC2(CC2)C2CN12,0.3132
OC1COCC1OC=O,0.2608
OC1C2OC2CN2CC12,0.2853
OCC1NC1C(=O)C#N,0.1777
CCC1C2CC2C1=NO,0.2446
OC1CCC(O)C11CC1,0.3064
CCC1OCOCC1O,0.3312
CC(C=O)C1=NC=CO1,0.2066
CC1C(C)C1([NH3+])C([O-])=O,0.2692
CC12CC1(C)C(=O)C2,0.2326
C1CC11OC2C3CC1C23,0.3003
CC1C2C=C(C)C(=O)C12,0.1881
OC1C2C3N2CC1C3=O,0.2203
OC1CC11CCOCC1,0.3156
CC12COCC1(CO)N2,0.2928
c1c[nH]c2c1CC(=O)N2,0.197
CC12CC1(C#N)C(=O)C2,0.2323
CCc1ncc(cn1)F,0.2038
OCC1CC1C1CCO1,0.3267
Cc1ccnc(c1C)F,0.2231
C#Cc1n[nH]nn1,0.2273
CC(O)C1CN1,0.2983
N#CC1(CCN1)C1CO1,0.2713
COC1CC2OCC2=C1,0.2464
COC(CO)C1CC1O,0.2848
CCN(CCCO)C=O,0.2691
OC1C2CN2C11COC1,0.2989
c1cc(oc1)N2CC2,0.2285
CC(O)C12CC(O1)C2O,0.3196
CC1(C=CCC(=O)O1)C,0.2634
c1c2c(n[nH]1)OCO2,0.226
CC1CC1C1CCC1C,0.3371
CC1C(O)C(C#N)C1O,0.2904
CCC1CN=COC1=O,0.2485
[NH3+]CC[C-]1OC(=O)C=C1,0.1631
CC1CC2CCOC2C1,0.3145
COC1(C)C(C)C1C#C,0.2761
OC1=CC(=O)NC(=N)N1,0.2121
CNC(=O)C1CC1(C)O,0.274
CC1(C)CC1(C)C1CO1,0.3348
CC1NC(=O)OC1(C)C,0.3152
CC12CC1(C)CC2,0.3241
CC1C=C(C)C2NC12C,0.2443
OC1COC(C=C1)C#N,0.2616
CC(C)(CCC#N)O,0.3211
OCC#CC1CCCO1,0.2767
CC1COCC1CC#N,0.2935
O=C1CC(N=CN1)C#N,0.2343
OC1C2CC3C(O)C1N23,0.2725
OC1CC2CC1(O)C2=O,0.2279
CC(=O)c1nc(on1)N,0.1967
C1CC23NC4C2OCC134,0.2819
c1nc(nc(n1)F)C=O,0.17
CN=C1OCC1(O)C=O,0.2068
C#CC1(CC1)OCCO,0.28
CC1CC1OC(=O)CO,0.2714
CN=C1OCCC2NC12,0.2546
O=C1C(NC11CC1)C#N,0.2067
CC12CC(C1C#N)C2=O,0.2484
O=CN1CC1(C#C)C#N,0.245
CC#CC(C)(O)C(C)=O,0.217
CC(C)CC(C)(C)OC,0.3213
CC1(CO)OCC=C1,0.2445
C1C=CNC(=O)CO1,0.2124
O=CC1C2CC1N1CC21,0.2075
CCOCCCCC#C,0.308
CC(OC=N)C(O)C=O,0.2223
CC1N(C)C2(C)CC12O,0.2705
COC(C)C1=CNN=N1,0.2508
C1COC(=N1)C(=O)CO,0.1885
N#CC1C2C3C=CC2N13,0.2121
OC1CN(C=N)C1=O,0.2189
OCC1(O)CC1(O)C=O,0.2199
CC1(CC(=O)C1O)C#N,0.2197
C1CC2OCCCC2O1,0.3269
CN1CC2(NCC12)C=O,0.1773
CCC1(C)NC1C(C)=O,0.2202
CCC(COC=N)=NO,0.2502
CC12C3OC11COC2C31,0.2989
CC12CCC(CC=C1)O2,0.259
CC(=O)C1(O)CNC1=O,0.2135
O=CNCC1CNC1=O,0.2662
CN=C1OC=CN=C1O,0.1674
C1NC23C4CC2OC13C4,0.2673
OC12CC(O)(C1)C21CN1,0.2958
CC12OC1C1(C)CCC21,0.324
c1nnnn1CCC=O,0.2247
OC12C=CCC1CC=C2,0.2383
CC1C2(C)CNC12C#N,0.2378
CN1C2CCC1C1NC21,0.2755
CN1C2CCC12C1CO1,0.3135
CC1=CC2C3C2C1C3O,0.2306
NC1=C(CC2OC12)C=O,0.1783
CN1C2C=CC(=O)C12C,0.1648
CN1CC1C(O)CC#N,0.2705
N=C1OCC23CN(C2)C13,0.2453
CN1C=CC(=O)C1=O,0.148
NC(CC#N)C(O)C#C,0.2637
CC(O)C1CC1C(C)=O,0.2204
CNC(=O)C(O)CC#N,0.272
OC1C2C3C4C=C1C2N34,0.18
C1OCC23NC12CC=C3,0.2268
CC(C)(C)OC,0.3245
CCN1CC1C(C)C#C,0.268
OCC1C=CC2CC1C2,0.2512
OC12C3CC1(OC23)C#C,0.2484
CN1N=NC(F)=CC1=N,0.1612
O=C1OCC11CC2CN12,0.248
CC(C)C(N)(C#C)C#N,0.268
CN=C1CC(C)C(=O)N1,0.2406
COC1(C)CC1(C)C,0.3252
COC(CC=O)C1CO1,0.2235
C1CC23C1N1C2C=CC31,0.1935
c1c(c2n(n1)CCN2)N,0.2187
CCC1=C(COC1)C#N,0.2066
OC12CC(O)(C1)COC2,0.3099
CC12OC1C=CC2C#N,0.2455
C#Cc1cncnc1F,0.1987
N=C1C2OC3C4C(C23)N14,0.2287
CCC1OCC1C(C)O,0.3011
CCCCc1c[nH]cn1,0.2523
c1cn[nH]c1CC(=O)N,0.2396
C1C2C=CC3NC3CN12,0.2293
Cc1cnc(nn1)C=O,0.1558
C1CC2OC(O1)C1NC21,0.291
CCC12C3CC1OCC23,0.3183
CC(=O)OCCC1CC1,0.2848
COC(=O)C(C)CC=O,0.2296
CN=c1cconc1,0.1738
CN=COC(C)CO,0.2735
CC1OC1C1(CO)CC1,0.3195
CC12OC1C1(O)CC21,0.2932
CCC1NC11C2CC1O2,0.311
CN1C=CC(F)=NC1=N,0.1716
OCC12C3CC1C(=O)C23,0.2424
C1CC11CC2NC2C=C1,0.2391
N=C1NC(C=O)C2OC12,0.2012
CC(C)OC(C)C(C)=O,0.2269
N=C1CN=C(NC=O)N1,0.1973
[NH3+]C1C2CC1(C2)C([O-])=O,0.2621
CC1(CC=O)OC1C=O,0.2031
Cc1c(cno1)CC=O,0.2135
CCCC1(CN1)C(C)=O,0.2233
C1CC2NC2C=CC=C1,0.1999
COC12CC1CC1OC21,0.3282
CCCC(C)(C)C1CO1,0.3398
COCC=O,0.2295
C1OC2CC3OC2C13,0.3188
c1c(c(c([nH]1)C#N)N)N,0.1921
CC1COC(O1)C#N,0.3038
CNc1c(nn[nH]1)O,0.2136
O=C(CC1CC1)C1CO1,0.2218
Cn1c(coc1=O)OC,0.2387
NC(=O)CC#CC1CN1,0.2509
CNc1c(oc(n1)O)N,0.2173
CCC1CC2CC3C2C13,0.3361
[NH3+]C1C=CCC1C([O-])=O,0.2417
CCC(CC)(CO)C#N,0.3122
OC(COCC=O)C=O,0.1863
CC1=CC2CC1CCO2,0.2503
c1c[nH]cc1OCC#N,0.2205
O=CC1OCC2NC12,0.2165
CCC(O)(CO)C1CN1,0.291
CC12OCC(=O)C1C2O,0.2162
NC1=C(C=O)C2CC2C1,0.1751
OC1CN2C1C(O)C2=N,0.2239
[NH3+]C1CC(C1O)C([O-])=O,0.1413
C1C2C1C13CCCC21O3,0.3293
N#CC12COC1CN2,0.2471
C#Cc1cncnc1N,0.1878
CC1OC2OC1C=C2,0.2413
COCC(=O)C1NC1C,0.2172
CN1CC1C1CCCO1,0.2929
CC1C2C3OC1(C#C)C23,0.2526
CNC(=O)C1CCCC1,0.2779
c1nc(=O)c(c(o1)N)F,0.1931
O=CC12CC1C1CC2O1,0.2277
C1CC1C(=O)NC(=O)N,0.2409
CCN(C)c1ccco1,0.2142
OC1C(O)C11CN=CO1,0.2531
CC1NC1C1C(O)C1O,0.2839
CC1=CN=C(C)C(=N)O1,0.1647
O=CC12OC3CC1CC23,0.2127
O=CC12CN1CC1OC21,0.1983
CC(O)COC(C)C#N,0.2935
N=C1OC2CC(C=O)C12,0.2281
OCC(O)CC(O)C#C,0.2893
C1CN1CC(=O)CO,0.1908
N=C1OC2C1CC21CN1,0.2747
OC12C3C4N3C1CC=C24,0.1593
C1CC2(C1)C1C3OC2C13,0.3066
CC1CCC([NH2+]1)C([O-])=O,0.2667
C1C(=C(CO1)C#N)CO,0.2076
OC12CC1(O)C(=O)C=C2,0.1786
[O-]C(=O)C[NH2+]CC1CN1,0.2693
Cc1cnoc1COC,0.2371
CCN1C2CC(=O)C12,0.2081
c1c(c(c[nH]1)N)C#N,0.1996
O=CC12CC(OC1)C2=O,0.1923
CC#CC1C2CCC12C,0.2818
CC(O)C1(C)CC1C,0.3264
C1OC11C2CC3OC1C23,0.2957
CN1CC1C(O)C1CC1,0.2944
CC(=O)C(=O)CNC=O,0.1545
CCC#CC1CC2CN12,0.2652
CC12CCC1C2(O)C=O,0.2169
O=C1CC2C=CCN12,0.2465
O=CC1CC=CC1=O,0.1905
OCCCC(CO)C=O,0.2271
OCC12CC1CNC2=O,0.2718
OC1CC11CCC=CC1,0.2684
CCC(C)C#CC1CN1,0.2691
CCC(C)(C#N)C(C)C,0.3503
CC(O)C1CC1C1CC1,0.3194
CCNCc1nnon1,0.174
COC12CC3C1C(=O)C23,0.2479
c1[nH]c(c(n1)CO)CO,0.2372
COCCC1NC1CO,0.3179
c1coc2c1c(no2)O,0.2344
CC1(CC(C1)C#C)C#N,0.2861
CC1(C)OC(=N)C2NC12,0.2655
COc1cc([nH]c1)C=O,0.1671
C#CC(=O)C(=O)CC#N,0.1536
CC(O)C(=O)C(=O)C=O,0.1354
OCC(CCC#N)C#N,0.3016
CCC(O)C(=O)C(N)=O,0.1778
C1CC23OC(CC=C2)C13,0.2283
CC1C2CC=CC12C#N,0.2434
OCC1C2NC2C1C#C,0.2684
CC1OCC11CN1C=O,0.2498
OC(C#C)C1C2CC1C2,0.2932
CC(O)(CO)C1CC1O,0.3105
OCC1C2OC1C21CC1,0.3031
C1CCC=CCOCC1,0.2475
CC(CC#C)C1CN1C,0.278
CCC1(O)C2CC1C2O,0.3009
CCCC(=NO)C(=O)N,0.2088
CC1(N)C2CC1(O2)C#N,0.2422
CC1=CCCC11CC1O,0.2456
CC1OCC1C(C)=NO,0.247
O=C1CCC11C2CC1O2,0.1953
CCCC(CO)CO,0.3254
CC1=CCC2(C)OCC12,0.2584
O=C1C2C3OC2(C#N)C13,0.2268
O1C2C3OC2C13,0.2942
COCC1NC1C#C,0.2831
CC12OC3(C)C1CCC23,0.2987
OC1CC1CNC=O,0.2819
COC12CC3COC1C23,0.3106
CN=C1COCC(C)O1,0.2616
CC#CC1(CO1)C#C,0.2529
CC12C3C1C1=CC3OC21,0.1066
CC1C(C)(O)C1(O)C=O,0.2076
CN=C(N)C(C)(O)C#N,0.2469
CC1(CCO1)C=O,0.2128
c1c(oc(nc1=O)O)N,0.2209
CC1C(O)C(C=O)C1O,0.2123
COC1(CCCC1)C=O,0.2143
C[NH2+]C1C[C-](C=O)C1=O,0.1599
OC1CC2NC12CC#N,0.2748
CCC1(C)OCC2CC12,0.3264
C#CCC12C3C4C3N1C24,0.2649
NC1=C(N)N=CC(=N)O1,0.1455
CCC1(C)NC1(C)CO,0.297
CCCCC1CCC1C,0.3601
c1cnnccc1=O,0.128
CN1CCC(=O)CC1=O,0.2189
OC1C2OCC(O2)C1=O,0.2115
CCC1C2OCC(O)C12,0.2987
CCC(O)C1OC1CO,0.3227
OCC12CC3C4C(C14)N23,0.3078
CC1(CC1)C(=O)OC,0.283
CCC1C(=O)NC1(C)C,0.2774
O=CC1CCOCC1=O,0.2034
CC#CC1OC1CC#C,0.2717
CC1COCCC(=O)O1,0.2718
CCOCC1C(C)C1O,0.3128
CCNc1cc(n[nH]1)C,0.2404
CC1CC2OCC(C)C12,0.307
C1C2CC3C=CCOC123,0.248
CC1CC1CC(=O)C#N,0.1967
Cc1cc2n(c1N)CC2,0.2397
OCCC1(CC1)C1OC1,0.3384
C1C2CC1C=CCCC2,0.2522
CC(=O)C1C2CCCN12,0.2084
CC(O)CC(C#C)C#N,0.2915
COC1(C)C2CC(=O)C12,0.2292
CC(C)C12CC1CCC2,0.3346
CC12C(CO)C1NC2=O,0.2506
CC1C2CC(C3CO3)N12,0.3067
CCC1(COC1=N)OC,0.2783
CC1OC11CC(=O)C1,0.2168
CC1OC(=O)C2CC1O2,0.2473
N=COC1C2OC(=N)C12,0.2692
N=C1OC(=O)OC1C#C,0.2706
O=CC12CCCCC1N2,0.22
C1C2OC34COC(C13)C24,0.3091
CCC1(OCC=C1)C#C,0.2508
CCC12OC3C(C13)C2=O,0.2244
O=C1CC2CC(C2)C1=O,0.1554
OC12C3CC1OC(=N)C23,0.2657
CCC12CC(O)C1CO2,0.3083
c1c[nH]nc1NC2CC2,0.2262
CC12CCC(OC1=N)O2,0.2874
CC1OCC1C#CC#N,0.2223
CC1(CC1)C1NCC1=O,0.2162
CC(C)OC(=NC)C=O,0.1697
CC12CC(C1)C(=O)CO2,0.2273
Cc1cncc(c1C)C,0.2263
OC1CC(C2CC2)C1=O,0.2178
CC(C)C1OC1CC=O,0.2213
CCCC(=N)OC(N)=O,0.2702
C1CC2C3NC3C=CC12,0.2411
OC12CC1CCOCC2,0.3144
CC1CC2C(O)C12C,0.3083
C1CC1C1=CC2CC1C2,0.2257
CC12CC3C4C(N14)C23O,0.2837
CC1CC2C(C#C)N12,0.2569
COCC(=N)OC1CC1,0.2741
CC(C)(C)C(=O)OC,0.2807
C1CC12CC(=O)CC2=O,0.1979
c1noc(=O)o1,0.2672
CCC1COCC1C#N,0.3023
COCC1CCC(=O)C1,0.2228
CC(C)(C)C(=O)C1CO1,0.2155
COC12CCOC1C2C,0.3171
COC1C=CCCC1C,0.2587
O=C1CC2OC12C1CC1,0.2143
CC#CCC(C)(O)C=O,0.2218
COC1C(C)C(C)C1O,0.3004
CC1CCC=CC(=O)O1,0.2204
c1cnn(n1)C(=O)CO,0.2216
COC1OC(=N)C=C1C,0.22
CC1(O)C(O)CNC1=O,0.2727
CC1OC(CO)CC=C1,0.2655
CCC1CC(=O)C(=O)O1,0.1725
OC1C(O)C2C1NC2=O,0.2626
C#CC(=O)N1CC=CC1,0.2142
CCn1nc(c(n1)O)C,0.2276
C1CC2NC2COCO1,0.3047
CC12CN1CC2CC=O,0.2102
CCC1CC2NC(=O)C12,0.269
CC1C2C=CC1(O)C2C,0.2369
FC1=NNC(=N)C=C1,0.153
CCC12C3CC1CC23,0.3244
CC1(COC(=N1)C#C)C,0.2179
CC(=N)NC(=O)CC=O,0.2108
CCCCN1CC1C#N,0.2688
Cc1c(onn1)NC=N,0.1955
O=CN1C2C3OC3C12,0.2478
N#CC12CCCC1O2,0.2916
N#CC12C3CC1OCC23,0.277
CC1CCNC=C1C=O,0.1901
CC1CN2CCN=C2O1,0.2722
COC1CN=COC1C,0.2667
CC(C)OC(C)(C)CO,0.3105
CC#CC1OC1CC#N,0.272
N#CCC12OC3C1NC23,0.2797
OC1C(O)C1OCC#N,0.2499
CC1OC1(C)C1CCC1,0.341
c1c2c(no1)CCC2,0.2417
OCC1C2CC(C#C)C12,0.2985
Cn1c(ncn1)CC=O,0.2086
OC12COC1CC1CC21,0.3144
c1cocc1CC#N,0.2421
c1c(ncnn1)CCO,0.1652
O=C1N2C3C2C2C3N12,0.2305
C#CC(=O)CC1(CC1)O,0.18
CCC1CC2CC=CC12,0.2593
Cn1c(=O)ccnc1F,0.2009
CCC1CC(OC)C1O,0.3177
CC12OC1C1OCC21C,0.2953
C1COCC=CC1=O,0.1888
CN1C=C(OC1=N)C#C,0.1727
CC(C=O)C1COC1=O,0.2254
CN1CC(=NO)C(=O)C1,0.1415
O=CC1COC(=O)C1,0.2256
C#CCC1(COC1)C#C,0.288
CC#CCC1(CO)CN1,0.2865
OCC1NC1C(=O)C=O,0.151
CC1=CC2CC3CC1C23,0.2463
CC1CCC(C)C11CC1,0.3373
Cc1[nH]nc(n1)OC,0.2477
OCC12N=CNC1C2O,0.2279
OCC1(CN1)C(F)(F)F,0.3343
CCCC(OC)C#C,0.3014
CC1(COC1)CC(=O)N,0.2618
Cc1[nH]nc(n1)N=CN,0.2109
OCC1N2CC2C11CN1,0.2962
CC1(O)C(CO)NC1=N,0.2679
CC(O)CC1CC(=O)N1,0.2815
CC1=C(N)ON=NC1=N,0.1367
CC12CC1(O)C1C(O)C21,0.2994
COC12C(O)C1OC2=O,0.2389
OCC1(CO)CC2CN12,0.2877
CC12OC3C1C1NC1C23,0.3034
N=C1NC2(CC2)C11CO1,0.242
O=C1OCC11OC2CC12,0.2464
O=CC1N2CC2C11CC1,0.2059
O=CC1CNC1C#N,0.2216
CC1CC(O1)C(O)C#N,0.2695
CC1=CC2(CC2)C2NC12,0.2358
C1C(CO1)(C#N)N=CN,0.2593
CC12CCC1C1CN1C2,0.3025
CCC1OC1(CC)CO,0.3289
Cc1c[nH]c(cc1=O)O,0.2085
O=C1C2C3CN1C23C#N,0.241
CC1CN1CC(C)=O,0.2233
CC1=C(CC(=O)C1)C#N,0.2114
CCC1NC1CC(C)=O,0.2292
C1NC1C1OC2COC12,0.2988
CC12CC1C(=N)OC2,0.2788
C1CC1N=C2NCCO2,0.2564
CC1COCC2CN2C1,0.3102
CC(C#C)C1(CC1)C#C,0.2871
CC(CN1CC1)C#N,0.2904
Cn1ccc(n1)C#C,0.2221
N#CCCC1CC2CN12,0.2834
C#CC1=CC2OC3C2C13,0.1933
CCC1(CC#N)NC1C,0.2805
CC1CC2COCC2=C1,0.249
Cc1c(c(co1)N)OC,0.2236
CNC=NC(C=O)C=O,0.1882
C1C2C1C1COCC21,0.3158
OC1C2OCC12N1CC1,0.2773
OC1CCC(=O)C2CC12,0.225
N#CC1CCC2NC2C1,0.2987
CCC(C)C(OC)C#N,0.3031
CC12CC1OCCC2,0.3235
CC=O,0.2342
CC1(C)C2CC1(CO)O2,0.3164
CCC1OCC2CC1C2,0.3211
N=C1OC2CNC1C2,0.2637
CCC1C(C)C2CCC12,0.33
CC1C(CCO)N1C=O,0.2555
COC1CC2=CCOC12,0.2335
CC1OCC(CO)=C1,0.2502
CC12CC1OC2C=O,0.2114
O=C1C=CC2OCC12,0.1881
CNc1cc(oc1)NC,0.2194
CCC(CC)C=O,0.2263
OC1C2C3OC3C12,0.285
O=C1ON=C(O1)C1CN1,0.2434
OCC1C2NC2C1C=O,0.217
CC12CC3(O)CC1C3O2,0.3004
CC(N1CC1)C(=O)C#C,0.16
O=CCOC1OCC=C1,0.2285
CC1C2CC(C)(CO)C12,0.3195
CCC1(OC2CC12)C#N,0.2723
COCC1(O)C(O)C1O,0.2848
OC(C=O)C1=CNC=N1,0.1973
CC(C)C1OCC11CO1,0.3206
CC1C2C1C1(O)COC21,0.292
OCC1CC2COC2C1,0.3139
CC1C2OCC2C1=NO,0.2422
NC1C(=O)NC=C1C#C,0.1784
OC12CC(=O)C1C2C#C,0.2273
c1coc(c1NC=O)N,0.212
N=C1OCCC1CC#N,0.2836
c1c[nH]c(=O)nc1C=O,0.1515
OCC1C=CC2CC12,0.2481
C1CC11C2CC1C1OC21,0.3334
CC#Cc1conn1,0.1996
COC1CC1C#N,0.2912
CCC1NC(=O)C2CC12,0.2648
CCNC(=O)C1NC1C,0.2618
Cc1c(nccn1)C,0.2022
NC(=O)C(O)C1CC1,0.2732
CCC1(O)CC=CC1O,0.2606
CC1C2C3CC(O)C1C23,0.3197
N=C1OCCC2CC2O1,0.282
Cc1c[nH]c(c1O)NC,0.2334
CCC1C(O)CC1OC,0.3185
CC(=O)C12CC1C1OC21,0.2199
N#CC12C3OC1C1C3N21,0.257
c1[nH]nc(n1)C(F)(F)F,0.2765
N=C1OC2C3C2C2C3N12,0.2747
CCC1=CCC2CC2C1,0.2589
CNC1CNC1(C)C#N,0.2582
O=C1CC2OC1C1CC21,0.2166
OCC1C2C3CC1CN23,0.3055
O=C1OCC2(OC12)C#C,0.2386
CCNC1=CNC(=N)O1,0.2221
C(C1CO1)C1=NC=NO1,0.2525
CC(O)C1=CC2CN2C1,0.2236
Cc1c(=O)ccon1,0.1863
N#CC1CN2CC2CO1,0.2479
CC1CC2=C(ON=C2)O1,0.2256
CN1CC2CC(=O)C12C,0.1821
C1OC2C3CC1C2CO3,0.3168
C(C#N)N=CNC(=O)N,0.2443
CCC1CCC(CC)=C1,0.2562
COCC1(CO)OC1C,0.3068
OCC1CCC(O)CC1,0.3187
O=C[C-]1C2C[NH2+]C1C2=O,0.1452
CC1(C#N)C2CC(O)C12,0.3041
CCOC1CC1(O)C#N,0.2679
COC(C)C(OC)C#N,0.2848
OCC1(CCCO1)C=O,0.2116
Cc1[nH]c(=O)ncn1,0.2012
c1c(c([nH]n1)N)C(=O)N,0.2142
C1CC1C1CC2COC12,0.3101
C1OC23CC4CC2OC134,0.281
C1C2C=CC11OC1C=C2,0.2171
OCCC(O)CCC#N,0.311
CC12CCC1CNC2=O,0.2691
CC(=O)C(OC=N)C#N,0.2225
CN=C1OCCCC1O,0.2755
COC(C)C(CO)CO,0.3111
NC(=O)C12CC(O1)C=C2,0.2347
CC12CN1CCC(O)C2,0.2948
COc1nc(co1)C=O,0.1915
C1CCC(C1)(CO)CO,0.3063
CCC12NC1CC2O,0.302
Cc1c(c(co1)CO)O,0.2278
CN=C1OC2C(C=O)C12,0.2175
O=C1C=CCCC11CN1,0.188
OCC1OC1C(=O)C=O,0.1504
C1CC2(CC3COC23)O1,0.2854
CC1CN=CNC(=O)N1,0.2399
C1C=C(CO1)CNC=O,0.2398
C1CNC(=O)C=C1C=O,0.1645
CC1=C(F)C(=N)ON=N1,0.1685
N1C2=CC3N=C1C1C3C21,0.2104
CC1(C)OCOC1C=O,0.2149
OCCC1CCC2CN12,0.311
CC1C=CC(O)C1CO,0.2547
C1C(=O)C2(N1)COC2,0.2114
C1CC(=C(C1)C=O)CO,0.1898
Cc1cc(co1)NC=O,0.21
N=C1OC2CC(O1)C2=O,0.2004
CN1CC1C1=CN=CO1,0.229
CCC(C#C)C1CC1C,0.3105
c1c(nc(cn1)N)CO,0.1865
Cc1ncc(n1C)C#C,0.2022
CC1(CC1)C1NC1CO,0.3106
CC(C)(C)C=O,0.2291
CC12OC3C4C(OC14)C23,0.2963
CC1OCC(=N)NC1=O,0.2377
CCC1(O)C(C)C1C=O,0.2228
CC1C2CC1(O)CC2=O,0.2292
CC1CCC(CO1)C#N,0.3005
OC1(CCC11CN1)C=O,0.2053
CC(CO)(CC#C)C=O,0.2179
NC(=O)OC12CC(C1)C2,0.3202
CC(C)c1ncco1,0.2447
OC1(C=O)C2CC(=O)C12,0.1962
CNC(=O)n1cccn1,0.2334
CC1OCC(CC#N)=C1,0.238
CCOC1CC1(C)C#N,0.2912
Cc1c([nH]cn1)C(C)C,0.2455
OC1CC11CC(O1)C#N,0.2528
CCOc1c([nH]nn1)O,0.2162
CC1(C)CC2NC12CO,0.277
c1c(c(=O)[nH]cn1)CO,0.1961
OC(C#N)C(C=O)C=O,0.1995
CCC(C)C(CC)CC,0.3734
CC1OC2(COC12)C=O,0.2057
OCC1CC(C=C1)C#C,0.2615
c1nc(nn1CC#N)O,0.2358
CCOC1C2C3CN3C12,0.2831
Cn1ccnc1CCO,0.2443
CCCC#CC(=NO)C,0.2031
CC1NC1(CC=O)C=O,0.1998
CN1CC(C)(C)C1C=O,0.1968
CCC1COC(C)C1O,0.3018
C1C2CC3CC3C12,0.3226
C1C2CC1C21CC=CC1,0.2664
O=C1C2CC2CC11CC1,0.2266
c1c([nH]nn1)N2CCC2,0.225
CC(=O)C1OC11CCC1,0.2209
CC1CC2(C)C3CC1C23,0.3339
CC1CCC(C#C)C1O,0.3005
COC1CC2(OC12)C=O,0.2169
CC(O)CC#CC(N)=O,0.2335
CC12CC1(C=O)C1OC21,0.2178
CC(C)(C1CCC1)O,0.3246
CC#Cc1ccon1,0.219
CC12CC(O)C1C1CC21,0.2963
N#CC1NCCC11CN1,0.27
CC1C=C2CN3C2C13C,0.1727
OCCC1C=CNC1=O,0.2144
c1c(nc(c(n1)F)F)O,0.1891
O=CCC12CC3C(O1)C23,0.2156
O=CC12CC1C1CC1O2,0.2225
CC1=CCC(C)(O)C1,0.2605
CC1C=CC2CC12C#N,0.2476
CC1NC(=N)C1(O)CO,0.2655
OC1CC2(CO2)CC1=O,0.2203
Cc1cn(nc1C)C=O,0.2125
CC1(O)C2CC2C1(C)O,0.3038
CCc1noc(=O)o1,0.2701
CC(C)(C)C#CCCO,0.3041
CC1C2NC=C(C=O)C12,0.1753
COC(=O)C1CCC1=O,0.2195
O=C1COC23CC(C2)C13,0.21
OCC1CC1C1CC1,0.3271
N=C1NC(C=O)=NC=C1,0.1316
CC(C=O)C12CC(C1)C2,0.2241
CC1N2CC1(C)C2C=O,0.2004
CCC1(OC1C#C)C=O,0.2122
C1NC11CCCC2NC12,0.2989
c1c(non1)NCCO,0.203
c1[nH]c(c(n1)N)CC#N,0.2178
C#CCC1CCC1,0.3124
C1C(CO1)(COC=O)O,0.254
NC(CNC1CC1)C#N,0.2623
CCC(=NC)OC=O,0.2608
CNC12C3OC1COC23,0.2765
C(C#N)C(=O)C#CC=O,0.1958
CC1OC(CO)C2OC12,0.3315
O=C1OC2CC1C2,0.2762
C1CC2(CC=C1)COC2,0.2655
C#CCN=COC=O,0.245
c1cnc(c(c1O)F)N,0.2155
CC(C)CCCC(C)O,0.335
CCC1(O)CCCC1O,0.328
OCC(OC=N)C#N,0.2853
CC1CC(C)(CO)C=C1,0.263
O=C1COC23CC12NC3,0.1988
CN=C1COCCO1,0.2613
c1c(c(c(cn1)N)O)N,0.2065
CCC1C2OCC3C2N13,0.3101
CN=C1CC2(O1)CC2,0.2707
CC1CC(CC1=O)=NO,0.2184
COCC1(O)CC=CC1,0.2647
CN=C1C(=O)NCCN1,0.1938
CC1CC2C1CN2C=O,0.264
O=C1C=CC23CC(C2)C13,0.1797
c1coc2n1nc(n2)N,0.2108
CC(C#C)C(C)(C)O,0.3154
CCC1CC(O1)C1CC1,0.327
CNC(=O)C1(O)CC1O,0.2505
OCC1CC2CC1C=C2,0.2537
N=C1CC2(CC2)C(=O)O1,0.2634
O=C1OC2C1C21COC1,0.2539
COC1OC(=O)NC1C,0.3122
CC(C)(C)CCC=O,0.2295
c1cc([nH]c(=O)c1)N,0.1763
CCC1OCC=C1C=O,0.1808
CN(CCOC)CC#N,0.2654
COCC12CC(O1)C2O,0.3155
CCC(O)(C=O)C(C)=O,0.2008
CC(C)C(O)C1COC1,0.3038
O=C(C#C)C1NC1C#C,0.1895
CC1(O)CC1(CO)C#C,0.27
CC1C2CC2C1=O,0.227
CC1C(C)C11CCC=C1,0.244
CCCCN=COC=O,0.2384
OC1=CNC(F)=CC1=N,0.1891
O=C1CC2OC2C2OC12,0.2145
CC1C2COC(=N)C12,0.2774
c1cnc(cn1)NC=N,0.1764
CC1(O)CC2(CO2)C1O,0.3127
CCOC1CC1(C)O,0.3137
CCc1c(non1)C,0.256
OCCCC1CC=CC1,0.2648
Cc1cncn1C2CC2,0.2437
CC1OC11COC11CC1,0.303
CC(C#C)C1=NNC=C1,0.2631
COC(=O)C1(N)CC1C,0.2486
CC1(OC1CC#N)C=O,0.2191
c1[nH]c2c(n1)COC=N2,0.185
OCC1CO1,0.3418
COC1C2N3CC2(O)C13,0.308
ON=C1COC2C(O)C12,0.2353
O=C1C2CC1C(O2)C#C,0.208
C#CC12CC1CC21CN1,0.2568
CC(C#N)C(C)C1CN1,0.2825
CC12OCC3C(CC13)O2,0.3336
N=C1OC2OCC1C=C2,0.2378
CCC(=O)N1CCC1C,0.2657
OC12CC3(OCC13)C=C2,0.2284
O=C1C(C#C)C2CN12,0.2286
N=C1CC(CO1)OC=O,0.2669
c1c(c([nH]c1N)N)C=O,0.1726
CC12C(O)C1CN2C=O,0.254
OC12CC3C1CC23C#N,0.2899
O=COC1(CC1)C1OC1,0.279
OC1C2C3CC2(C#N)C13,0.2948
COC1C2C3C1N=CN23,0.2261
CC1CN(C)C=C1C=O,0.1737
CC1(CC1)C1(CO)CN1,0.3115
CNC(C)(C=O)C(C)=O,0.178
CC1(C)OC(=O)C1CO,0.2781
NC1=NC2C3CC3C2O1,0.2782
CCCC(=O)NC(=N)C,0.2442
C1C23CCCC12C1OC31,0.2745
CC1CC2=C(N1)ON=C2,0.2145
CC1OC1(CC=O)C=O,0.2102
CC(O)C1CC2OCC12,0.302
CC1(C#N)C2OC2C1=O,0.2082
CC1NC1C(=O)CC=O,0.2043
CC(N)C(OC=O)C#N,0.2502
C1OC11C2C3CC=C1C23,0.1814
CC(C)CC(=O)C1CO1,0.2203
CC1=C(C)C(CN1)=NO,0.1773
O=CC#CC1(CO1)C=O,0.1974
C#CCn1cccc1,0.2326
N#CC1CC2(CN2)CN1,0.2749
Cc1[nH]c(cc(=O)n1)N,0.2087
CC(O)C(O)CC1CN1,0.3045
CCCN1C=COC1=N,0.2188
CN1C2C3NC3C1C2O,0.2832
NC(C#N)C1=NC=NO1,0.2407
C1OC1C1CC2(CO2)C1,0.3325
CCCOCC#CC#N,0.2271
c1cnn2c1CC(=O)C2,0.2042
CCCNC(CO)C#N,0.2664
CC(=N)OC1=NC=CN1,0.2338
CN1CC(=O)C(O)C1=O,0.2034
OC1CCN2CC2C=C1,0.2298
C(C(C=O)(C=O)C#N)O,0.1901
N#CC1CC=CC1C#N,0.2634
CN1CC11C(O)CC1O,0.2991
O=C1NC=CCC11CO1,0.2061
CC1(C)N2CCC12C=O,0.2054
CC12CC3C(CN13)C2O,0.295
c1c[nH]c2c1cco2,0.2223
CC1C2CC(O)(C=O)C12,0.2125
CC1OC2CC2(O1)C#C,0.2658
CC1C2C=CCC(=O)N12,0.2334
CC(CO)CCC(C)=O,0.2347
C1C=CC2OC12,0.2477
NC1=NCC(C#N)C1=O,0.1809
Cc1c(c(no1)C#C)N,0.1855
Cn1cc(nc1)NC=N,0.2145
OCC1OCCC=C1,0.2615
CC#CC1OCCO1,0.2901
COC1CC2C1CC2=O,0.2212
CC1=CC(CC1)C=O,0.2141
OCC1C2CC3CN2C13,0.2923
CC1(CN1)C1=NC=NN1,0.2594
OCC1C(OC1=N)C#C,0.2692
CCC1CCC11CCC1,0.3505
CC1=CC(=NO)CC1,0.1916
C1CC23OCC12CC=C3,0.2514
CC(O)COC(C)(C)C,0.326
c1c(c(=O)c(n[nH]1)O)N,0.1615
CC12OC1CC(=O)C2O,0.2289
CNC1(CCC1N)C#N,0.2685
CCC12CC1COCC2,0.3233
COCC1C=CC2CC12,0.248
C1CC23CN4CC(C12)C34,0.2794
N#CC12CC(C1)(C2)C#N,0.3167
O=C1NC2C3NC3C2O1,0.309
CNC1=C(N)OC(=N)N1,0.2254
N=COCCCC#C,0.2827
O=CC(C=O)C1CN1,0.1954
CCC1OC1C1CO1,0.339
OCC1=NON=CC1=N,0.1878
CC1CN(C=N)C(=O)C1,0.2219
CC1CCC1(C#C)C#C,0.2829
CCCC1CCOC1,0.3198
CC#CCCC(=O)C#C,0.1866
COC(C)(C#C)C1CC1,0.2945
CC1OC11CCC2NC12,0.3086
CC1C=CC(=O)NC1=N,0.2038
CC12CC1C(O)C2C=O,0.2077
CC(CC1CC1)OC=O,0.2851
CCC1CC2COCC12,0.3253
NC(=O)N1C2CCCC12,0.287
CCC(C)C1=NON=N1,0.2444
CCC1(O)CCC1(C)C,0.3196
CC(C)C12OCC1C2O,0.2909
CC1CN2C(C)C(=O)C12,0.2016
CC12CC1C(C2)C1CC1,0.3342
CC(O)C(C)C#CC=O,0.2051
C#CC12CN3CCC1C23,0.2612
OC1C=CC2(OC12)C#N,0.2293
CC1OC(CCO)C1C,0.3228
O=CC1CCC(C1)C=O,0.2193
CC1=COC(=O)OC1=N,0.2123
CC12CCC=CC1(C)N2,0.2389
C1C2CC3COCC12O3,0.3236
CC12CC(=O)OCC1O2,0.2712
CC#CCC1NC1C#N,0.2651
c1c(=O)[nH]c(=O)cnn1,0.1618
OC1CC2OCC2(O)C1,0.3135
CC(C)(O)C1OC2CC12,0.3187
CCCC12CC(C1)OC2,0.3132
CCc1cncnc1O,0.2279
C1OCC2OC=NCC12,0.2709
OCC1(CN1)C=O,0.219
C1CC12CNC(=O)C2=O,0.1734
Cn1cccc1N2CC2,0.2307
OC1CC2COC1CO2,0.3207
CN=C1CC(C)(CO)O1,0.2779
CC1CC(=O)CC1O,0.2203
N#CC12OCC3C1OC23,0.268
CCC(C=O)C#CCO,0.2182
OC1CC1(C=O)C1CO1,0.2092
CCC1C2CC2CC1O,0.3218
NC1=CN(C=O)C(=N)N1,0.1789
O=C1C2OC3CC2C1O3,0.1961
Cc1c(c(on1)C)C#N,0.2301
CC1COCC(=O)OC1,0.255
CCC1=CN=CC(=N)O1,0.1586
OCC1(CN1)C(O)C#N,0.2887
O=C1C2C3C4C3C1C24,0.2163
CC1OC2CC1OC2=O,0.252
COC1(CCC1)CO,0.3285
CCC1C2C(C1O)N2C,0.2862
CC1(C#C)C2C(O)CN12,0.2724
CC12CC1C1OC21C,0.2927
[NH3+]C1CC(C=C1)C([O-])=O,0.204
c1c(nc(o1)N)CC#N,0.2371
CC(=O)CCCN1CC1,0.2236
CC1N=COC2COC12,0.265
O=CN1CC2C3OC3C12,0.2642
CC(O)(CNC=O)C=O,0.2093
ON=C1CN2C3CC2C13,0.2438
C1COc2n1c(=O)on2,0.2686
N#CC1C(C#N)C1C#N,0.2858
CCC1CC1CCC#C,0.3131
CC1(C)C2N1CC2=O,0.2164
CC1CCCOCCC1,0.3236
O=C1CC2CC3C2N3C1,0.2075
CNc1c[nH]cc1N,0.2325
CCC(C)(C)C1(C)CO1,0.3346
CC1COC(=O)N1C,0.3039
CC1=CC2OC2C(=O)C1,0.2073
CCOC(C#N)C(N)=O,0.2723
CC(=N)NC(=O)N1CC1,0.2426
OC(C=O)C1=NON=C1,0.224
CC12NC1C1(OC21)C#C,0.2326
CC1CC2C1C2(O)C=O,0.2186
CNc1cc(oc1)C#C,0.1791
CC(OCCC#N)C#N,0.3016
C1CC12CC=CCC=C2,0.2413
CC12CC1C1(CCC1)C2,0.3305
CC1C2CC2(C)CC1O,0.3228
OC12CCCC1CC2=O,0.2208
c1cc(=O)cnc(c1)N,0.1349
CC1CC2C=CCC2O1,0.2591
CCC12CC1CCC2,0.3391
[NH3+]C1C(O)C1C([O-])=O,0.2694
CC1=C(F)C=NOC1=N,0.1687
CN1C2C(=O)C=CC12C,0.166
O=C1NCC(CC#C)N1,0.2859
O=CC1NC11CCOC1,0.2195
C#Cc1ccc(cc1)O,0.1962
CC1(OCC2NC12)C#N,0.2843
CC1(CO1)C#CCC#N,0.2728
CC1C(C)C(CO)C1C,0.3295
OC1C2CC1C(=O)CN2,0.2045
CC(C)([NH3+])C1=N[N-]N=N1,0.2664
CCc1[nH]cc(n1)CO,0.2453
O=CC1CCCC2OC12,0.221
CC1(O)C2NC1C21CO1,0.3073
CCc1cc(oc1)N,0.2244
C#CC12CC1C1(CC1)O2,0.2462
OC1C2OC=NC12C=O,0.2125
Cn1cncc1C2CC2,0.2431
CC1CC2CC(C2)C1C,0.346
C#CC1C2CC1C2=O,0.2486
COc1cc(ncn1)F,0.234
COC12CC3C1C1C2N31,0.2972
OCC(=O)C(O)CC#N,0.2312
OC1CCOC(=O)C=C1,0.2167
N1C2C1C1OC3C(O1)C23,0.2979
CN=COC1CC1CO,0.2716
OC1CN=COC2CC12,0.2504
CNc1cc(co1)C=O,0.1556
Cc1c(cno1)NC,0.2006
CCC1=CC2NC2C1,0.2425
CC1C2OC3CC3C12O,0.3056
C1C2C3C1C21CC=CC31,0.2585
CC1(OCC=C1)C=O,0.1991
CC12NC1C1(CC21)C#C,0.2414
O=C1OCC2CN2C1=O,0.1988
CC1(CC=O)CC(O)C1,0.2253
CC1(C(C1(C)C)C=O)C,0.2229
CCc1c(coc1N)O,0.2218
COC1C(O)C1CO,0.3054
C1C2C3C4CC3(CN12)O4,0.3008
CCC1CC1CN1CC1,0.3157
Cc1cc(oc1)N(=O)=O,0.1741
CCC1(C)CC2CN2C1,0.3017
CC12COC1C1CN1C2,0.2894
CC(CO)CC(=O)C=O,0.1567
O=CC12CC1CC2C#N,0.2257
CC(O)CC(C)C(C)C,0.3333
OC1C(=O)C2NC2C1=O,0.1768
CCOC(C)(C#C)C#C,0.2769
CC1COCOCC1O,0.3017
Cc1conc1OC=O,0.2419
OCC1OC2CC1(O)C2,0.3048
CC1CC1C1=NOC=N1,0.2424
N=C1OC2C3CC=C1C23,0.2013
CCCC1NC1(C)C#N,0.284
C1CCC2(CC2)C=CC1,0.249
CCC12CC(C)(O)C1O2,0.3139
CC12CC1C(CO2)C#N,0.2786
c1c2n(nn1)CC23CC3,0.2535
CCc1c(onc1O)C,0.246
CCN1CC(=O)C1(C)C,0.2019
CCc1ncoc(=O)n1,0.2039
CC(=O)C1(CCC1)C,0.2288
N=COCC(=O)NC=O,0.2113
OCCC(O)(C#C)C#N,0.2601
CC1N(C)C(=O)NC1=N,0.2473
Cc1c(nno1)OC=O,0.2129
CCc1cc(ncn1)O,0.231
CC([NH3+])(CO)CC([O-])=O,0.2768
N=CN1C2CC(C2)C1=O,0.2276
OCC1CCCC1=NO,0.2452
CC12C3N1CC2C3(C)O,0.2994
Cc1nc(nc(=O)o1)F,0.2185
COCC1C2CC1OC2,0.3213
CC1=CC(C#C)C(=O)N1,0.2159
Cc1nc(=O)nc(o1)C,0.2122
CCC(CC)OC(=O)C,0.2859
c1coc(n1)C2CC2,0.2359
OCC1CC=CC1=O,0.1923
OC12CC(C1)C2C#N,0.3081
c1c[nH]cc1OC2CC2,0.24
C1CC2C3NC3C2O1,0.2939
N#CC1CC=CCC=C1,0.2481
CC1C2C3C(CN3C)N12,0.268
CC1CCCOCCO1,0.3204
C1CC(O1)C1=NNC=N1,0.2402
N#CC1CC2(CC2)CN1,0.2713
CCC1C2CC1(O2)C#C,0.2533
CC(CO)CCCCO,0.3392
CC1(C)OC2CCOC12,0.3268
CNC1=CC(=O)COC1,0.1927
CC1OC(OC1C)C=O,0.2091
O=C1CN2CC3CC12C3,0.1972
CC1(C)CC1(C)OC=O,0.2715
CC(C)(C(=O)CCO)O,0.2199
CC12COC11CC2OC1,0.2779
N#CC1C=C2CN3C1C23,0.1718
CC1=C2CCC2OCC1,0.2461
CC#CC(=O)C(C)C#N,0.2072
CC1=CC2(C)CCC1O2,0.2536
NC1=CC(=N)OC(F)=N1,0.1839
CC1=C(C)C(=N)OC=C1,0.1657
N#CC#CC#CC1CN1,0.1748
Cc1nc(cn1C)OC,0.218
Cc1ccnc(=O)o1,0.1832
CC1NC1(CO)CC=O,0.2243
CC1CC2C(CO)C12,0.3246
c1nnnn1CC2CC2,0.2675
CC1CCCC(O)CO1,0.3153
CCC(C#N)C1CC1O,0.3148
OCC1COCCCO1,0.3252
C1C=CCOCOC1=O,0.2342
OCC(O)C(O)CC#N,0.3116
CCNC1(COC1)C=O,0.1962
CC1(C)OC(=N)CC1=O,0.2163
N#CCC1C2CC1OC2,0.283
CC(C)C(C)(O)C#N,0.3137
OC12CC3(O)C1C2C3=O,0.2412
N=C1OCC1OC=O,0.2702
CC(O)C1=CC=CN1C,0.2339
c1c(c2n(n1)CCC2)N,0.2226
CCn1c(=NC)onn1,0.1958
CC1C2CC(C12)C(C)=O,0.231
CCCC1CC1OC,0.3326
CC(=O)N1CC(O)C1=O,0.2166
CC1C2C(CO)CC12C,0.3167
C1C2OCC3CCC2N13,0.2919
CC1NC(C)C1=O,0.2188
CC1C(OC1=O)C=O,0.2218
OCC(O)(CC=O)C#C,0.2096
CCCC(O)C#CCC,0.2885
CC#CC1(CCC1)C#N,0.2799
CC1CC2C3CC2C13,0.3814
CC1CC2OC3CCC123,0.3005
CC1N2CC2C1(C)C#N,0.2798
OCC#CC1COC=N1,0.2684
CCC1C2CN(C=O)C12,0.2574
CC12C=CC3(O)CC1C23,0.2405
OCCOCCOC=N,0.2874
OC12CC=C3CCC1C23,0.2206
O=CC1CC2CC1C=C2,0.2205
CCC1C2OC(=N)C12C,0.2772
OC1C2C3NC3(C#N)C12,0.2871
NC1(CC(C1)C#N)C#N,0.283
OC1CNC2=CNC=C12,0.2155
CC(C)OC(=O)C,0.2846
CC(C)CN(C)CC#N,0.258
CCC(C)OC(C)=O,0.2844
OCC1C2CC(O2)C1=O,0.21
OC(C#C)C1=NCCN1,0.2305
COCC(=O)N1CCC1,0.2551
CNC12C(O)C1OC2=N,0.244
CCC1(CC1)C(C)C,0.3465
O=C1CC2(COC12)C#C,0.199
CC1(CO)CC2COC12,0.3085
CC1C(O)C2CCC12,0.3077
OC1C2CN2CC11CN1,0.2913
C#CCNc1cnn[nH]1,0.2307
CC12CC(O)C=CC1N2,0.2158
COCC1CCC1,0.3411
CN=C1C=C(C)OC=N1,0.1977
CC12C(O)C3C1C(O)C23,0.315
CC12CC=CC=CC1O2,0.1992
NCC([NH3+])CCC([O-])=O,0.2726
COC(C#N)C(C)C#C,0.2883
CC1C=CC2CC2C1=O,0.2153
CN1C2C=CC(O)C12,0.2185
CCC(C)CC1OC1C,0.3452
CC12CN3C(C13)C21CO1,0.3092
OCC(O)C1=NOC=N1,0.2266
C1CNC=CC(=O)C1=O,0.1554
CC1NC1C1NC1C#N,0.2707
CC1(O)CC(O)C1O,0.3037
O=C1CCC(C1)C#C,0.2215
c1cncc2c1c[nH]c2,0.1629
O=C1CC2C=CC3C1N23,0.2009
CN1C2C3CC2(C=O)C13,0.1847
NC(=O)C1CCC(O)C1,0.276
C1C(=CC(=O)CO1)N,0.192
CC1C2CC1OCCC2,0.3156
O=CNC1CC11CCC1,0.271
c1nc2c(noc2o1)N,0.2297
OC1CCN2C=CC=C12,0.2398
C#CC12C3C4C(C13)N24,0.2365
CC12CC3(C1)CCOC23,0.3367
C1NC1C1CO1,0.3238
OCC1(CN=CN1)C#C,0.25
C#CC12NC1CC1CC21,0.2625
OC(C#C)C1=NON=N1,0.2149
C(=O)n1nc(nn1)C#N,0.2077
Cc1c[nH]cc1CC#N,0.2443
OC1(CC#C)CCC1=O,0.203
CC12CC1N1CC(C1)O2,0.293
c1coc(cc1=NO)O,0.1728
CCCC(C)C(O)C#C,0.2956
CN1CC1(C#N)C1CN1,0.2585
c1cn2c(coc2n1)N,0.2261
C#Cc1c(cco1)CO,0.1943
CC1=CCC2C(CO)C12,0.2456
N#CC1CCC2OC2C1,0.3119
C1CC23CCC2OC13,0.2975
COCCCC(=O)C#N,0.1793
CC1C2C3C2C(=NO)C13,0.2523
C#CC1CC2(CN2)C=C1,0.2429
O=C1C2CC3(C#N)C2N13,0.2439
COCC1=CCCC1,0.2604
CC(C)C1(C)CCC=C1,0.2621
CC1OC2C3CC3C12O,0.2933
OCC(O)C1CCC=C1,0.2565
COC1(COC1=N)C#N,0.2572
CC12OC1C1OC21C#N,0.2552
OC12C3CC3C1C2C#N,0.2554
COCC12NC1CC2O,0.304
Cc1cc(cc(c1)F)O,0.2233
NC(C#N)C1CN=CO1,0.271
CC(=O)NC12CC(C1)C2,0.2723
NC(=O)C(N)(CO)C#N,0.2507
CC12COC1=NC1CC21,0.2445
COCCC(=O)CO,0.2354
CC1(C)CC(C#N)C1=O,0.2172
CC1CC1C1C2COC12,0.3094
C1OC11C2NC2C2OC12,0.2964
C1CC12C(=O)OCCN2,0.2407
CCC1CC1OC=O,0.277
COCCCC1COC1,0.3206
CC1CC11OCCC=C1,0.2421
C1CC23OC4C2C=C1C34,0.1852
CCC1OCC=CC1=O,0.1775
CCC1=NNC(=N)C=C1,0.1584
CNc1cnncn1,0.1779
CC(CC1CCC1)C=O,0.226
Cc1cn[nH]c1C,0.2508
OCC1OC2C(C=O)C12,0.2128
CC(=NO)C1C2COC12,0.2416
NC1=CC(=O)C2OC12,0.1859
CCCC1OCOC1=O,0.2743
O=CC(=O)C1CCO1,0.1449
O=C1CN=C2C3CC3N12,0.2297
CC1(C)N2CC2C1=O,0.2176
O=C1CC(O1)C#C,0.279
OCC1(CC1)C1NC1,0.3112
COCC1CC1O,0.3236
CC(C)C1(CC(=O)C1)O,0.2166
CC(C)C(C)C(C)=O,0.2298
O=C1NC=NC1C1CC1,0.2254
CCC1N2CC1(C2)C=O,0.1888
C(=O)C(=O)NC(=O)N,0.1711
OC1(COC1C#N)C#N,0.2677
CC12CC(C)(C1O)C2O,0.3111
CC1CC2=C(C1)N=NO2,0.2114
c1cnn(c(=O)n1)C=O,0.155
OC1C2C3N2C1C3=O,0.2342
COC1CC(C)C1=NO,0.242
O=C1CC2C(OC12)C#C,0.1989
CC12CC3C1C3(O)CC2,0.3206
OC1C2NC2C11COC1,0.3056
O=COCC#CC1CO1,0.2639
CCC#CC1(CC1)C=O,0.2222
CN=C1C=C(F)NN=N1,0.1586
CC1(NCC11CO1)C=O,0.2038
OCC1(OCC=C1)C#N,0.2469
c1cn[nH]c1NCC#N,0.244
OC12COC1C1CC21,0.2963
C1C2CC3C=CC2CC13,0.252
N#CC12CC(C1)CCO2,0.2859
c1coc(c1OC=O)N,0.1999
CC12NC(=O)OC1C2O,0.2915
CCC1(CC(=O)N1)C#C,0.2724
NC1=[NH+]C(=N)C([O-])=CN1,0.1438
C1OC23CC4OC(C2)C134,0.2785
CC12CC3C(CC13)C=C2,0.2491
Cc1c(c(=O)nco1)F,0.2086
COC1CC(C)(C)C1O,0.316
CCC1(C#N)C2CC1O2,0.2828
CC(NC(N)=O)C#N,0.2902
c1cc(nc(c1)O)N,0.2001
CC1=CC2CC(C2)C1O,0.2465
CCN=C(C=O)NC=N,0.1513
C(CNCCC#N)C#N,0.2822
CC12OC3C(C13)C2C#N,0.2713
c1nc2c(o1)oc(=O)o2,0.212
CCC1NC1(CC)C#N,0.2846
CC1C2NC2C11COC1,0.3061
[O-]N=C(CC1C[NH2+]1)C=O,0.1555
N=C1OCC11NC1C#N,0.2621
CC12CC3CC4C1C2N34,0.3009
CC1=CC2(C)OC2C1,0.2428
C1CN(C(=C1)CO)C=O,0.2093
C(=O)c1c(c(n[nH]1)O)N,0.154
CC12COC1CC2=O,0.2169
C1OC11C2CCCC1O2,0.3189
CC#CC1N=COC1C,0.2675
O=CC12CN1C1CC2C1,0.2052
c1cn2c(n1)oc(n2)N,0.2305
CC1C2OCC12C1CC1,0.3006
N#CC1NCC11CC1,0.2607
COC1CC(O)C1C,0.3197
CCCOC(C)CCO,0.3276
CC1OC2(C)CCC12C,0.3134
OCC1OCC1=O,0.2195
N=C1COC(=O)CO1,0.261
Cc1c(nco1)CC=O,0.2105
CC#CC1NC1C(C)=O,0.2195
CC1NC=CC1=NO,0.1754
CN1N=C(O)NC1=N,0.2331
OC1CC11C2CC3C2N13,0.2871
CCn1c(c(nn1)N)N,0.2266
[NH3+]C1(CC([O-])=O)CC1O,0.2725
CC12CC(C)(C1)C(=O)N2,0.259
CC1C(CC=O)OC1=O,0.2257
OC1CC2C3C4CC13C24,0.3354
OC1C=CCOC11CC1,0.2495
C1COC(OC1)C(=O)N,0.2692
CCC12OC3C(C13)C2C,0.3008
CC(C)N=C1CN=CN1,0.2212
CC1OCC11CCOC1,0.3131
CC#CC(C)(O)C(C)C,0.2922
C#CC(C#N)C1COC1,0.2678
CCC1C2C3CCC1C23,0.3327
CN=C(N)N1CCC1=O,0.2217
C1CC1CC(=N)NC=O,0.2288
CC1C2OC(CO)C12C,0.302
C#CC12CN3C(C=C1)C23,0.2279
CC1C2C(O)C2N2CC12,0.2836
OC1COCCC2NC12,0.2978
CCCCOCC1CC1,0.338
OC12CC1C(=O)C=C2,0.1849
CC(C)(C=O)OCC#N,0.2268
CC1(C)COC1CCO,0.3199
COC12C3OC1CC23O,0.2821
CC1(O)CC1(CO)C#N,0.3001
CC(C)N=C(C=O)N,0.1842
OC12C3C4OC1CC2C34,0.288
CCC(C)C#N,0.3527
CN1C2C3(C)NC3C12C,0.2662
CNC(=O)C(O)C(C)=O,0.2164
OC1C2CC1N=COC2,0.2638
CN1C=NC(=N)C=C1F,0.1901
CC1C2CC2(C)C1=O,0.226
C1NC1C12OC3C1NC23,0.2874
CC1(CC1)C([NH3+])C([O-])=O,0.2657
CC(=O)N1CC(C1)C#N,0.2635
C1C2NC3COC=NC123,0.2193
c1c(cn[nH]1)CCO,0.2596
CC(O)(CC#C)C=O,0.2244
CC(C=O)C1=CCOC1,0.1999
CCc1ccc(o1)C,0.2282
CC1OC1(C)CC=O,0.2231
CC#CC,0.3096
C#CC1OCCC2NC12,0.2815
COCc1c(cn[nH]1)O,0.2321
CC(O)CC1OC1C,0.316
CC1N2CC1(O)C2C#C,0.268
C1C2CC3OCC3N12,0.3106
c1c(nncn1)OC=O,0.1656
CCC1=NC(=N)N=NN1,0.1804
C1N2C3C4OCCC13C24,0.3007
CC1=CNC=C1C1CN1,0.2492
CC1C=CC2=CON=C12,0.2042
CC(=O)c1cc[nH]c1N,0.1774
CC1OC(=N)NC(=O)O1,0.2679
OCCC1CCC=CC1,0.268
CC1CNCC(=O)C1O,0.1883
NC1CN2CC12C#N,0.2542
CN1C=NC(C#C)C1=O,0.2247
CN(C)c1cnoc1N,0.221
N#CC1(C#N)C2CCC12,0.2865
O=CN1C2CC1C(=O)C2,0.2141
CC1(O)C2C3CCC1C23,0.3197
OC1COC2CCC12O,0.2965
COCc1c(cn[nH]1)N,0.221
CC1C2NC2C2CN12,0.2907
OC12COC3C(C13)C2=O,0.2424
OC1=COC(=N)OC1=O,0.1864
OC1C(=N)NC=C1C=O,0.1798
CC(CC#N)C(=O)C#N,0.2085
N=C1NC(=O)ON=N1,0.1872
C(C#N)NC(CO)CO,0.2676
OC1C2CCC12CC#C,0.2958
COC(C)C12CC1CC2,0.3287
COC1CC1(C=O)C#N,0.22
CC1OCC2OCC12,0.3236
CCC1(O)C2CC1C2C,0.3246
CC1(C)OC1C1CCC1,0.3372
OCC1=CC(=O)C2NC12,0.1806
c1c(c(=O)c(no1)N)F,0.1739
C1C2=CC3C=C1C1C3C21,0.0841
N#CC1NC23CN(C2)C13,0.2347
OCC1C2CC1C2C#N,0.3004
OCC(C#N)C1CCC1,0.3068
OCCC(C#C)C1CO1,0.3
CC1=COC(=N)N=C1F,0.1741
CCC1=CC2CC2C1,0.2435
CC1(CC(=O)O1)C(N)=O,0.2584
CC(C)N(C)C(=O)C#N,0.219
O=CCC12COCC1N2,0.2202
CCn1c(=O)[nH]nc1O,0.258
N=C1COC(CC#N)O1,0.2905
CC1CC1OCCC#C,0.301
OC1C=C2COC2C1=O,0.2188
OC12CC1C1OC=NC21,0.2614
Cn1c(ccc1N)C=O,0.1673
CCC1NC1(C=O)C=O,0.2078
CCc1ncc(cn1)C,0.207
COC1CC2(O)C(O)C12,0.2995
CC1C2OC1(C)C1NC21,0.3125
CCc1c(c(c[nH]1)O)O,0.228
CCCC1OCC2CC12,0.3356
N=C1CC2(CCCC2)O1,0.2872
Cc1cc(ncn1)O,0.2317
O=C1OC2(CCC12)C#C,0.2705
CC1C2CCC(=O)N12,0.2399
CCC1CC(C)C1O,0.3121
C#CC1(NC2CC12)C#N,0.235
CC(O)CCOC=N,0.2832
CC1C2CN2C1CO,0.3059
CC1C(CC1=O)NC=O,0.2143
CC12CC1(O)CCC2,0.3277
COC1(C)C2C3CN2C13,0.3087
CCC1=CCC2CC12O,0.2444
CCC1CCOC=NC1,0.2588
COC1(C)COC2CC12,0.3149
O=C1CC2NC2C1C#C,0.2196
C1CC11C2C3CC=C1C23,0.1714
Cc1coc2c1C=CC2,0.192
CC1CC2NC(=O)C12,0.2689
NC1=NC(F)=CNC1=N,0.1578
CCc1cocc1NC,0.2223
CC1(O)CC2CC2C1=O,0.2203
c1cncc2c1occ2,0.2042
CC1=CC2CN2C1C#N,0.232
CC1(C)CC11CC2CN12,0.3119
CNC(=O)C1(C)CN1,0.268
CC(C)CC(O)CC#N,0.3145
COC1CCC1CC#C,0.3075
COC12CC(C1)OC2=O,0.255
CC12C(O)C1CC2(C)O,0.3076
O=CC12CC(C1)(N2)C=O,0.1941
CC1=CC2C3OC2C13O,0.2224
CC1(CCC1)CC(=O)N,0.2703
CC(C)C1C(C)N1C,0.2851
OCC1(CCC#N)CN1,0.2994
O=CC12CCC1CC=C2,0.2154
C1Cn2c1noc2=O,0.2468
CN1C=NNC(=O)C1=N,0.1897
CC(O)(C=O)C(N)=O,0.2139
O=C1CC2CC12CC#C,0.2306
CC(=O)CC12CCC1O2,0.2248
CN1N=CC(=N)C=N1,0.1753
CC1COC=NCC=C1,0.2359
OCC1CC2(CN2)C=C1,0.2452
OC1CNC11COC1=N,0.2565
O=CNC12CC1CC=C2,0.2474
O=CC1=CCCC2CC12,0.1942
COC1CNC(=O)CO1,0.265
Cc1cnc(cn1)O,0.1939
C1C(CO1)(CCCO)O,0.3124
CN=C1ON=CC(C)=C1,0.161
OCC(O)C(=O)CC#N,0.2315
c1c(n[nH]n1)COC=O,0.2534
CC1(CCC=CC1)C,0.2684
C1C2C=CC3OC2C13,0.2369
CCCNc1ccno1,0.2235
C(C=O)c1nc(on1)N,0.2178
OC1C2C3OC(=N)C1C23,0.2685
O=C1CNC11C2CCC12,0.2053
CC1(C2C[NH2+]C12)C([O-])=O,0.1603
CC(C)Nc1ncno1,0.2398
CC#CC12CN1C(=O)C2,0.2287
CC(O)CC(C)CCO,0.3325
Cc1ccc(n1C)N,0.2327
OC12CC1OC(C2)C=O,0.213
CCC1CC2(COC2)O1,0.3113
CC1=NCC2C(C#C)N12,0.235
OC1COC2CC2C1=O,0.2097
OCC12CC3NC1C23O,0.2784
O=C1NC2C3CCC1C23,0.2609
C(C1CO1)C1=CN=NN1,0.2533
OC1CC1(C=O)C#C,0.1999
C1C2OCCOC1C=C2,0.2383
NC1=C(OC=N)C=CN1,0.2157
CN1CC(C#N)C2CC12,0.2567
N=C1NC=NC=C1C#N,0.1619
c1cc(=O)onc1C=O,0.1665
CC1C2CCN1C2C#N,0.268
O=CCC#CC1CCO1,0.2209
O=CC12CCC1CCC2,0.224
CC12CNC1C(=O)OC2,0.2427
OC12CC3N(C1)C23C=O,0.2017
CCC1CN=C(CC)O1,0.2693
Cc1cnc(o1)C,0.2372
O=C1C2C3C(C#C)C1N23,0.2331
C1C2CCOC=NC12,0.2526
O=CC1NC11CCC=C1,0.2048
OC1(CC1N1CC1)C#N,0.2756
CN1CC2C1=NCC2=O,0.2028
CC1CC23COC2C1C3,0.2984
OC1C2CC3CC3(O)C12,0.2931
CCC1(CCC1=O)CC,0.2154
OC1C2CCC1C1OC21,0.3227
C#CC1CCCC11CO1,0.296
COC1C2C3C2C2C3C12,0.2994
CC1NC11C2NC2C1O,0.2971
CN=C1OC(=O)NC=N1,0.2051
O=CC1=NCC(O1)C#C,0.1912
c1cn(cn1)C(=O)N,0.2155
O=COC1CC1CC#N,0.2781
CCn1c(cc(n1)O)N,0.2396
Cc1noc2n1ncn2,0.2379
C1C=C(C(=O)N1)CC#N,0.223
CCC1CN1C(C)C#N,0.2783
CCOCCC1CN1C,0.3084
CCCCC1CC(=O)N1,0.284
CC1(CO)C2CC1C2,0.328
CC1OC2C1CCC2C,0.3192
CCC1(CC1)OC=NC,0.2729
N#CC12CN1C=NCC2,0.2343
CCC(CO)C#CC=O,0.2051
CC(O)C1NC2COC12,0.2915
CCOc1coc(n1)N,0.2231
CN1C2CC(CO)=CC12,0.2301
CC12CC1C1(CC1)C=C2,0.2359
c1[nH]c2c(n1)NCC2,0.2079
CC1C2CCC12C,0.331
C#CCC12CCC1CC2,0.3039
C1C2C3C4C5CC13C2C45,0.3523
C#CCC(C#C)C#N,0.2831
COC1(C)C2C3CC1C23,0.322
CN=C1NC2COC12,0.2412
CC1(CO1)C1(C)CCO1,0.3204
N=C1NC(=O)CCCO1,0.2369
CC1CC(CO)C1C#C,0.3022
OC1COC2=C1N=NO2,0.1756
C1OC1C1C2CCCN12,0.3027
OC(CC1CCC1)C#N,0.3053
OC12CC(C=C1)N1CC21,0.2278
CC1CC1C1OCC1=O,0.2225
CC1C2C3C4C=C1C2N34,0.1763
COC12CCC1C2CO,0.3125
COC1CC11CC(=O)C1,0.2208
COCC12NC3C1NC23,0.2909
C1CC23OC2CCC3O1,0.3308
O=C1COC(CC#C)C1,0.2185
COC1(C)CCN=CO1,0.2767
CC12C(CO)C1OC2=N,0.2767
Cc1nc(c(o1)N)C#N,0.2104
CC(=O)C12OC3C1OC23,0.2034
CCC12COC1(C)C2O,0.2808
O=C1NC=CC2CC1C2,0.205
CCOCc1cnco1,0.242
c1cc([nH]c1C#N)N,0.1914
CC(=O)COC(=O)C#C,0.2141
CC(O)CC1C2CCN12,0.2895
COC12CCC1OC2,0.3008
CC1C2CC1(CO)CC2,0.3358
CNc1nc([nH]n1)C#C,0.1787
CCC1NC(=O)N2CC12,0.2857
CCCC(=O)C1CN1C,0.2041
CC1C2C3CN1C2C3=O,0.2215
CC1NC1CN(C)C=O,0.2683
N=C1OCC1CC1CO1,0.2844
C1OC11C=CC2OC12,0.2332
O=CC1CN2N=CN=C12,0.2093
CCC1CCN1C=O,0.2639
c1c(c(on1)N)C(=O)N,0.2185
CC12OC3C(C=C1)C23,0.2288
OC1C2OCC1N1CC21,0.31
CCCOC(C)CC,0.3338
CC12OC1C(=O)C1NC21,0.1911
C1OC1C1COC2CC12,0.3182
O=C1CNC(C1)C#N,0.2246
OC1C(CC#N)C1C#C,0.2824
NC1=NC(=N)OC(O)=N1,0.207
CC1N2CC2C(=O)C1=O,0.1384
CC#CC1NC(=O)C1O,0.2516
Cc1cnc(c(=O)o1)N,0.1609
C#CCC1(CCCC1)O,0.2987
C1CC1OC=O,0.2785
N=C1OCC2NC12C=O,0.213
O=C1C=CC2C3CC12C3,0.1795
CC(C#N)C1CCC1C,0.3338
N=CN1CC1(C#N)C#N,0.244
Cn1c(cccc1=O)N,0.1746
OC1CC2=CC3NC3C12,0.2374
CC12OC1C1C(C=O)C21,0.2283
O=CC1(CCO1)C1CO1,0.2101
OCC1OCC11CC1O,0.2783
CCC1(CC1)CO,0.3339
CC1C2C3C4OC1C4N23,0.2925
c1c([nH]c(=O)o1)C=O,0.1702
c1c([nH]c(c1O)N)CO,0.2141
CN(C)c1c(con1)N,0.2187
C1C2CC34CC(C3)C4C12,0.3405
CC(OC(=O)C#N)C#N,0.2466
COCC1CCC1(C)O,0.3214
CCC#CC1(CC1)C#C,0.2622
CCNC(C)(CO)C#N,0.2671
C#CC1NCC1C#N,0.2626
C1C2OC2CC2OC12,0.3332
CC12CCC3(CC3)C1O2,0.3438
CC(O)C1COC1C,0.3061
CCCNC(=O)CCO,0.2777
C1CC(=CC(=NO)C1)N,0.1838
C#CC1CC1C#C,0.2713
N#CC1NC11CN2CC12,0.255
C1CC11C2CC3C2N13,0.3253
CC1(CC(C1)O)C,0.3286
C1CC2OC3C(C=C1)C23,0.2433
O=C1CCOCC2OC12,0.2166
CC1C2OC(=N)C(C)C12,0.273
OC1=CC(=N)C(O)=CN1,0.1864
CC12C3CC1NC23C#N,0.253
COC1CC1(O)CCO,0.2975
CC12OC3C1OC23C,0.303
OCC1OCC1OC=O,0.2556
OCC1(O)CC2(CO2)C1,0.3116
c1c(c(c[nH]1)N)CC=O,0.1615
CC1OC2CC1(C)C2O,0.3235
CCN1C2CN3CC1C23,0.266
CC12C3CC1CN23,0.3312
CC1(CC(O)CO)CC1,0.3092
FC1=NNC(=N)NC1=N,0.1833
OC1CCC2NC12C#C,0.2667
N#CC1C2C3OC3C12,0.2731
CC(=O)NCC1CC1,0.2771
CN=C1OC(CO)C=C1,0.205
c1c(coc1N2CC2)O,0.2179
CC(O)C#CC(C)C=O,0.218
CC(CO)OC(=N)C=O,0.1931
OC12CC3(O)C1COC23,0.2865
O=C1OCC2OCC12,0.2683
C1CCC(=CC1)NC=O,0.215
CC1(O)COCC2OC12,0.3306
C1C2CC3CC12N=CO3,0.2364
C1CC(=O)C(=O)OC1,0.1786
O=C1CC2NC(C#N)C12,0.2145
C#CCC12CC(C1)C2,0.3136
C1C=CNC(=O)O1,0.2271
CC12COC(C=O)C1O2,0.2205
O=C1C2CC11CCC1C2,0.2285
O=C1CC2(CN3CC23)O1,0.2579
CC1OC2=NCC(O)C12,0.2675
CC(=O)CC1CC1C#C,0.2322
CC1NC1C1CC2CN12,0.3013
C#CC#CC1C2CCC12,0.2177
CC1(CCC=C1)NC=O,0.2642
C#CCc1cnnnn1,0.1643
Cn1c(ccn1)C#C,0.2116
CC1C2(O)CCC12O,0.291
c1c(=O)c(con1)F,0.186
OCC1COC1CC=O,0.2239
COC(C)(CCO)C=O,0.2177
C#CC1=CCCC(=O)N1,0.1873
CC1N(CC1(C)C)C=O,0.265
C1C2OC3OC1C1C2C31,0.3238
CC(=O)OC(C=O)C#N,0.23
NC1=CC(=N)OC(O)=C1,0.1765
OC12CC3C4C3C1(O)C24,0.2625
O=CNC12CC(C1)C=C2,0.2403
CC1COCC(=O)N1,0.2639
CCCOC1CCC=C1,0.2635
CC12OC3C1NC(=O)C23,0.2389
CCOC(C)C1NC1C,0.3162
CNc1cc(=O)nc[nH]1,0.2023
C1C2OCCOC=NC12,0.2281
CC(C)(C)C12CC(C1)O2,0.3089
CC12OC1C1CC2C1O,0.3176
c1c(nc(o1)N=CN)O,0.1686
CC1(CC1)OCCO,0.3374
CC1C=CC2OC12C=O,0.2171
CC1OC2(C)C3OC2C13,0.308
CN=C1OCC1(C)CO,0.2787
C1C2C3C4CC1CC2C34,0.3248
CC1C(C)C1(C)C=O,0.2323
C1COCC=CCO1,0.2306
OC1CC11C=CCC1=O,0.2188
COCC(OC)C=O,0.2133
C(CO)NC(=O)CC=O,0.2207
C(C=O)C(=N)NC=O,0.2169
C1CC(=O)OCC1=NO,0.2519
CC#CC(C#C)C#C,0.2869
CC1(C)CC2(CC12)C#N,0.2889
OC12CC1CC21CO1,0.3111
CN1C2C3C=CC2(O)C13,0.1958
CC1=CCC2CC12C#C,0.2417
COC1(C)CCCCO1,0.3406
C#CC#CC(=O)C(=N)N,0.1598
C(CO)C#CC(=O)C=O,0.1553
CC1(C#N)C2C3CN1C23,0.2761
O=CCC1CN1CC#C,0.216
CC1CC2=NC(C)=NN12,0.2657
C1C(=NO)CNC(=O)N1,0.2368
CCC1CN1C1CC1,0.2997
c1cc([nH]c1)CN2CC2,0.2419
C#CC1CC2(CN12)C#N,0.248
OCC12CC(C1)(C2)C=O,0.219
OC1=C(OC=N)OC=N1,0.2175
C1OC2C3OC12C1OC31,0.2988
CCc1ccoc(=O)n1,0.191
OC12COC1C1CCC21,0.2989
C1C2CC=C3CCC3C12,0.2526
OC1C2CCN2C1C=O,0.1653
C#CCc1c(onn1)N,0.2089
CC1C(O)C1C(N)C#N,0.2936
O=CCCCC1CCO1,0.2271
OC1C2CCC1N=CO2,0.2663
COC(C(C)O)C(C)O,0.32
CC(C)CCCNC=O,0.2833
C1CC2(CC2)OC13CC3,0.2948
O=C1CC2CCC3C2N13,0.2381
CC1CC2C(C)C(O)C12,0.3024
CC(O)CC(C)CC#C,0.3139
C#CC(=O)C1CCC1,0.2034
CCC12CC1C(=O)N2,0.2547
OC1=COC(=N)NC1=N,0.1973
CCC12CC1C(=O)O2,0.2766
CC1N2CC(C2)C1=O,0.2049
CC1CCCC1OC=O,0.2864
COC1CC11OCC1C,0.2816
O=CCCC1OCC=C1,0.2226
Cc1c(n[nH]n1)C(=N)N,0.2153
CC(C#N)C1CC(=O)C1,0.2222
C#CC1(CC1)CC=O,0.2188
CC(=O)C1(O)CC1(C)O,0.2245
C1C=CC2=NCC(=O)N21,0.19
OC1C2OC2CC2OC12,0.3223
CC1CC2=CNC=C2N1,0.2205
OCC1OC1C1(O)CC1,0.3185
CC12C3CC1OC(=N)N23,0.2822
CCC1CC1(C)NC=O,0.2749
CC(=NO)C1CC2OC12,0.2525
CC1C2CC1(C#N)N2C,0.245
CC1OC2CC3C(C2)C13,0.3117
C#CCC1COCC=C1,0.263
CC1NC(=NC1C)C#N,0.199
OCC1=CC(O)CC1O,0.251
C1C(=NO)C(=O)OCO1,0.1984
CC12CN1C(=O)C21CC1,0.2322
Cc1c(c(n(n1)C)N)O,0.2333
CC(=O)CC(=NO)C#C,0.1925
C1CCOC(=O)C(=O)C1,0.188
O=C1OC2CC1CCC2,0.2741
C1C2C3NC3CCCN12,0.2818
CC(C)CC1CCOC1,0.3115
CN1CC1CCCC=O,0.2068
CC1CC2COC(C2)C1,0.3157
CC1=CC2COC1OC2,0.2478
c1c(cn[nH]1)C=O,0.2081
c1conc1NC2CC2,0.2237
CC1COC2=C1C=NN2,0.2419
O=C1C2CC2C2CCN12,0.2563
N=C1N=NOC(=N1)C#C,0.2002
N#CC1CC2C3CN3C12,0.2593
CC#CC(=O)CCC#N,0.2107
Cc1ccc(oc1=O)O,0.1723
CC1CC=CCC1C,0.2682
c1(nn2c(o1)nnn2)N,0.242
C(C#N)c1c(n[nH]n1)N,0.2166
CC12NC1(C)C(=O)C2O,0.2214
CC(O)CC1OCCO1,0.3336
CNC1CC(=O)C1C#N,0.1913
CCC(C#N)(C#N)NC,0.256
CC1(CO)C2COC12,0.3
CC1(CCO)CC=CC1,0.2655
NC1CNC1(C#C)C#N,0.2428
OCC1C=CCC2OC12,0.2666
CC12CC3(CC(=O)C13)C2,0.2177
CC12CC(OC=N)C1N2,0.2721
CCC1C2CC1C2(C)C,0.3718
CCC1C=C2CN3C1C23,0.1745
C1CC(=O)CC=CC=C1,0.2066
COC1CC(C)C1(C)O,0.3259
CC12C3CC1OCCN23,0.3068
OCC12OC1CC2C=O,0.2254
NC1CNC(=N)NC1=O,0.228
COC=NCC(C)O,0.2599
CC1C(O)C1CC(N)=O,0.2694
C#CC1CCC1CC#N,0.294
CCC1NCCNC1=O,0.2599
OC12CC1(C#C)C1CC21,0.2592
CCC(CO)CC1CO1,0.337
CC1OC(C)C11CN1,0.3113
OC12CC(C=C1)C2C#N,0.2362
CCc1c(c(no1)C)N,0.2137
CC#CC1(C)CN1C,0.2636
C1COC2C3OC3C2O1,0.3133
N=C(OCCC=O)C#N,0.2067
CCC1C2C3CC3(C)N12,0.3077
C#CCC(=O)CC=O,0.2105
C#CC1CN(C1)C=O,0.2665
CC12NCC1OC2CO,0.2842
CC1CC(CO)=CC1C,0.2582
c1c2c(c([nH]1)O)NCC2,0.2256
CCC12NC3C1N(C)C23,0.2808
C#CC1CCOC1,0.3015
COC1=NC=NOC1=N,0.1795
OC12C3C1C1(O)C3OC21,0.3035
OC1C2CC(CC12)C#N,0.3007
c1c(nn[nH]1)C(=N)N,0.2205
CC1C2OCC3C2C13C,0.3201
CC1=CC2C3OC2(C)C13,0.2241
O=CC1=NC(CN1)C#C,0.1674
OC1CC2(O)C3NC3C12,0.2857
CC1OC(C)C1C=O,0.2108
CC1CC11CC(O)C1,0.3343
C#Cc1coc(c1N)O,0.1884
CC#CCC(C)(O)CO,0.2909
CCC1CCC1O,0.3275
CN=c1occ(o1)N,0.2323
[O-]C(=O)C1[NH2+]C2CC1C2,0.2662
CC1OC1(C)CC(C)=O,0.2267
CC#CC1(C)CC(C)O1,0.2794
C(c1noc(=O)o1)O,0.2691
COC1C2NC2(C)C1O,0.2963
OCC1CC11CC2CC12,0.3093
COC1(C)OCCC1C,0.3326
CC(C)C1(CC1)CC=O,0.2253
CC1CC(C#N)C(=N)O1,0.2739
C1C2C3C1C21COCC31,0.3319
OC12CN3CC1C23C=O,0.193
C1CC1COCC2CC2,0.3389
CCCC1C2OC(=O)C12,0.277
CC1C2CCC(O)C1O2,0.3038
CC(C)N1CC(C1)C#N,0.2583
OC12C3N=C4OC1C4C23,0.1509
CC1(CC(=O)C1O)C#C,0.214
CCc1cc(n(c1)C)O,0.2379
CC#CC1COC(C)O1,0.2844
C1C2CC3CCC2C13,0.3663
OCC1C2C1C(O)C2O,0.305
CC(O)C1OC2CCC12,0.3016
c1cc(ncc1C=O)O,0.1904
CC(=O)CC1C2CC1O2,0.2171
CC1C(O)CCC1(C)C,0.3275
CC1(O)C2COC1C=C2,0.2427
N=C1CCOC(=O)CO1,0.2607
c1cnc(cc1F)F,0.2383
C1CC1N=CNC(=O)N,0.2354
CCCC(C#C)C#N,0.2986
Cc1c([nH]nc1O)O,0.2554
O=C1C2CC3(CO3)C1O2,0.2303
Cc1c(nc(o1)OC)O,0.2273
CC1(CC1C=O)OC=N,0.2258
CCC1CN1CCC#N,0.2785
O=COCC1(CN1)C=O,0.2233
O=C1NCC2OCC12,0.2676
CN=C1OC(C)C1C#N,0.2717
Cn1ccc(=O)c(n1)N,0.1771
N=C1OCC1C(=O)C#N,0.1898
CC1CC(O)CC(=N)O1,0.2774
O=C1C2CC(O2)C1C#N,0.2111
CC1COC11CC(=O)C1,0.2134
CCCCC#CCO,0.2782
CCOCc1c[nH]cn1,0.2533
OC1CCC(=O)C1,0.2209
CC(C)COC(=O)NC,0.3155
CC12OC1C1CC21,0.2953
O=CC1CC2OC=NC12,0.226
CCC(CC#N)C(C)O,0.2984
N=COC1CCC2OC12,0.2795
CC1=CCC2(C)OC12C,0.2455
CC(O)(CC1CN1)C#C,0.2678
CCCCC1CC1C#C,0.2907
OCC1CCOCCO1,0.331
CC1(O)CC=CC(=O)C1,0.1889
CC12CN1C(=O)C(O)C2,0.2305
CC12CCC1N=C(N)O2,0.2761
CC1CCC(C)=C1,0.2589
O=C1CCC2OCCC12,0.2203
CCC1COC1C#N,0.278
CC(O)C(N)C(O)C#N,0.2676
O=CC12OC1C1CCC21,0.2095
OC1CC23CC2(CC3)C1,0.2903
CC1(CC(=O)CO1)C,0.2192
CC1CC11C=CCC1=O,0.2207
CN1C(=N)CN=C1C#C,0.1826
CC12COCC3C1CN23,0.3118
C#Cc1c(ocn1)C=O,0.1742
CC1NC1CC=O,0.2209
CNC(=O)C(C)OC=O,0.2499
N=COC1(CC=O)CC1,0.2223
Cc1c(cc(=O)[nH]n1)F,0.1797
CC1N(C)C1(C)C1CO1,0.296
CC1CC(=O)C1O,0.2229
Cc1nc(c(o1)N)N,0.216
CC1OC(=O)C1C=O,0.2247
OC12CCC1OCCC2,0.3155
CC1C2N1C1(CC1)C2=O,0.2209
CC1C(O)C1N1CC1,0.3042
CN=C(C#N)N(C)C=N,0.1876
CC1=CC(=O)CCC1,0.1894
CC12COC1CCCC2,0.3174
[O-]C(=O)CC1C2C[NH2+]C12,0.2702
CN1C2CC(O)(C=O)C12,0.1995
CCC1C2OC1(C)C=C2,0.2362
C1OC11CC2COC12,0.2945
CN(C)C(CC#N)C=O,0.1726
CCCC(CC#N)C#C,0.3061
CC1CC(=O)NC(C)=C1,0.2138
Cc1cc(oc1NC)O,0.2267
C#CC(=N)N(C=O)C=O,0.1961
CC(C)(c1cnoc1)O,0.2448
C1CC1OC1=NCCN1,0.2744
CC1NC1CC(=O)CO,0.2308
CCC(O)C(O)C#CC,0.279
CC1CC2CC3CC3C12,0.3308
CC12CC(C1)C(O2)C=O,0.2149
OC(CCCC#C)C#N,0.277
ON=C1CN2C(C#N)C12,0.2291
C1N=C2OCCC3C1N23,0.2434
CC(O)(CCCO)C#C,0.3004
OCC1C2COC12C#N,0.2507
CC1COC(=O)C2OC12,0.2503
NC12CNC1C2(N)C#N,0.2397
OC1CN2C1COC2=O,0.2858
CC(O)C1C2C3CC3C12,0.2798
CC1(CN1)C1(O)COC1,0.3089
CCC1(C)COCO1,0.3323
CC1OCC1N(C)C=O,0.2674
C1C2C3C4C2CC1N34,0.34
CC1OC(=N)C2CC1N2,0.2675
C1CCCOCC1,0.3242
N=C1OCC2CC12C#C,0.2661
CC(C)(O)C1CC2NC12,0.301
CC1CCOC(=O)CO1,0.2558
CC(C=O)N1CC(O)C1,0.2083
N=C1CC(CC=O)O1,0.2245
OCC1C2CN2C1=O,0.2298
CCCc1cc([nH]c1)C,0.2409
OC12CC1C1(O)CC1C2,0.3169
CC1(COC1(C)C)C,0.3116
OC12CNC1C2(O)C#N,0.2474
OC1(CCOC1=N)C#N,0.2719
CC(O)COCC1CN1,0.3204
CC1OC2C(CCO)C12,0.3074
CCCC1CC1(N)C#N,0.2799
NC1=COC(=N)C(=N)N1,0.1678
CC1(CO)OCOC1=O,0.2629
O=CC12C3CC1=CCC23,0.178
CCC12CC(C1)OCO2,0.3243
O=C1C=C2C3C4C2C1N34,0.1501
c1cn(nn1)CCC#N,0.2527
CCC1OC(C)C(=O)O1,0.2731
C1CC1CCCO,0.3423
CC(C)(C#N)N1CC1,0.2835
c1c(c(c(o1)N)C#N)N,0.1961
OC12CC1NC2C#C,0.253
c1cc([nH]c1)NCC=O,0.1721
OC1C2CCN3CC3C12,0.2785
C1C(=CC(=O)CO1)CO,0.1804
N=CN1C(=N)CCC1=N,0.2204
CC1CC(C)(O)CC1=O,0.2193
O=C1COC(C=C1)C#N,0.1776
CCOC1COC1C#C,0.2739
CC1OC(C)C1(C)O,0.3073
CCC(CC)C#CC=O,0.2048
N#CC1N2C3CC=C1C23,0.1704
CC12OCC3C(C=C1)C23,0.2357
c1nc(no1)NC(=N)N,0.1971
CC1OC1(C=O)C#C,0.212
O=C1CC(N1)C1CC1,0.2844
C1OCC11C2OC1C=C2,0.2342
O=C1C2C3C1C1(CC1)N23,0.2254
CCC1(CO1)C(C)C#C,0.3054
O=C1CCC11CCC=C1,0.2081
CC1CC(C)C1(C)C#N,0.3268
NC1CC(O)C1(N)C#N,0.269
C#CC1C=CCC2OC12,0.2662
CC1(O)CCC(=C1)C#C,0.2075
O=CCC1C2NC2C1=O,0.21
CC(C)CC(F)(F)F,0.4117
Cc1cnc(=O)[nH]c1N,0.1797
CC1=C2CCN=C2OC1,0.2054
CC(=O)n1cccc1N,0.156
CCOC(C)(C=O)C=O,0.1872
CC1(C)OCOCC1O,0.3241
C#Cc1c(n[nH]c1O)N,0.2258
CC(C#N)C1(N)COC1,0.282
CC(O)CC1(CO)CC1,0.3067
CC1(OCC11CC1)C=O,0.2098
OC1C2CC3(CO3)CC12,0.2963
O=CC1=CC2C3CC1N23,0.1645
CNC(=O)OC(C)C=O,0.2278
CC1(C)CC11OCC=C1,0.2223
COC=NC1CCCC1,0.2671
CC1=CC(OC=N)=CO1,0.2262
CCC1(C)COC2CC12,0.3074
C1C=CN(C(=O)N1)C=O,0.2215
CC1(OC1C1CN1)C#N,0.2622
C#CCCCC(F)(F)F,0.3146
CC(O)C1=NC2CC2N1,0.2364
CC(N)(C#C)C#CC#N,0.2219
CCN=C1OCCC1O,0.2765
CC#CC(O)CCO,0.2888
CCC(=NCC)OCC,0.2723
CNC(CCCO)C#N,0.2741
CCN1N=NC(=N)N=N1,0.1628
C#CC(=O)OCCO,0.2297
CN1C2CCC12C(N)=O,0.2551
CCC(O)C(C)C(N)=O,0.2716
COCCCNCC#N,0.2704
O=CCC12CC1CO2,0.2154
OC1CC23OC(C12)C3=O,0.2392
CC1COCOC1(C)C,0.3288
C[NH+]=C(N)C1=CN=N[N-]1,0.1842
N#CC1C2CN2C11CC1,0.2724
CC1(CNC1C#N)C#C,0.2596
OCC1C2CC1C(=O)C2,0.228
C(CN=C(C=O)N)C=O,0.1806
CC12CN1CCC2=O,0.2179
COC(C)(C)C1CO1,0.3305
CC12CC(=O)C1OC=N2,0.2012
CN1CC([NH+]=C1)C([O-])=O,0.1478
O=CC1CCC1CC#C,0.2227
CC1CC(C)N=CO1,0.2717
O=C1CC=C(N1)C1CN1,0.2099
CC(C=O)C1OC1C,0.221
CC(C)(C)OC(=N)C=O,0.1919
CNC(=O)C1COC=N1,0.2492
CCn1c(=O)oc(n1)O,0.2575
CC12OC1CCOC2=N,0.2676
CC(O)CCC(C)C#N,0.3169
COC(=O)CC1CC1C,0.2832
CC12CCCC1(C)C2O,0.3063
COCCC(=O)CC=O,0.2117
CC#CC(N)C(N)C#N,0.2626
COC1C(=O)CC11CN1,0.1968
C1C2C1C13OC21CC=C3,0.2087
C1C(=CC(=O)C1=O)C#N,0.1269
C(C1CO1)C1CC2CC12,0.3421
CC12OC1C=CNC2=O,0.2064
CC1=CC(=N)OC(C)=N1,0.1826
C1CCC(C1)C(=O)C#N,0.209
CCC1C2CC1(C)OC2,0.3179
N#CC1OC2CCC=C12,0.2408
c1nc([nH]n1)N,0.255
CC1CN(C)C(=O)C1=O,0.1725
CCc1cc([nH]n1)C#N,0.2208
OC12CC3OC1(C#C)C23,0.2346
c1cnc(c(=O)[nH]1)C=O,0.1428
CCC1CC1(C)C#N,0.3159
OC1CC11CC2NC2C1,0.3103
CCCOC(C)C1CO1,0.3395
COC(=O)CC(C)O,0.2595
CN1CC([NH3+])(C1)C([O-])=O,0.2395
COCc1cn[nH]n1,0.2532
CCC12CCC1(N2)C=O,0.2179
O=C1CCOCC2NC12,0.2182
CCCN(CC)C(=O)N,0.2893
CCOC(=N)C(C)=O,0.2015
CNc1ccn[nH]c1=O,0.1749
O=C1OC2COC3C2C13,0.2616
C#CC12CC1(CC2)C#C,0.2351
CCC(CC)(C=O)C=O,0.2009
OCC1(CN1)C1CC1,0.2991
CC1C=CC2C(C#C)N12,0.2225
C1CC2(CCCC=C2)O1,0.2475
CC1C2C3C4CC(C14)N23,0.3221
c1c([nH]nn1)C2CCC2,0.2489
CC(CC(C)=O)C=O,0.2285
CCC12CC1CC(O)C2,0.326
c1c(c(no1)CO)C=O,0.1982
CCc1c([nH]nc1N)C,0.2331
c1ncn(n1)CC2CC2,0.2698
CC12C=CC3C1CCC23,0.2312
OCC(=O)C1C2CCN12,0.2094
FC1=CNC=NC1=N,0.1941
CN1C2C=CC(C#N)C12,0.2235
Cn1c(cnc1O)C=O,0.1789
C1CN(C(=O)OC1)C=O,0.2366
CC1CC=C(C)C(C)C1,0.259
CC1=CCCC2CC1C2,0.2487
COC=NCC(O)C#C,0.2493
N#CC12CC(C1)OCC2,0.2827
CCC(O)C1CCCC1,0.3316
N=CN1C(CC1=O)C#C,0.2302
CC(OC(N)=O)C1CO1,0.3211
CCNc1nc[nH]n1,0.2248
CN=C(C=O)N1CCC1,0.1549
Cc1c(c(c[nH]1)C#N)O,0.2011
COC1CC2NC2CO1,0.3135
OC1C=CN2N=CC=C12,0.1915
CCC1CC11CCC=C1,0.2457
OCC1(O)CC1C1CO1,0.2969
c1c[nH]c(c1C2CC2)N,0.2418
OC12C3CC1C(=O)CC23,0.2224
COCC1(C)C2CCN12,0.302
c1cnoc1C(=O)C=O,0.144
OC12CNC1=NCCC2,0.2452
CC1(CC#N)NC1C=O,0.2187
CC12C3COC1COC23,0.3243
CC#CC(=O)C#C,0.1883
CC(CC#N)(C=O)C=O,0.197
CC1OC=NC1CC#N,0.2693
CC(C)(c1ccon1)O,0.2524
CCC1=CC2NC2C1O,0.239
N#CC1OC2CCC2O1,0.2979
CCc1cnc(cn1)O,0.1938
COC(C)(CO)C#N,0.2955
O=C1CC2OC2CCO1,0.2633
CCN1C(=N)NCC1=O,0.2438
O=CC1C2C3CCC2C13,0.2202
O=CC12C3OC1C(=O)C23,0.1906
CC1C2OC1C2O,0.3021
ON=C1COCC11CN1,0.2263
c1c(nc(oc1=O)O)N,0.2006
OCC1N2C3CC1(O)C23,0.3016
CC1C2CC1(O)C1CC21,0.313
CCCC1CC2COC12,0.3132
CC1=CC(=N)OC=N1,0.1828
NC1C2C(O)CC12C#N,0.2779
C1C=Cn2c1c(nn2)O,0.1875
OCC(=O)CCC1CO1,0.2414
NC(=O)N1CC2OCC12,0.2869
CN1C2C3CCOC2C13,0.297
CC#CC1OC1C(C)=O,0.217
O=CC1=CNC2COC12,0.1816
OC1CN2C1=CN=C2O,0.2381
CC1OC1C1NC1C#N,0.2861
OCC1=CCOC1=N,0.2208
Cn1c(=O)nnoc1=O,0.187
OC1CC2C3OCC1C23,0.2972
CCC1C2OC1C2C#C,0.2763
CC1CC1(C=O)N1CC1,0.212
O=C1OCC2OCC2=C1,0.2106
OC1COCC1C1CC1,0.3085
CC12CCC1(O2)C#C,0.2594
COC=NC1C2CC1C2,0.2611
OCC1(O)C2CC=CC12,0.2334
Cc1cc(nc(n1)F)C,0.2169
CNC1=CON=CC1=N,0.1525
CC1N=C(OC1=O)C#C,0.2169
COC1CCNC(=O)C1,0.2667
CC1CC2=C(C)N=CN12,0.25
COCC1OCCCO1,0.3321
CC12CCC1C1OC21,0.3266
CC12COC1(C)C2C=O,0.2166
O=CC12CCC1CCO2,0.2189
CN1CC11C2C3CC1N23,0.3058
C#CC(C#C)C#CCO,0.2757
c1c(onn1)CC#N,0.2366
CC1OC(C)(C)C11CC1,0.3191
CC12CC1([NH2+]C2)C([O-])=O,0.2571
OC1CC2C(CC#N)C12,0.3117
Cc1c(nc([nH]1)O)O,0.2345
CC1CC2OC3COC123,0.2864
OC1CN2C3C4C3C2C14,0.276
CC(C)N(CC#C)C=O,0.2663
CC(O)C(C)C#N,0.3119
C1CCC(CC1)CC#N,0.3415
O=CC12OC1CC=C2,0.2187
N#CC12CC1CCCO2,0.2718
N=C1CC2=C(NN=C2)O1,0.2232
CN=C(OC=O)C1CN1,0.229
CC(C)C1OCCC1=O,0.2144
COC(C=O)C(C)CO,0.2177
C1C2C3C=CCOC1C23,0.2439
CC1C2CCC1C2(C)O,0.3234
CCC(CO)CCC#N,0.3182
CC(C=O)C1(C)CN1,0.213
C#CCO,0.2872
C#CC1C2CC2C2CC12,0.3012
OC1CCC(C=C1)C#C,0.2537
CCC12CN(C1)C2CO,0.298
N#CC12CC3(CC3)C1O2,0.2712
CC1C(=O)OC1(C)CO,0.2783
OCC1CN=C(N1)C=O,0.1649
CC(N)=[NH+]C1=CN=N[N-]1,0.162
CN1CCC(=O)C(=O)C1,0.1509
CCC12CC(CC1=O)O2,0.2116
c1(c(nn[nH]1)N)N,0.2262
N#CC1C2CN3CC2C13,0.2627
CCCCC(=O)C(C)C,0.2306
CC1(CCN1C=O)C=O,0.2032
OC1CCC2OCC2=C1,0.2471
c1c[nH]c(=O)cc1C#N,0.1587
CCNC1CC1(N)C#N,0.2656
COC1(CCCO1)C=O,0.21
O1C2C3OC4C1C4C23,0.2829
O=CC12C3C4C1CC2N34,0.2022
C#CC1C2C3OC2C13,0.2783
CC1CC1CCCCO,0.3425
NC1=CC(=O)C2CCC12,0.204
CCC1(CO)OCC1O,0.304
CC(CO)CC1(C)CO1,0.3353
CCC12CC(C)(C)C1O2,0.3288
CCN1CC1C(=O)NC,0.2402
N#CC1C2CC2C11CN1,0.2767
c1c(c(n[nH]1)CC#N)N,0.2186
COc1c(nc(o1)O)O,0.2282
O=CN1CC11CN2CC12,0.2467
N=C1OCC2=C1CCC2,0.2157
CCOC1CCOC1=O,0.249
C1CC2OC1CC1NC21,0.3077
[NH3+]C1C2[N-]C(=O)C12C#N,0.204
OC1CNC(=O)C11CN1,0.2515
CC1C2CCC1(C)C2=O,0.2258
O=COC1=NCC2CC12,0.2446
CC(=O)C(O)C#N,0.2375
C#CC1=CNC(=O)C1=O,0.1309
CCCC(O)CO,0.3173
CC1=CC2CC2COC1,0.2432
CCOCC(C)(O)CO,0.3198
CCCC1C2CC(=O)C12,0.2293
CC1(CCCCO1)C#N,0.2975
CNC1=NC=NC(=N)O1,0.1925
CC1CN1CC(=O)C=O,0.1215
CN(C=O)c1ccco1,0.2165
OC12CC3(C1)CC=CC23,0.258
N=COC1C2NC(=O)C12,0.2503
CC#CC1C2COCC12,0.2844
CNC(=O)N(C)C=NC,0.2455
OC1(CC1)C1COCO1,0.3202
Cc1nc(c(o1)N)C=O,0.1896
CC(N)C(NC=O)C#N,0.2589
CC1OC(=N)C1C#C,0.2854
O=C1COC1C1CCC1,0.2212
O=C(C1CO1)C1CO1,0.2053
CC1(CCO)CC1C#N,0.3056
ON=C1CCCC2CC12,0.242
CC1(CC(O1)C#C)C#C,0.2675
Cc1[nH]c(cn1)CO,0.2377
CCOC(=NC)C(C)C,0.2746
C1OC23CN4C2C=CC134,0.191
CC1CCC2=C1OC=C2,0.2297
CCC1OC2CC12O,0.301
CC1=NC(=N)OC(O)=N1,0.1995
CC1OC(C)C1OC=O,0.259
CC1CN2C1C21COC1,0.3054
O=C1CCC2OC=NC12,0.2065
CC1=C(O)N=CNC1=N,0.1748
CC12C3N1CC3(O)C2O,0.2976
COC1(CO)C2CC1O2,0.304
CCC(C)(CO)CC#C,0.3095
COC(=O)CC(C)C=O,0.2316
CN=C(CC#C)OC,0.257
OCCC1NCC1=O,0.2169
CC1(CC12COC2)C,0.3054
c1cnc(cn1)O,0.2013
CN(C=O)C(=O)C(=O)N,0.1835
CC1(CN1)C(=NO)C#C,0.204
CC(C=O)C1CC1C=O,0.2198
N#CC1CC2C3C1CN23,0.2694
O=CC1CCC(=O)C=C1,0.1814
C1NC1C1COCCO1,0.3041
c1ccc(=O)[nH]c(=O)c1,0.1632
OC12CC1C1COC1C2,0.3211
OCC1CC2(COC2)O1,0.3078
CC12CCC(OC1=O)O2,0.2677
CC1=CNC(=O)C1=NO,0.1429
OC1C2CC3(CC3)C1O2,0.3093
ON=C1COCC11CO1,0.2338
OC12CC1CCC=CC2,0.2585
CC12CN3C1C(CO)C23,0.2963
CC12CC(N1)(C=O)C=C2,0.2024
CCC1C2OC1C1OC21,0.311
C1C2(CNC(=O)N1)CN2,0.2961
OC1COC(C#N)C1O,0.2865
OC1CC1C1=NOC=N1,0.2121
N=C1NC=C(NC=O)O1,0.1777
FC1=NOC(=N)C(=N)O1,0.2028
CC1(COCC1=O)C=O,0.1943
CN=c1[nH]ccc(=O)o1,0.1847
C(COCCO)NC=O,0.2828
CC12C3C4C(C14O)C23O,0.2827
[O-]C(=O)C12C[NH2+]CC1O2,0.2356
CN1CC2NCC12C#N,0.233
CC1COCC(N1)C=O,0.1971
CCC1C2CC1(O)C=C2,0.2399
CC1(OCC=C1)C#N,0.2522
C#CC(=O)n1cccc1,0.1628
CC(O)(C#N)C(=O)CO,0.2232
CN=C1CC=CCO1,0.2475
CC1(O)C2CN3C2CC13,0.2899
CC(O)C1COC1CO,0.3011
OC1CC2OCC=C2C1,0.2417
OC12C=C3CN4C1C2C34,0.1766
OCC1OC2C(C#C)C12,0.2783
CC1CN2N=CN=C2N1,0.2466
C1CN1C1CC2CC1O2,0.3199
C1C=C(CO1)C(=O)CO,0.1902
C1CC2CC1CCCO2,0.307
CCc1c(nn[nH]1)C=O,0.2033
CC1C2CC1C1(C)OC21,0.3374
CC(C)NC(=O)C,0.2786
N#CC1CC11COC=N1,0.2459
OCC(O)C1=CCCC1,0.2519
OC1=C(OC=N)OC=C1,0.2172
c1cnoc1NCCO,0.2231
N#CC1CN2CC(C2)O1,0.2462
CC1C2CCC2C1C#N,0.3114
O=CCC12CC1CCO2,0.2155
CC12C3CC1N3C21CC1,0.3197
CC12COC(=N)C1(C)O2,0.2698
OC1C2NC1C(=O)C2=O,0.1417
CC1(OC1CO)C1CN1,0.3148
c1ncnc(n1)NC=N,0.2032
CC1NC(=O)C1C1CO1,0.2836
CC(C)(C)C(O)CCO,0.3231
C1COC(=O)N1C=O,0.2427
C1C2C3COC1OC23,0.3163
CC1N2C(C)C(=O)C12C,0.2111
C1CC1(C=O)C(=O)N,0.2176
CCC(C=O)C(=O)NC,0.2065
OC1CCCCC1C=O,0.2191
FC(F)(F)C1C2CN1C2,0.3129
Cc1cc(=O)oc(n1)F,0.2011
CC1CN1CC1COC1,0.3112
C#CC1(CC2CO2)CN1,0.2733
OC1C2C3COC1CN23,0.3078
CC(C)C1C2OCOC12,0.3315
CC#CCC(C)C#C,0.291
N#CC12CCN1CCC2,0.2547
C1c2c(n[nH]n2)NC=N1,0.2043
CCC#CC(C=O)C#C,0.2122
OC1CCC11OC1C=O,0.2175
CC12C3C1N1C3C=CC21,0.217
CC1NC1CC(N)=O,0.2703
CCCCC1OC1C=O,0.2193
CC(=NO)C#CCC#C,0.2035
N=C1OC(C=O)=NC=C1,0.1475
C#CC1(CCC1)CCO,0.3022
CC12CC1C(O)C21CC1,0.317
O=CN1CC2CCC12,0.2644
CNc1c([nH]c(n1)O)N,0.2238
CC1CC(C#N)C(=O)N1,0.2635
C1CCC2(C1)CNC2=O,0.2816
CCOC(C=O)C1CC1,0.2114
C1C2CC11CCN3C2C13,0.249
CCC(=N)OC(=O)CN,0.2306
C1CC1NC(=O)CC#N,0.2722
CC(CO)C1CC1O,0.3216
CN1CC2(O)C1C2(C)C,0.2675
CC1C=CC2OC3C2C13,0.2253
CN=C1OC=C(O)N=C1,0.137
O=C1CC2OC2C(=O)C1,0.2067
CN1C2CC(CCO)C12,0.3065
O=CC(=O)NCC1CN1,0.1739
CC1(CC1)C=O,0.2341
CC1COCC(C1)C=O,0.227
CCOC(C)CCC#C,0.3097
CC12CCC(=O)C1O2,0.2121
CNc1ncco1,0.2318
COC(=O)CC(N)C#N,0.2751
ON=C1CC2CC12C#N,0.2428
COC(C)CC1CO1,0.33
OC1(CC#C)COC1=O,0.2564
CCN1C=CCC1=O,0.2085
CC(C#C)C1=CN=NN1,0.255
CC1C(O)C2(C)OC12C,0.3205
CC(CC(N)=[NH2+])C([O-])=O,0.2447
CC1C2C3CCC3C12C,0.3038
CC1=C(COC1)C(=O)N,0.2076
c1nc([nH]n1)CCC=O,0.225
OC(CCC=O)C=O,0.204
CC1CCC(CC#N)O1,0.3018
CC1OC2C(NC12)C#N,0.2604
C1C2(CO1)C(=O)OC=N2,0.221
C1C2C3CCN=C3N12,0.2351
CN(CC#CC#C)C=O,0.2218
CC12C3C1C1(C#N)C2N31,0.2323
OC12CC(C1)C2(O)C=O,0.2087
O=COC1CC1C#C,0.2594
CCC([NH3+])C(O)C([O-])=O,0.2843
CC1C2CC1C(=C2)C#N,0.2008
C1OC2C3CC4OC3C124,0.2909
O=CNC1CNCC1=O,0.1972
CCC#CC1CCCO1,0.2835
C1C2C=CC3C=CC1N23,0.2085
O=C1CC2C3CC2C13,0.2226
c1c(c[nH]c1O)N2CC2,0.238
COC1C2CC2(C)C1C,0.3186
C(#N)c1c([nH]c(n1)N)N,0.2034
CN1CC2OC(C)(C)C12,0.2918
CC1CC(C1)(C#N)C#N,0.3149
CCC1(CC1)OCC,0.3287
CC#CC1(COC1)C=O,0.215
CC(=O)CC(=O)CC#C,0.2062
c1[nH]nc(n1)CCCO,0.2686
CC1C2(C)CC1(O2)C=O,0.2082
CC1(C)OC2=NCCC12,0.2664
C#CCCc1c[nH]nn1,0.2485
CCC(=O)C1OC1C,0.2221
C1NC11CN=C2OCC12,0.2614
CN1CC1(CC#C)C#N,0.2739
CC#Cc1cnoc1N,0.2099
COc1cncc(n1)O,0.1917
CC1CC(C1)C#CC#C,0.2258
COCC(CO)C#C,0.3128
CN(C)C1(CC1)C=O,0.1887
CCC1(C)CC2OCC12,0.3146
OC1C2OC(C3CO3)C12,0.286
OC12COC11CC2OC1,0.2731
OCC1(O)CNCC1=O,0.1886
CC(C)(C)C1(C)CC1O,0.3273
CCC1COC(=O)CO1,0.2611
CCC(C1CC1)C2CC2,0.3496
CC(O)C12CC1CC2=O,0.2299
CC(=O)NC(=O)OC,0.2463
C(=O)C(=O)NC(=N)N,0.1488
CC1C2(C)OC2C1(C)O,0.317
CCCC(=O)CC=O,0.2109
CC(=O)CC1CC1(C)O,0.2275
NC(=O)C1C2OC(=O)C12,0.2297
CCC(C)(C)C1CCC1,0.3547
C#Cc1cnccn1,0.191
C(CO)N=C(C#N)N,0.2117
c1c2c(no1)OCCO2,0.231
COC1C=CCN2CC12,0.2377
CC1C2C(CC12O)C=O,0.2233
CCCN1CC1(C)C,0.3057
N=C1OCC11CC1C=O,0.2218
CC12CC(C1)COC2=N,0.2869
CN(C)c1cc[nH]c1O,0.2395
COCCC(O)CC=O,0.2228
C(C(=O)C(=O)NC=N)O,0.1656
CCC1(C)OC2CC2O1,0.3253
O=CC1(C=O)C2CC1O2,0.2023
CCC12CC(C)(CC1)O2,0.3235
CC(CC#C)CC(C)=O,0.2336
CC1OC(C#C)C1(C)C,0.272
C(C1CN1)C1=NC=NO1,0.2287
CCC1CN=CO1,0.2716
C1CC12C=C(CO2)C#N,0.1842
CC1(CO1)C1(CO)CO1,0.334
CC12CC3(O)CCC1C23,0.3165
COC1CC=CC(=O)C1,0.1898
O=C1C=CC2OCCC12,0.1879
CC1NC1CC(O)C#N,0.2979
C1CC(=O)N(C1)CC#N,0.2663
CC1=CC2NC1CC2=O,0.208
C(C(CO)OC(=O)N)O,0.3047
CCC(C)(CCO)OC,0.3202
CC1(O)CC1C=O,0.2265
CCC1C2CN=COC12,0.2744
CCc1c(non1)OC,0.2329
CCOC(CO)C1CO1,0.3032
C#CC1NC1C#C,0.266
OCC12CNC(=O)C1O2,0.2512
CN1CC(C2CO2)C1=O,0.2763
CCC(=O)C1CCO1,0.2192
C1OC23CCC(CC12)C3,0.311
C#CCCc1ccco1,0.2334
NCC(N)(C#N)C1CO1,0.2794
COCCCC1(CC1)O,0.3276
COCC(O)(CN)C#N,0.2772
C1C2NC3=CNN=C3C12,0.2148
C(OC1CC1)C1CO1,0.3264
CC1C2CN1C2(C)C#C,0.2589
CC1C2CCC1(C)C=C2,0.2574
CC(=O)C1=COC(=N)O1,0.1731
CCC12CN1C(=O)C2C,0.2335
CC1=CNC(=N)C(=O)C1,0.1527
CC1CC11CC(=O)C=C1,0.1917
O=C1C2C=CC3CC2C13,0.2045
CC1COCOC(=N)C1,0.2682
CC12C3CC4CC1C4C23,0.3248
CC1=CC2NC1C2O,0.2296
CCC(N)(C#N)C(N)=O,0.2615
CC(NC=O)C(=O)C#N,0.1662
CCC#CC1CC(=N)O1,0.2752
CNc1c(c(no1)O)N,0.2303
CCc1cc([nH]n1)OC,0.2543
C#CC(C=O)(C=O)C=O,0.2107
C1CCC2NC2C=CC1,0.2427
CC1COC2C1OC2=N,0.2723
CCCC1=CC(=O)CC1,0.1938
OCC12COC1C2O,0.2923
CCNC(=NC)C(=O)N,0.2062
CC(C)C1OCC(C)=C1,0.2468
CN(C)Cc1nnon1,0.1631
O=C1CC2C3CC(O1)C23,0.2704
CC1(O)C2C3C1N=CN23,0.2331
COCC1(C)CC1O,0.295
CC1CCC11COC1,0.31
c1c(onn1)C(=O)N,0.2065
C1CC1C12CCC1CO2,0.3114
CC1(O)CC(=O)CC=C1,0.2254
CC1(C)COCC1O,0.3129
N=C1CC(O1)(C#N)C#N,0.2538
CCc1c(cn(n1)C)C,0.2496
CC1(CCCCC1)C,0.3602
OC1C2CCC(=O)NC12,0.2612
CC12COC1C(N2)C#N,0.2659
ON=C1C2COC1CO2,0.2442
CC1C2C(C)CC(=O)N12,0.2365
CC12C3C=CC1C(=O)N23,0.2088
O=C1CC2C3C(CN23)O1,0.2591
CC12C3C4N3C1C24CO,0.2739
O=CC1C2OCOC12,0.2185
N#CC1C2CC3OC1C23,0.2789
OC12CCC3COC1C23,0.2997
CCn1c(c[nH]c1=O)O,0.2292
CN1CC(=N)N(C)C1=O,0.2435
CC1C2CN(C=O)C12C,0.257
C1CC=C(C1)COC=O,0.2508
CC12CC3OCC1CC23,0.3213
NC(=O)N1CCOC1=N,0.2709
CC1C2CCCC1O2,0.3126
CC1CC2COCC2O1,0.325
CCC1CCC=C1C#C,0.209
N#CC12CC3C=CC1C23,0.2294
O=CC12C3CC(N13)C2=O,0.1998
CC1=CCC2CC2(O)C1,0.2594
ON=C1CC2NC2C1=O,0.1677
O=CC1C2OC=NC12,0.2207
OCC12CC1C1CN1C2,0.2844
COC(C)C#CCC#N,0.2756
CCOC1(C)CCC1=O,0.1983
COCC1=CC(O)CC1,0.2575
CN1CC2(CC12)NC=O,0.2363
OC1C2C1C(=N)N2C=O,0.2356
Cc1[nH]c2c(n1)con2,0.2011
CC1N2C3CC3C12C#C,0.23
O=C1OC2CCC(C2)O1,0.3223
C1OC2C=CC1C=C2,0.222
CC1C2N3C(C)C1C23C,0.316
CC1(C)C2CC1C(=O)N2,0.2563
CN1CCC(=O)C1C#N,0.2027
CCC1(C)CC(C)(C)O1,0.3126
CC1C2C=CC1(O)C2=O,0.2298
C1CC2CC=CCC2C1,0.2677
N=C1NC2COCOC12,0.2612
CC1C(O)COC1C#N,0.3002
CCC1CCC(=O)OC1,0.2709
OC1CC1CCC#C,0.3133
CCOCC#CC1CO1,0.2701
CCOCCN=COC,0.2659
CC1[NH2+]CC1(N)C([O-])=O,0.2595
CC1CCC23CC12CC3,0.3011
c1c(c(no1)O)NC=O,0.2192
CC12NC3(C)C1OC23C,0.298
CC1OC(=O)C1C,0.281
O=C1C=CON=NC1=O,0.1546
CC1NC1(C)CN1CC1,0.3187
COc1cccc(c1)F,0.2217
CCC12CC(C1O)C2O,0.3248
CCn1ccccc1=O,0.1768
C1CC23CC(C4NC24)N13,0.291
CC1CNC1(C#C)C#N,0.2524
CNc1c[nH]c(=O)o1,0.2326
OC1CN2C(C3CC3)C12,0.2848
OCC1CC(CC#N)C1,0.3079
N#CC1CC(N1)C1CO1,0.2686
CC(C)NCC(=O)C#N,0.1513
Cc1nnon1,0.25
O=CC12CC1(CO2)C#N,0.2111
CC#CCCOC(C)=N,0.2781
CC(CO)C1=COC=N1,0.2436
O=CC1(CC2CN12)C#C,0.2064
CC(CCO)(C#C)C#N,0.2895
CC(=O)N(C=N)C(=O)N,0.2355
OCC1C2CC(O)C12O,0.318
CC12CC(C3CN13)C2=O,0.2246
CCC1C(C)C=CC1C,0.2638
O=C1C2C3C=CC1N23,0.1905
CCC(=O)CC=O,0.2117
CC1(O)COC(=O)C1N,0.2513
CC12C3C4C1CN=C4N23,0.1569
N#CC12COC3CN1C23,0.2686
CC1(C)C2N1CC2(C)C,0.2977
CC12CC1C(O)C(=O)N2,0.2545
CCCC12CC(O1)C2=O,0.2438
c1coc2c1[nH]cn2,0.2062
CN1CCNCC1=O,0.2459
CC1CC(O)C(C1)C#N,0.3074
COC(=O)C1C(C)C1C,0.2776
NC=[NH+]CC([O-])=O,0.2444
COC(=O)C1CO1,0.2633
CCN(CC=O)CC#N,0.2048
Cc1c(nc[nH]1)N(C)C,0.2432
CC1(CN=COC1=O)C,0.2477
NC1=CC(=O)C(=O)C1O,0.157
CC1CN2C=NCC2=N1,0.2102
CC1CC1CN1CC1,0.3167
O=CC12CC1C1CC21,0.2079
COC1C(C)OC1C,0.3185
c1c2n(nc1C#N)CC2,0.2336
OC1CN2CCC(=O)C12,0.1922
CN1C2CC2(C=O)C1=O,0.2072
CC([NH3+])C1=C([O-])OC=C1,0.1643
CC12CC3C1CC23C,0.3637
OC1CC23CC(CC12)O3,0.308
C(C(C=O)C=O)NC=O,0.2103
CCC1C2CC1(CC)O2,0.3151
CCC1OC2C(CO)C12,0.3039
CC(C=O)(C=O)C1CC1,0.1968
O=CNC1C2C3OC1C23,0.2691
OC12CC1(CC2)C1CO1,0.317
COC1C(OC1=O)C#N,0.2503
CC1(OC2CCC12)C=O,0.2113
CC1=CCC(C)(CO)C1,0.2599
CC(C)Cc1c[nH]nn1,0.2503
CN=c1oc(no1)OC,0.2597
Cc1cnc([nH]c1=O)O,0.1991
CC1N2CC1(O)C2(C)C,0.3059
CCc1c(noc1N)C,0.2283
CC12C3C(CN13)NC2=O,0.2488
CC1NC1(C)C1CN1,0.3056
CN1C2C3NC2C13,0.2828
O=CCC1(CCN1)C#N,0.1998
CCC(C#N)C(C)C#N,0.3371
OC1C2C(C=O)N2C1=O,0.1743
CC1CC1(C)C#CC#N,0.2249
CC1COC(=N)C(N)=N1,0.2016
CC(=NO)CN1CC1,0.2503
CCCC12CC(C)(C1)C2,0.3736
CC1=NC(O)=NNC1=N,0.1475
[NH3+]C1(CC1C([O-])=O)C#C,0.2565
CNC1=NNC(=N)N=C1,0.1281
N#CC12CC(O1)C1OC21,0.259
OC1COC(=O)C=C1,0.2155
O=CC1C2CC1C(=O)N2,0.2035
C(=N)Nc1c(nn[nH]1)O,0.1943
CC(C)C1=CCCC1C,0.2583
C#CCC1C2CC1O2,0.2895
N=C1COCC(=O)CO1,0.2067
CC1CC2C(C)C(=O)N12,0.2346
CC12C3C4CC(C1O4)N23,0.3255
O=C1NCC11C2CCN12,0.2616
[NH3+]CC(O)CCC([O-])=O,0.0787
NC1=NC(CCO)CO1,0.2782
OC1CC2(O)C1CC2=O,0.2182
CC(CN)(NC=O)C#N,0.2683
O=C1CC=C2C3CC3N12,0.2136
C1C2CC3CC=CC3C12,0.2653
COC1CCC1C#CC,0.2894
CN1CC1(C)C(C)=NO,0.2408
CC1C2(C)CC1(O2)C#C,0.2546
C1CC23NC2(C1)C1OC31,0.3115
N=C1NC(C=O)=NO1,0.1475
CC12CC3(C)C1CC23,0.373
CC12CCC1(CC2)C#C,0.2802
CCC12C(O)C1OC2=O,0.2567
CC(CCO)(CCO)O,0.3185
CC1C2OC(C)CC12C,0.3161
CC(C)C1NC1(C)C=O,0.222
C#CCc1ncnnn1,0.161
OC1C2OC(OC12)C=O,0.1993
NC1(CCC1CO)C#N,0.2926
OC1=COC(=N)C=C1O,0.1649
OC1C2CC3(CC3)OC12,0.304
C1CC23CC=CC(O2)C13,0.2438
CC1C2OC(=N)C1C=C2,0.2375
CC1=C(CCC1)CC#N,0.2495
NC(C#N)C(=O)NC=O,0.2124
c1coc(=O)cc1C#N,0.1599
COC12CN3CC1(O)C23,0.2762
CCC(C)C(O)C#C,0.2958
CC1CC=CCC11CO1,0.2686
N=C1CC2CC(C2)CO1,0.2716
CCOCC(O)CC,0.3283
CC(OC=N)(C#N)C#N,0.2552
O=CC1C2CC1N2C,0.1925
N#CC1=CC2CC1CO2,0.2055
C1COC(=N1)CC#N,0.262
CC12OC1(CO)C1NC21,0.3078
CC(CO)C(=O)C1CC1,0.2292
C1OC2CC3CC(O3)C12,0.3185
OC1CC(CC#C)C1=O,0.219
CC1NC2CC(C2)C1=O,0.215
CC#CC1CCC11CN1,0.2781
CCC1(CCC1)CC#C,0.3107
N=C1ON=CNC1=O,0.1978
Cc1coc(c1O)N,0.2194
CC1C=CCC1C#C,0.2639
C1C2C3OC3C=CCN12,0.2187
COC(C)C1CCCO1,0.3235
CC1C2C(C)OC12C=O,0.2175
CC(C=O)C1C2CCN12,0.2077
CC#Cc1cnccn1,0.1869
O=C1OCC11CO1,0.2595
CCC1C2CCC12C#N,0.2834
COC1C(O)CC11CC1,0.3121
O=C1C2NC2CC1C#C,0.2054
c1c(nc([nH]1)N)NC=O,0.2036
CCC1C2CN1C2C#C,0.2555
CCC12CC(C1)OC=N2,0.2646
CC#CC(C)C1(C)CC1,0.3012
OCC1C=CCC2CC12,0.2631
CC(C=O)C(=O)N(C)C,0.2051
CC(O)C(C)N1CC1C,0.3154
CC1=CCCOC1CO,0.2586
C(C#N)NC(=N)NC=O,0.2207
CCn1cnc(c1C)O,0.2212
CC1C2C(O)C1(C)C2=O,0.2376
CC1=CCOC2CC12O,0.2447
CCCC12CC1CCO2,0.3103
CNC1(CC1)C(O)C#N,0.2471
CC1OCCC(CO)O1,0.3466
CC1CC(C)=CC2OC12,0.2371
CN1C(CC#C)C1(C)C,0.2697
CC1(NC=CC1=O)C#N,0.189
OCC12C3C4N3C1C24O,0.2708
CC(=NO)C1COC1=O,0.2422
COC(=O)C1(O)CC1O,0.2268
C1CC12CNC(=O)O2,0.3122
C1C2C3CCCN=C3N12,0.2392
Cn1c(c(c(n1)N)N)N,0.2137
CCC1(OC1C)C#N,0.3008
OC(C#N)C1CNC1=O,0.2693
Cn1cnc2c1[nH]cn2,0.2208
OC1CCC(C1)N1CC1,0.3002
O=C1COCC11CO1,0.1999
C1CC23NC4C2N1C34,0.2747
c1nc2n(n1)CC23CC3,0.2655
COc1cc(co1)C#N,0.1981
O=C1CC(N=CN1)C#C,0.2289
CC1(CCC1)C,0.3649
O=CC1=CC2C3CC1C23,0.1857
O=C1CC2C3CN(C1)C23,0.1931
CC1CCC2OC2C1=O,0.2123
CC1OC11COCC1O,0.2951
CCCC1OC(=O)C1O,0.263
CC1CCC2(CC2)C1C,0.3392
COC(=O)C(CO)C=O,0.2286
COc1cc([nH]c1N)O,0.2324
CC1OC=NCCC1=O,0.2169
CC1=CCOC1CO,0.2476
CC12CC1CCCCC2,0.335
OC1CC1CCC=O,0.2275
COc1c(nco1)C=O,0.2019
CC1C2OCC(=NO)C12,0.2376
O=C1CC2CCC3C1N23,0.2146
CC1CCC1OCC#N,0.2849
CC1N2CC1(C)C21CC1,0.3128
N=COC12CC(C1)OC2,0.2691
C1OC2OCC1CC=C2,0.2481
[NH3+]CC1=C[N-]N=CC1=O,0.1897
CC(C)C#CC1CC1C,0.2783
O=C1OCC2CC2CO1,0.3104
CCCC(OC=N)C#C,0.2825
OCC1C2OC1C2O,0.303
O=C1NC2C3CN3C2=C1,0.2067
CC1NC1CO,0.3186
O=CC1(OC2CC12)C#C,0.214
C1CC(=O)C=C1N2CC2,0.1987
CC1CC(O1)(C#N)C#N,0.263
CCn1ccc(c1)OC,0.2273
CC(O)C1(CN1)C#N,0.2926
COCC1CCCO1,0.3278
[NH3+]C1C(NC1=O)C([O-])=O,0.2424
CC1=CCCCC1=O,0.1925
CC1CCC(C)C2OC12,0.3393
c1(=O)c(=O)onno1,0.2083
O=CC1N=COC1C#N,0.219
N=C1C=CON=C1C#N,0.1671
OC1CCC(C1)OC=N,0.2785
CCC1CCCC(C)C1,0.3698
C1C=C2CCOC3C1C23,0.2301
CC(=O)COC1(CC1)C,0.2232
O=CC1OC2C3CC1C23,0.2149
OCC1=CCCC2CC12,0.25
c1c2c(c(o1)O)NCC2,0.2101
O=C1OCC11C2CC1O2,0.2451
CC12CC1CCC21CO1,0.3408
CC(C)n1cccn1,0.2653
OCC12CC1C(=O)CO2,0.2178
CC1(O)CN2C=CC=C12,0.2443
CNc1c(coc1O)N,0.2243
Cc1c2c(cco2)on1,0.2069
CC1C(C#N)N1C,0.2614
CC(CC=O)C(C)C=O,0.2192
N=C1CC=CCC(=O)N1,0.2251
OCC1CCC1OC=O,0.2785
O=C1CNC2CN3C2C13,0.1896
CC1(O)CCCC=C1,0.2599
CC1C(=N)OCC11CN1,0.2782
ON=C1CC2(CN2)C=C1,0.1863
CC1(O)CCC2(O)CC12,0.3218
C(c1c(onn1)CO)O,0.2217
C1OC2C3CC(C3)C12,0.3303
OC1COC(CC#N)C1,0.3025
Cn1nc2c(n1)OCO2,0.2082
CC#CC1C2CCC12O,0.277
C#CC12COC1C1CN21,0.2547
CC1CC2COC1(C)O2,0.3279
CN1C2CC1C(=C2)C#C,0.1861
CC12CC1(O)CC1CC21,0.3225
CC12C3C(CN13)C21CN1,0.3071
OCCC12CC1OC=N2,0.2594
CC1(O)C2CCC1C2=O,0.2309
CCC1CC1(NC)C#N,0.266
OCC12COC1C(=N)O2,0.2628
C#CCCCOCC#N,0.2761
CC1C2N3CC1C23CO,0.312
CCC1NC(CC)C1=O,0.2176
OC1=NOC(=O)NC1=N,0.2095
COc1conc1C=O,0.1805
CC12OCC1CC=C2,0.2512
CNC(=O)OC1CCC1,0.314
C1C(CO1)C(=O)CCO,0.229
CC12CN=C3OC1C23C,0.162
c1cnc(cn1)N(=O)=O,0.1757
O=C1NC2C3CC12C=C3,0.2224
CCc1c(cnn1C)N,0.2221
CC(O)C(CC#N)C#N,0.3157
COCC1(CC1C)C#N,0.3014
CC(OC1(C)CC1)C#N,0.2867
CC#CC1C2C3CC1C23,0.2868
CCCn1cccc1O,0.24
CC12CC1(C)C(=O)CO2,0.2147
N=C(C#N)N1CCC=C1,0.1712
OC1=NNC=C1C1CO1,0.2404
C1C(CN1)(C=O)OC=O,0.1963
CCC#CC(=O)COC,0.2093
C1C(=O)COC(=N1)N,0.2039
Cc1c2c(n[nH]1)CCC2,0.2452
OC1CC1(O)C(=O)C#C,0.1742
CCOC(=O)CC1CC1,0.2838
c1c2c(no1)CCOC2,0.2417
C(=O)C(=N)NC=N,0.1639
C#CC(=O)N(C=O)C=O,0.1919
CC1OC1C12CC1CC2,0.3267
O=C1C2CCC3CN1C23,0.2292
C1C(CC1=O)C(=O)C=O,0.1493
OC1CC2OC1C=C2,0.2547
C1C2C3CC4C1C4OC23,0.2786
CN1CC(O)C1(C)C#C,0.2641
CCC1(CC1)CCC#C,0.3118
CC(OC=O)(C=O)C#C,0.2104
CCC12C3CC1=CCC23,0.1772
NC(CC1(O)CC1)C#N,0.2757
CCC(=O)N(CC)C=O,0.2346
Cc1c(cc([nH]1)N)CO,0.2258
O=C1OC2CN3CC12C3,0.2389
CC1C(O)C1CC#C,0.3033
CC1CC2=C(C1)N=CO2,0.2311
CC(C)C1CN1C1CC1,0.3087
O=C1C=CN2CC3C2C13,0.1817
C1C2OC3=C(ON=C3)C12,0.2059
c1cocc1NCCO,0.2205
O=C1NC2C3OC2C13,0.2397
C1CNC=C(C1=O)C#N,0.1807
OC(C#C)C1CC1C=O,0.2233
NC(CCC(N)=O)C#N,0.2746
CN1CC2OCCC12,0.3004
C1C2C=CC3OCC12O3,0.2261
NC(C#N)C1(CC1)C#N,0.2802
CC1COC23CC12CC3,0.2889
CCc1nc(nn1C)O,0.2391
CC(O)(CC=O)C1CC1,0.222
OC(C=O)C1=NOC=C1,0.2215
OCC12CC3OC1C2O3,0.3071
CC12NC3(C=O)C1OC23,0.2006
O=CCC(C#C)C#N,0.2226
O=C1CC2CC2OCO1,0.2684
N=C1CNCCC(=O)O1,0.2205
C1C2C3C4C5OC1(C24)C35,0.294
CC12CC1(C[NH2+]2)C([O-])=O,0.1663
CC(CCO)C(C)=O,0.23
CCCC(=O)C#CC,0.2089
c1c(nc(nc1O)F)O,0.243
CC(O)C1(OC1C)C#C,0.2781
CN=C1OCC2CN12,0.276
CC12CC1(NC=N2)C=O,0.2026
CC1(C)C2CC2C1(C)O,0.3061
CC1CC11CC(C)(O)C1,0.3202
O=C1CCC11CN=CO1,0.2021
CC1(CC=O)CC(=N)O1,0.2238
O=CC1COCC(=O)O1,0.2098
OCC12CNC(=O)C1N2,0.2578
CCc1cc(=O)cn[nH]1,0.1869
CCC(C#N)C(C)=NO,0.2539
COC(C)CCCC#C,0.312
CCC#CC1(CC)CN1,0.2695
CC12CN3C(C1)C(O)C23,0.288
CC12C3CC3C1NC2=O,0.2606
Cc1cc(cnc1C)N,0.1964
ON=C1C(O)C=CC1=O,0.1628
COCCn1cnnn1,0.2677
C#CC1=CC2C3CC1N23,0.18
CC1CC(C=O)N1C=O,0.2097
CC(=O)C(O)C#CC#C,0.2034
CN1CCC=CNC1=O,0.2309
[NH3+]C1CCC1(O)C([O-])=O,0.2641
CC1(C)C2CC1C21CC1,0.3596
Cc1cnoc1N2CC2,0.2208
O=C1C=CNCC2NC12,0.1854
COC(=O)CCC#C,0.2738
CC1CC(=O)C=C(C)N1,0.188
CCC#CC(OC)C=O,0.2036
COCc1ncccn1,0.2089
CC1C2CC1C2N1CC1,0.3166
CC#CCC1CCCO1,0.2947
C1C=CCC(=NO)C=C1,0.196
Cc1c(cc[nH]1)NC=O,0.2102
OC(CCC#C)CC#C,0.2987
CCC12CC3C(CO1)C23,0.3233
CC(C)(O)C1COC=N1,0.2657
O=CC1OC(C=C1)C#N,0.2089
C1C2OC3(CC=CC3)C12,0.2581
OC1CC2(CC=O)CC12,0.2207
COC1(C)CNC(=O)O1,0.3155
C1C=CC(=O)N1C(=O)N,0.2139
C1CC1CC(=O)N,0.2738
CC(=O)OC1C(O)C1O,0.2514
CCC(=O)C#CC#C,0.1851
c1c([nH]c(=O)[nH]1)NC=O,0.1766
CC(O)C12CCC1CO2,0.3022
O=C(C#C)C12CCC1N2,0.1989
CC1=CC2COC3C2C13,0.2314
C#CC(CC1CN1)C#N,0.2621
O=C1CC2CC1(C2)C#C,0.2238
O=CC12COC3C1NC23,0.2073
c1c(c(c(cn1)F)F)F,0.2327
CC1(C)COCC1C#N,0.2991
N=C1OCC2CC1C2,0.2864
COC1OCC=CC1C,0.2665
CC1=CC2C3C4CC13C24,0.2204
CC1(C=CNC(=O)N1)C,0.2257
CN1C(CO)COC1=O,0.2919
CC1=NC2C(CC2=O)O1,0.2046
CCC1OC(=N)C(=N)O1,0.2326
CC1CC2=CCC(=O)C12,0.2197
NC1=COC(=N)N=C1N,0.1724
C#CC1C2OC3CC2C13,0.2855
CCC1C2NC(C#N)C12,0.2507
OC(C#N)C12CC1CO2,0.2625
OC1CCC2N=COC12,0.2672
CCc1c[nH]nc1CC,0.256
OCC1CCOC1=O,0.2659
C1CN1C12CC1C1NC21,0.2731
N1CC11C2CC2C11NC1,0.3158
COc1ncc(nn1)O,0.1714
OC1CCCC(=N)OC1,0.2693
CC1CC=C2CC(O)C12,0.2474
CN(C)Cc1ncno1,0.2022
Cn1c2c(nc[nH]2)nn1,0.2179
CC1N=C(CO)N2CC12,0.2505
NC1=CC(=N)OCC1,0.2023
C(=O)n1c(=O)onn1,0.2215
COC1CC=CC1OC,0.2528
CCN=C1C=NNN=N1,0.1662
Cc1c(c(c[nH]1)O)O,0.2283
CC1=NNC(=N1)C1CO1,0.2513
NC(C#N)C#CC1CC1,0.2544
CC(O)(C1CC1)C1CO1,0.3466
O=CC1C2CN3C2CC13,0.2081
CC1CCOCCCO1,0.3184
NC1C2NC=NC12C#N,0.2291
CC1=CCc2c1ocn2,0.1857
CCOCC#CC#N,0.2273
CCCC1COC1C,0.3224
NC1C(=O)OC11COC1,0.2473
COC1=NCC2(C)CN12,0.269
O=C1NCC2COC1C2,0.2522
NC(=O)N1C2CC1CC2,0.2804
CC1CC2OC2C(=O)O1,0.2501
CC1CCCCCO1,0.3227
CC(C)(C)C(O)C1CO1,0.3341
CC1OC(=N)C1CC#C,0.2823
COCC1(CN1)C#C,0.2795
O=CC12CC3N1C2C3=O,0.2021
C#CC12CC3CC1CN23,0.2572
CN1C2C3CC1C23C,0.2974
OCCOC1CCC1O,0.3175
CC(=O)c1cnon1,0.195
O=C1NC2CN3CC12C3,0.2294
CNC(CC#N)C1CN1,0.2704
CCC#CC(O)CO,0.2763
N=C1OCC11C2CC1O2,0.2578
OC1C=CC2CCC1C2,0.2578
C1OC2CC3OC3C2=C1,0.2324
CC1=CC2CC2OC1=N,0.2065
O=CCC1N=CNC1=O,0.2142
CC#CC1(C)CC2NC12,0.2832
CCC1(O)CC2CC12O,0.2822
Cc1cc([nH]c1)C,0.2421
CCC12C(C)N1CC2O,0.283
O=CC1CC11NCC1=O,0.1926
CC1(CC#C)CCC1O,0.303
CCN1CC2CN2C1=O,0.2769
CC12NC1C1CC21C#C,0.2405
CCc1c(oc(=O)[nH]1)O,0.2416
CCCC(O)C(N)C#N,0.2972
CN(C)C1C2OC1C2O,0.2719
CC1C2C3COCC2N13,0.3124
OC1C2N3C1CC23C=O,0.2166
OC1C(NC=O)C1C#C,0.257
c1[nH]c2c(n1)OCC=C2,0.1661
N#CC1CC=C2COC12,0.241
CC12C3CC3C1C2C#C,0.2526
Cc1cccc(c1N)C,0.2103
COCCOC=N,0.2869
N#CC12C3C4NC1C4N23,0.2448
CC1=NC(=N)ON=C1N,0.1518
CC1=CNC(C1=O)(C)C,0.1844
OC1(CC2NC2C1)C#N,0.2689
CC(C)CC(C)C1CC1,0.3527
N=C1OC2COC2C=C1,0.2079
CCC1(CC2OC12)C=O,0.2227
CCC1CC11NCC1=O,0.2093
CN=CNC(=O)CO,0.2339
C#CC1CC2CCC12,0.3005
CC1C2C=CC1(C)C2C,0.2377
CC(O)C1(CCO1)C=O,0.2109
CC(=O)C12CN1CC=C2,0.21
CC1CC1C(O)C1CC1,0.3262
O=C1CC=CCC1C#C,0.217
COC1COC(C1)C#C,0.2853
c1[nH]c2c(n1)nc[nH]2,0.2216
CN1C2CC3OC2C13,0.2899
CC(C)C1=CCC2NC12,0.2467
CC(O)C1OCC1C#N,0.2674
OCC1OCC(O)C1O,0.312
CC1(O)COCC2NC12,0.3127
OCC12NC3C1COC23,0.2966
CNC1CCNC1C#N,0.2594
CNC1(COC1)C(=O)N,0.2353
N=C1CCC(O1)C1CC1,0.2852
CC1(O)C2C3CC=C1C23,0.18
COC12CC1COC2,0.3366
COC1=NCCN1C=N,0.2231
C#CC12CN3C4C3C1C24,0.2731
CC1CC(CC=O)C1=O,0.2158
N=C1ON=NC(C=O)=C1,0.1481
COC1CC2(CC12)C=O,0.2256
C(C1CN1)N1C=CC=N1,0.2595
CC12CC3C1N3C2=O,0.2486
O=CC12NC3C1C2C3=O,0.1875
OCC1COC(=O)C1O,0.2749
N=C1OCCC11CC1,0.2789
O=CC1CC11C2CC1O2,0.2252
CC1(C)C2CC(O)C12O,0.2967
CC1OC(C=O)C(=N)O1,0.2183
c1cn2c(n1)COCC2,0.2468
CC(=O)NCC(C)(C)C,0.2767
CC12CC(C)(C)C1N2,0.3228
OCC(CC1CN1)C=O,0.2158
CC1NC11CCC(=O)C1,0.2206
NC(=O)OCCC1CO1,0.3223
CC1NC(=O)C2OC12C,0.2501
c1cc([nH]c1)NCCO,0.2381
Cc1cnc(n1C)C#N,0.2032
NC1=C(F)NC(=N)N=C1,0.1513
CNc1cc([nH]c1)O,0.2326
[O-]C(=O)C12CC1[NH2+]C2,0.1614
C1OC11C2OC1C1NC21,0.3087
CCCOC=NCC,0.274
CC1(CO)CC(C1)C=O,0.2227
OC1C2C3CC2(C#C)C13,0.2905
N=C1NCCNC1=O,0.2061
CN1C(=N)OC=NC1=O,0.2093
CC1OCC2=C1C=NO2,0.2298
C1C2CC11N=COC21,0.2589
C1CC1C1CC1C1CO1,0.3292
COC12CCC1C1CC21,0.3021
CCc1nc(co1)NC,0.2102
CC1OC2(C)CC1C=C2,0.244
C1C(=O)CN1,0.2179
CC1(C)CC2OCOC12,0.3238
COC1(CC1O)C(C)=O,0.2145
NC(C#N)C#CCCO,0.2749
C1CC(=C(C1)N)C(=O)N,0.1958
CCC(NCCO)C#N,0.2782
O=CC#CC1CN1,0.1943
C1OC1C1=CN=CN=N1,0.1659
CCN(C)c1nnon1,0.1782
C1OC2C3NC3C3C1C23,0.2837
Cn1cnnn1,0.2678
CN1C2CC(=O)C1C2O,0.1985
CC12C(NC1=O)C1CN21,0.2526
OC1CCOC1C#C,0.2823
Cn1ccc(c1)COC,0.246
c1c[nH]nc1N2CCC2,0.2217
c1nc2n(n1)CCOC2,0.2657
Cc1c(nn(c1O)C)C,0.2513
CC1OCC(CC=O)=C1,0.2023
CC1C2OC3C2N(C)C13,0.2929
c1c2c(on1)N=CNC2,0.1807
CC1[NH2+]C1CC([O-])=O,0.2762
CC12CC(C#N)C1(C)O2,0.2897
CCC12CC(C#C)C1N2,0.2923
NC1=NC(=[NH2+])[N-]C(=N)O1,0.2073
CC(O)CCC1(C)CC1,0.3287
NC(=O)C(O)(C=O)C#C,0.1973
CCCOCCOC,0.3363
CC1OCC(O1)C1CN1,0.3181
C1C2OC2C2=C1N=CN2,0.2306
CC1OCC(N)=C1C=O,0.1831
CN(C)c1nc(no1)O,0.2422
O=CC1C2CCC12C#C,0.2055
CCc1nc(on1)CC,0.2605
OCC1CC(=O)CN1,0.2099
CC1(OCC1C#N)C#N,0.2758
OCC1CC(CO)C1O,0.3037
[O-]N=C(C=O)C1CC[NH2+]1,0.1105
CC1C2C(O)C(=O)C12C,0.2119
CC1=NCC2CC2CO1,0.2566
O=C1NCC2CCC2O1,0.2994
CCC(O)CCOC,0.3186
CCOC(=N)CC1CC1,0.294
c1([nH]c(nn1)O)O,0.2753
C#CC(=NO)CC1CC1,0.2065
CN(CC=O)CC1CN1,0.2037
CC12CC(CC1CO)O2,0.3139
OC1C2CC1C2C1CC1,0.3265
C1OC1C1=NC=CO1,0.2311
CCC(CC(C)O)C=O,0.2314
Cn1c2c(cn1)nc[nH]2,0.2269
CC(C)C12CC1C(=O)O2,0.2765
CC1(O)CC1(O)CO,0.3015
c1c(=O)cnoc(=O)n1,0.1584
CC1C2C1C(C)C2C,0.3329
CC(C#CC#N)C(N)=O,0.2139
CC(O)C1CC1C=O,0.2237
CC1NC1C(C)(O)CO,0.3075
CC12CC3CN1C23C#C,0.2538
CC1=CC(OC=N)OC1,0.2596
C1OC1C1C2C3OC1C23,0.3048
COC1CCC(CO)O1,0.3319
CC1OC11CCC1(C)O,0.3191
c1coc(c1C#N)C#N,0.189
CC1=CCC(C1)C=O,0.2213
CC1=CCC2NC12C#N,0.2401
OC1(CC2CC12)C1CC1,0.3183
CC(=O)C12CC1NC=N2,0.2151
OC1C2CCC12C1CO1,0.3143
CC12CC1C1(O)CCC21,0.296
OCC12OC1C1CC2O1,0.303
CCCCCC#CCO,0.2781
COc1ncoc(=O)n1,0.2218
CC(CC=O)C(=O)C=O,0.1502
CC(=N[O-])C12C[NH+]1CC2,0.1218
CC1(OC(=N)C=C1)C=O,0.1887
CC12CC(O)C1C1NC21,0.2928
C1C=C2COC3C1C23,0.2002
CC1CCC2OC1C=C2,0.2433
O=COC(CC#C)C#C,0.27
c1c(nc(c(=O)o1)N)O,0.15
CN(C=N)C(=O)C#N,0.2019
COC1C2CC1N2C=O,0.2519
CC1C2CC(O)(C2)C1C,0.3295
CC1=CC2CC1(C2)C#N,0.2386
CNc1c(cn[nH]1)C#N,0.2239
C#CC1(CCC1)CC#N,0.2939
CC(C)(O)C1C2COC12,0.303
COC12CC3CC1(O)C23,0.2883
COC(=O)CNCC=O,0.2196
CC12CC3C4C1N4C23C,0.3043
CCC(=N)N(CC)C=O,0.2364
CCC1(C)OC1CC=O,0.2245
CCCCNC(=O)C#C,0.2312
C#CC12CC3C1N3C=N2,0.2322
CCC1OC(=O)C1N,0.2498
CC#Cc1c[nH]cc1N,0.2049
Cc1cn(c(c1N)C)C,0.2403
CNC1C(N)C1C#N,0.2475
CC1COC1(C)C(N)=O,0.2651
COC12CCC1C(=O)C2,0.218
OCCC1CC11COC1,0.311
CCCC12NC3C1NC23,0.2883
CNC(=O)COC(C)=N,0.2667
COC1CN(C)C1C#N,0.252
N=C1CC(O1)C1CCC1,0.2888
COC1(COC1)C1CN1,0.308
COCC1C2NC2C1=O,0.2189
CC1C2C(C)OCC12O,0.3217
C(CO)C#CCC(=O)N,0.2702
Cc1c[nH]cc(c1=O)C,0.201
CCC(O)C#CC(N)=O,0.2323
COCC1(C)OC2CC12,0.306
COC1C2C=CC(=O)C12,0.1877
OCC1CNC(=O)C1O,0.2766
C1C2C3C4CN1C2C3O4,0.2716
CC1(CCCN=CO1)C,0.2577
NC(C#N)C1=CN=CN1,0.2372
CN(C=O)c1nnon1,0.1952
C1NC1C1CCOC=N1,0.2662
CC12OC1C=CC2CO,0.2456
CC1=CC(OCC1)(C)C,0.2615
CC(=O)C1NC2CC12O,0.2076
CN1CC(C2CC2)C1=O,0.276
C1C=C(CO1)CCC=O,0.2067
N=C1CC2CC2C(=O)N1,0.2403
CC12CCC1OC2C=O,0.2147
CC1CC2NC2(C)C1O,0.3066
C1C2(COC2)OC=N1,0.2716
COC1C2CC(=O)C12O,0.2282
CC1C2C3CC(C)=C1C23,0.1715
CCC1(COC1)C2CC2,0.3195
C1CN=C(NC1=O)C=O,0.1832
CC(C)C12CC(O1)C=C2,0.2354
OC1CCC11CN=CO1,0.2705
CC1C2C(C)OC12C#C,0.2484
c1cc(c(c(c1)N)F)N,0.2164
O=C1OC2CCC3C2N13,0.2784
N=C1NC(=[NH2+])N[C-]1C#N,0.1497
O=C1CC23OC4C2C1C34,0.2214
CC12CCC(C1)C(=N)O2,0.286
N#CC12CN1CC=CC2,0.2541
CC1C2CN=C3OC1C23,0.2165
CC1C2OC3C(C)C3C12,0.3141
CN(C)c1c([nH]nn1)N,0.2256
OCC1C2CCCCN12,0.2728
CC(=O)C(=O)CCC#N,0.1587
CCc1cccc(c1)N,0.2069
NC(=[NH2+])C1=COC(=O)[N-]1,0.1695
CC(C)C1CC(=O)CO1,0.2196
CCC1(NCC1O)C=O,0.195
OCC12CCC(O)C1O2,0.3281
OCC1OC11CC2NC12,0.3045
COC(=O)C(=O)NC=O,0.1828
O=C1CC2C(C1)C2C#N,0.2234
CC(=O)OCC1(CC1)O,0.2641
CC1OCC1NC(C)=O,0.2733
CC(CCO)CC(N)=O,0.2782
Cn1c2c[nH]cc2nn1,0.1792
c1nc(c(o1)C(=N)N)O,0.187
CN=C1C=COC(O)=C1,0.1818
OCCC1OC2COC12,0.3079
CCC1CC2(O)C(C)C12,0.3189
CCC12CCC(O)C1N2,0.3071
CCC1(O)C2C3OC3C12,0.2793
CCc1ncc(nn1)O,0.1687
CCCOC=NCC=O,0.2203
C#CC12C3CN1CC2N3,0.2372
CCC12NC(C=C1)C2=O,0.2454
CN=CN(C)C(=O)CO,0.2295
OC1CC2(O)CCC=C12,0.24
CC1C(C=O)N1C1CC1,0.2065
CCC1=CCC2CC12,0.2464
CC1C2CC3C2C3C1O,0.3164
Cn1c(c(cn1)O)O,0.2396
OC1C=C(C=O)C2CC12,0.1871
CN=COCC#CC#C,0.2191
C1C2NC3=C(C=CO3)C12,0.2092
CC1C2CC3CC(O3)C12,0.3104
CCC1C(O)C(=O)C1O,0.2215
OC1C2N3CC3C12C#C,0.2373
OC12CC3C4CC1C4C23,0.3192
CCCC1OC1(C)C#C,0.2856
c1cnc(oc1=O)C=O,0.1663
Cc1cccc(c1C)N,0.2073
OC1CC2C3OC2C13,0.2959
CC1C2CC11CCOC21,0.3359
CCCCOCC#N,0.2928
OC1C2C(=N)OC12C#C,0.2438
CC(C)(CC#N)C(=O)N,0.2764
N=C1OCC2OC12C=O,0.2075
COC(CC#C)C1CC1,0.2937
OC12CC(C1)C(=O)C2,0.2298
O=C1NC2CCC2CO1,0.3018
CC1(C)C2COC1C2=O,0.2073
O=CC1C2C=CCN12,0.1992
O=C1CC2CN=COC12,0.2001
O=CC12CC3C4C3N1C24,0.2078
Cn1c(cnn1)NC=N,0.2114
CC1C2CC(C12)N1CC1,0.3175
CC12CC(=O)C3OC1C23,0.2122
CC12CC1(O)CC2(C)C,0.3163
CC1C=CC2CC2C=C1,0.2502
C#CC1OCC=C1C#C,0.2086
OC1CC2NC(=O)C2C1,0.2779
CC1(CC#N)CC1C#N,0.3011
[O-]C(=O)C1C[NH2+]C11CC1,0.2635
CCC(C)(OC)C1CO1,0.3196
CC1CC11CC(C1)C=O,0.2224
CC1OCC(=O)CC=C1,0.2062
C#CC1(CC1)OC2CC2,0.2736
CC(C#C)C(C)(O)C#N,0.2896
NC(=O)NCCC1CO1,0.3043
CN1C2C1C(O)CC2O,0.2939
C(CC(=N)NC=O)CO,0.2319
CC1OC11CN2CC12C,0.3135
CC(C)Nc1cocn1,0.2085
CC#CC1OCC1=NO,0.2465
CC12NC1C(C)(C)C2O,0.3066
CC(O)(C=O)C(=O)C=O,0.143
COC1(C#N)C2CC1O2,0.2787
OC1CCN2C(C#N)C12,0.2667
CC12CC(=N)OC1CO2,0.2845
c1coc(c1N(=O)=O)N,0.1593
CC1CC2C3CCC3C12,0.3185
CC#CC1C(O)C2CN12,0.2635
NC1=CN=NOC1=N,0.1696
CC12CCC1C2CC#N,0.302
N=COC(=O)CC#N,0.2523
NCC(=O)OC(=N)C#N,0.1877
C1NC1C1=CCC2OC12,0.2325
C#CC(=O)n1ccnc1,0.1696
N=C1NC(=O)CC1C#N,0.2495
CCC(=O)C#CC#CC,0.1815
ON=C1CC(O)C11CC1,0.2345
CN=C1ON=CC=C1F,0.1657
NC(=O)CC1CCC1=O,0.196
CC1=CNC(OC=N)=N1,0.2172
CC1(CO1)C(O)CCO,0.3395
CC(=Nc1nnon1)N,0.1879
CC(C)CC1CC(=O)N1,0.284
C1C=C(CC(=O)N1)C#N,0.2076
C1CC1(CO)OCC#N,0.277
OCC(O)CC#CC=O,0.2053
O=C1CN2CCCCC12,0.1942
NC1=NC(O)=CC(=N)O1,0.188
CC(O)CCCC#C,0.3143
CN1C(CC1=O)C1CC1,0.2794
CC12CC1C(=O)NC2,0.2666
CC1(O)C(O)C1(N)C#N,0.2788
N=C1OCC2(CC2)C1=O,0.1901
Cc1ccc(c(n1)O)N,0.1887
CC12CC(O)C1C1OC21,0.3087
CC1CC(=O)C(CO)O1,0.2171
C1C2OCOC1C1OC21,0.3174
c1cc2c(cno2)nc1,0.2017
CC1CC=C(C)C1C=O,0.2062
CC(O)C(C)N(C)C=O,0.2641
CCC1C2OCC12C,0.3053
NC(=[NH2+])[C-](C#N)C(N)=O,0.2072
CCOc1ccc[nH]1,0.2422
c1cnc(c(c1O)F)O,0.2267
CC(=O)n1cnnc1,0.2097
CC(C)C1(CC1)CCO,0.3399
O=C1NC2CC1(C2)C#N,0.2611
NC=[NH+]C(C#C)C([O-])=O,0.1385
CC1(NCC1=O)C(N)=O,0.2034
CC12OC1C1OC21C=O,0.2061
N=C(OC(=O)C#N)C#N,0.2266
COC12CC(CC1)C2=O,0.2128
CC12CC(C)(C1O)C2=O,0.23
C#Cc1ccc(nc1)O,0.1958
CNC(=O)CCC#N,0.2791
CC#CCC(C=O)C#C,0.216
N=C1OCC2NC12,0.2658
CC1OC2(C)C(CO)C12,0.3037
OC1C2OC3C2C13C#N,0.2688
CC1(C)C2OC(=O)OC12,0.3149
CC1(C)C[NH2+]C1C([O-])=O,0.2622
C1CC11C=CCC11CO1,0.2482
O=C1C2CN2C1C#N,0.2197
O=C1CC2NC1C21CO1,0.2114
c1c2n(cn1)CC=CC2,0.2222
CC1(O)C2C1C(=O)C2O,0.2198
CCC(=O)C(C)C,0.2313
CC1OCCOC1C#N,0.2743
CCC(=O)CC(C)(C)C,0.2301
CC1(O)CC(CO)C1,0.3245
O=C1C2C3C4CC(C14)N23,0.2135
C#CC1N2CC2C11CC1,0.2571
NC(CO)C(=O)OC=N,0.2116
CC1CC2(O)C1OC2=O,0.2618
CC12CC1OCC2C#C,0.2791
OC12C3CC(C13)C21CC1,0.2964
OCCC12CC1CC2=O,0.2317
CNc1cc(cn1C)N,0.2197
Cc1cnn(c1C#C)C,0.2087
CN(CC#C)C(=N)C=O,0.1677
CC12CC3C=CC1C3O2,0.2384
CC12CN(C1)C21COC1,0.3048
CC1C2C3C(O)C1(C)N23,0.3068
OCC12OC(C1O)C2O,0.3057
O=CCCC1COC1=O,0.2283
Cn1c(ccn1)N(=O)=O,0.1869
C#CCCCC(=O)C#N,0.1835
OC1CCC(C1)C#C,0.3111
CC1(NCC1C=O)C#N,0.2162
CC1C2OC(C12)C(N)=O,0.2658
CNC(=O)C1NC1C#N,0.2475
COCC12C3C4C1N4C23,0.2743
CC1(OC2CC12)C1CC1,0.3134
CCC(=O)c1ccon1,0.2005
COCC1OCC1C#N,0.2837
c1cnnnn1,0.166
CC12OC(=O)C1C2CO,0.2608
OCC1(COC=O)CN1,0.2663
C1C2C3C4C5C(C2N15)N34,0.2674
C#CC1(CCCO1)C#N,0.271
CCC(C(C)C)C(N)=O,0.2737
OC1CC1C1=CNN=N1,0.2154
CC1C(CC1C#N)C#C,0.2868
CC1=CCC(=CCC1)C,0.2501
CC1OC(C)(C=C1)C#C,0.2512
COCCOC(=O)C=O,0.1804
CNc1cnn2c1CC2,0.2199
CC1NCC(=N)OC1=O,0.2343
C#CC1C2C3CCC2C13,0.3006
CC1CC1(OC=O)C#N,0.2715
COC1(C)C=CC2NC12,0.2364
CC(C#C)C(=O)C1CC1,0.2269
Cn1cc(nn1)N,0.2155
CC1N(C)CC=CC1=O,0.1649
O=CN1C2CC2CC1=O,0.2171
CN=C1NC(=O)NN=N1,0.1744
CC1NCCOC1=N,0.2572
OC12COC3C4C(C14)C23,0.3038
N=COC1C2OC1C2=O,0.2353
O=C(C#C)C1COC=N1,0.1876
O=C1NC2CC12,0.2561
Cc1nc(=O)nc(o1)N,0.2162
COCC1C2CC(O)C12,0.3131
CCn1cc(cn1)C#C,0.2251
CCN=C(N)NC=O,0.2167
c1c(con1)CN2CC2,0.2368
NC1C2CCOC12C#N,0.2522
[O-]C(=O)C(=[NH2+])NC1CC1,0.1953
CC1=CNN=C(N)C1=N,0.1727
CC1(C)CC2CC(C2)O1,0.3114
CCC(CC#C)C(C)O,0.3142
OCC1OC2CC(O)C12,0.303
CCC1OC2(C)CC12O,0.2973
N=C1NC=NC(=N)N=C1,0.1724
O=C1CCCC1C1CN1,0.2136
CC(=N)OC(CN)C#N,0.2689
COCC1(O)COC1=O,0.2607
Cc1cc(=O)cc([nH]1)C,0.2001
CC12CCC1CC2,0.3415
CN(C)C(CO)C(N)=O,0.2415
CCC(C#N)C1CO1,0.3116
COCC1CCCC=C1,0.2647
CC12CCC3(C)C1OC23,0.3096
C1CC23OCC4C(C24)C13,0.3226
CC1COC2CC1C=C2,0.2438
CC1C(C)=CCC1(C)C,0.2573
C1CC12CC(=O)C=C2,0.1918
CC1CC2C3N2CC13C,0.2967
[NH3+]C1C2CCC12C([O-])=O,0.1319
C(C#CC#N)C(F)(F)F,0.2457
CC12CC1N=C(N2)C=O,0.1635
C1OC1C1COCCO1,0.3226
CC1OC2(C)C3OC3C12,0.3034
O=CC1OC1CC#N,0.2174
c1cn[nH]c1C#CC=O,0.1694
CC1(O)CC2C(C#N)C12,0.2926
CNC(COC)C#N,0.2666
CC(O)C1CC2OC12C,0.3109
CC12CC1C1CC2(C)O1,0.3267
C(CC(=N)NC=O)C=O,0.2203
CN1CC1C#N,0.2692
CC1(OC2CC1C2)C#C,0.2828
CC1(CC1)OCC(=O)N,0.28
CNc1c(c[nH]n1)C#N,0.1993
CC(C)C#CC#CC#C,0.1862
ON=C1CCC(=O)C1O,0.2135
C1CC(=C2CCC=C2)C1,0.1877
C1CC1(COC(=O)N)O,0.3054
CC12CC(O1)C1CC21,0.3396
CCc1cn[nH]c1C,0.2508
CC12C3N1CC2(O)C3=O,0.2275
COCc1cc[nH]c1,0.2521
CC(C)NC(C#N)C#N,0.2499
CCC1C(CC)C1C#C,0.2871
CC12C3C1C1OCC3C21,0.3286
CC1=CCC(=O)C(O)C1,0.2213
CCC1OC1C1CN1C,0.3102
Cc1cc(c[nH]1)C#N,0.2219
CC1=CCCCOCC1,0.2538
OCC12CC1C(C2)C=O,0.225
CC(=O)C12C3C4C(C13)N24,0.2056
c1c(nc(c(=O)o1)O)F,0.1618
CC1C(=O)C2NC2C1=O,0.2068
c1(c(=O)onc(n1)O)N,0.1756
ON=C1CCC2OCC12,0.2457
CCC12COC1=NCC2,0.2587
CCOC(C)CC(C)O,0.3173
O=C1NC(CCO1)C#N,0.2842
O=CC1(CC1)C1CCO1,0.2222
OC(C#C)C1(CO1)C#C,0.2736
OC1C2C3C(O)C1N23,0.3037
CCC1N2CC1(C2)OC,0.32
CCC(CC)(CC)CC,0.3576
C1CC1CNC(=N)C=O,0.1698
CN(C)c1cnc(o1)N,0.2319
C1C2C3C1N1C2CC31,0.3147
O=CC1C(=O)CC11CC1,0.2056
COC12CC3C1C(O)C23,0.3294
CC12C(O)CC1C1CN21,0.2753
CC(C)(C=O)C1CCO1,0.2167
C#CC1OC1C1CN1,0.2559
CCC1(C)CC(O)C1=O,0.2161
OC1C2(CC2)CN2CC12,0.2895
CC1(C)C(O)C1C1CC1,0.3059
CC1(O)COCC1C=O,0.2176
CC(O)CC1=CCCC1,0.259
CC1CC11CC(=O)C1C,0.2188
C1OC2CCN=C2O1,0.272
CC#CC(=O)C#CC=O,0.1873
CC1=CC2CC2CC1,0.242
CCCCC1(CC1)OC,0.3267
CC(=O)C1(C)CNC1=O,0.2215
Cc1c(cc[nH]1)N2CC2,0.2381
CN1C(=N)ON=C1C,0.2279
CC1C2CCC3CC2C13,0.3384
CC(C)(COC)C=O,0.2295
N=C1ON=NC(=N)C=C1,0.1589
CCC1=CC=CC(=N)O1,0.1658
CC12OCC3OC1C2O3,0.2993
CCC12CN1CC2(C)C,0.3048
OCC12C3CC1C=CC23,0.2372
CCCCN1CC1CO,0.2818
O=C1COCC2CC2N1,0.2663
O=CC1C2CCC1C=C2,0.2129
C1C2CC1C13CC(C1)C23,0.3341
O=CC1OCC2OC12,0.2214
CC(C)C(=O)N(C)C,0.2685
CC1N2C3CC2(C)C13O,0.3088
CC12CC(C1O)C21CO1,0.3078
ON=C1C2OC2CC1=O,0.1704
CC1CCC(O)C2NC12,0.3095
CC1COCCC1C#C,0.2895
O1C2C1C1OC2C=C1,0.2431
O=CC12C=CC3CC1C23,0.2086
Cc1cnc(c(=O)[nH]1)F,0.175
CNC(=N)C(=O)CCO,0.1702
C1CC23CCC4C2C1C34,0.3735
CC1=CNC(=N)C(=O)O1,0.166
O=C1CC2C3CC(N1)C23,0.2674
CC(O)C(O)C(N)=O,0.2821
Cc1cnco1,0.243
CC1(O)C2OC2C11CO1,0.3065
C1OC2C3CC12OCO3,0.2781
CC1OC2(CCC12)C#N,0.2707
CC1C2NC1(C)C2C#N,0.2743
NC1=NC(F)=CC(=N)O1,0.189
CC1OC2CCCC2=C1,0.2427
COCC(C)(O)CC#N,0.3106
CC(C#C)C1=CCCC1,0.2546
CC(C)C1OCC1C#C,0.2873
O=CC12C3N1CC2C3=O,0.1965
CC12OCCCC1C2O,0.3015
OCC1C(O)C1NC=O,0.2635
CNC(C#N)C(=N)OC,0.2379
N=C1OC2CC3(CO3)C12,0.2828
CC1OC(C)(C)C1(C)C,0.3094
OC1CC1C1CC2CN12,0.2952
CN1CC(=NO)C1C#N,0.2284
CC(CO)C1CC(=O)O1,0.283
CC(O)C12CC3C1CC23,0.327
CCn1cc(cn1)O,0.2315
CC(CO)C1=NC=NO1,0.2584
OC1CC23CCC2C1O3,0.2962
NC1=[NH+]C([O-])=CC(=N)N1,0.1583
OCC1OC(=N)CC1O,0.2841
OC12CN3C1CCCC23,0.3087
C1C2CN1CC=CCO2,0.1915
C#CC12OC1C1NC21,0.2357
c1cnc([nH]1)NC=O,0.1994
C1OCC2OC1C1NC21,0.312
CC1CC2C(O)C12O,0.312
O=C1NC=CCC2CC12,0.2133
CC1(C#N)C2C3CC1C23,0.3103
CCc1c(cc([nH]1)N)O,0.2208
CC(O)C1CN1C,0.2977
CC12C3C4C1C4(C#C)C23,0.2481
OC1C=CCCNC1=O,0.2182
O=C1CC2(CN12)C1CC1,0.2375
OCCC1OC1CC#N,0.3073
CC1C2CCC1(O)C2C,0.3202
CC12C3C4CC(N13)C24C,0.3052
O=C1C2C3OC(=O)N1C23,0.2373
N=C1OCC2C1NC2=O,0.2613
CC1CC1(C#N)N1CC1,0.2798
CC1CC2(C)CC(C2)O1,0.3155
CC#CC(=O)C1(CC1)C,0.2039
CCc1[nH]nc(n1)CO,0.2593
C1CC23OCC4C2CC134,0.2938
CC1C=CCCOC=N1,0.2466
[O-]C(=O)CC(=[NH2+])NC=N,0.1958
N=C1N=CN=COC1=O,0.1955
C#Cc1c(nco1)O,0.1892
CC(CNC=[NH2+])C([O-])=O,0.2394
OCCC1C2C3OC3C12,0.2831
C#CC12CC(O1)C21CN1,0.2511
CC1CC11OC(=O)C=C1,0.2096
OC1C2C=CNC(=O)C12,0.2115
c1cc(n2c1CC=C2)O,0.1843
CN1C(=N)CN=C1C#N,0.1791
CC(C)C1OC1(C)C#C,0.2855
C1CCN(C1)C(=O)CO,0.2689
CC1CCC1C(F)(F)F,0.3797
Cc1c(nc(n1C)O)N,0.2257
OC1CC2CC3C(C2)C13,0.3259
C(C(=O)C=O)OC=O,0.1533
CC1OCC1NC=O,0.2742
CC1C2CN2CC1=O,0.2035
CCCCC1COC1=O,0.2804
C#Cc1nc(=O)onn1,0.1479
CCCC(C)CCOC,0.3331
ON=C1CC2CC1C2O,0.2516
CC1=NC2CC(O1)C2O,0.2499
OC1CC=C(C1)C#C,0.2098
OC12C3C1C1C3C3C2N13,0.2801
O=CC1C2OC1C1NC21,0.2157
CC(C1CC1)C(=O)C#N,0.2006
CCC1(CC2OC12)C#C,0.2964
c1c(cc(nc1N)O)O,0.2182
C1CN1CCCCC#N,0.2773
CCCC(=O)NC(=N)N,0.2277
CC(O)C1(CC#C)CN1,0.2984
N=C1ON=C(C=C1)C#N,0.1569
CC12COC1C1(CO1)C2,0.2931
CC1N2C3(C)CC3C12C,0.2814
CCC12CC1OC21CC1,0.3006
c1c(coc1C#N)C#N,0.2042
OCC1CC1CCC#N,0.306
C(=Nc1n[nH]nn1)N,0.2141
CC1=CCC2CC1O2,0.2418
CCC1(COC)CC1C,0.3283
CC1OC(=O)C11CN1,0.2589
CC#CC1CC=CCO1,0.26
CC1OC2(CC2O)C1C,0.2985
CN=C1CN=CN1C=O,0.2154
C1OC1C1OCC2CC12,0.3372
CC1OC11CC2OC12,0.327
c1nc2c(o1)oc(=O)[nH]2,0.2022
CC(CO)C1CC1CO,0.3336
COCC(C)C(C)C=O,0.227
Cn1c(c(nn1)N)N,0.2273
COC1CC2CC2(C)C1,0.3268
CC1C2C3CC2OC1C3,0.3186
C1CCC(CC1)C(=O)N,0.2763
OCCC1NC(=O)C=C1,0.2153
N#CC1NC11CCCC1,0.2821
c1c(c(=O)c(co1)F)N,0.1742
OCCC(CC=O)C#C,0.2233
CCn1ncc(n1)C=O,0.1986
CC(=O)C(C)(C)C#N,0.2311
C1C23CCC12COCC3,0.3148
CC(O)C(O)C(=O)CO,0.2298
O=C1C2CCN2C1C#C,0.1972
OCC(CC=O)CC#C,0.227
COCC1(C)NC1C,0.3194
CC1C2CC(C#C)C1O2,0.2929
CC12CN3C4CC1C4C23,0.2786
CC(C)C(CO)CC#N,0.3213
CCC1NC2(CC12)C#N,0.2441
O=C1COC2CC3C2N13,0.2314
C1C=CCN=C(N1)C#N,0.2143
CCC(C)(CC#C)OC,0.3041
c1c(c(n[nH]1)N)C=O,0.1866
CCCCCC1CN1C,0.3034
C1CN1C12CN3C1CC23,0.3123
OC1(CC1(O)C#N)C#C,0.2525
O=C1C2C3NCC1OC23,0.193
C#CC12CN1C1COC21,0.2408
O=C1CNC1C1CC1,0.2173
C1COC(=O)N1C(=O)N,0.2722
CNc1cnn(n1)C,0.2106
ON=C1CC2C1N2C=O,0.2426
Cc1c(c(=O)[nH]nn1)F,0.1883
CNC(=O)C1CN1C,0.2404
C1CC23NC12CC1OC31,0.2999
c1coc2c1CN=C2N,0.1966
COC1(C)CNC1=O,0.2588
CC1N(C)CC1(O)C#N,0.2433
C1CC1OC12CC1OC2,0.3028
OC1CCC(CC#C)C1,0.3117
CCCC(=O)C(O)C=O,0.2053
CN(CCN1CC1)C=O,0.2694
CN=COc1cc[nH]c1,0.2345
CNC(=O)CCOC,0.2778
CCN1C(=O)CNC1=O,0.2561
N#CC12CC3C4C(C13)N24,0.2614
OCC1=CC2NC1C2O,0.2302
CC#CC(C)(C)COC,0.3037
O=CCC1C2C3OC3C12,0.2175
CC1OCC2=CCOC12,0.2429
C(=N)N(C=N)C(=O)N,0.235
CCN1CC(O)C1C#C,0.2575
CC1(CC1)OC2(CC2)C,0.323
OCC1C2CC3CC1C23,0.3284
O=C1CC2CC(C#N)C12,0.2153
CN=C1OC(C)C=C1C,0.2114
OCC12OC1CCC2O,0.3152
CC1OC11C=CC2NC12,0.2376
CC12OC3C1C1C2C31O,0.3081
CC#CCC(=O)NC=N,0.2268
CC1CCC11NC1CO,0.316
O=C1C2C3CC4C(C23)C14,0.2197
CC12C3C1N1CC2=CC31,0.1064
CCC1NC(=O)C1C,0.2797
c1c(c(co1)C#N)CO,0.2187
NC1C2COC12C#N,0.2304
CC12CNC(C1)C(=O)O2,0.2444
OC1C2CNC(=O)C12O,0.2585
COC1C2COC=NC12,0.2498
ON=C1CNC1CC#C,0.2299
CNc1ncn(n1)C,0.2195
CCC1CC(O1)C(C)O,0.3215
N#CC12CN3C(CC13)C2,0.2688
[NH3+]CC1CC(O1)C([O-])=O,0.2741
CC12NC(C)(C1O)C2O,0.3094
C1C2C1C1CC3C2CC13,0.3306
OCC1C2CC3(CC3)N12,0.2964
OC1C(CC=O)OC1=N,0.2254
Cc1c([nH]c(=O)o1)N,0.2373
CC1NCCCOC1=O,0.2471
CC#CC(C)(CO)C=O,0.2208
CCC1(C)CC1C(C)C,0.3382
c1ccn2cccc2c1,0.164
OCCC12CC1OCO2,0.3063
CC1(C)CCC(O)CO1,0.3104
OC1COC(=O)CC=C1,0.2491
CC(C)C(C)C1(C)CC1,0.3409
N=C1OC2OC3CC2C13,0.2733
CCN1C2CC1C2=O,0.2504
CCOCC1NC1C=O,0.2225
CCC1CC2CC12C,0.3276
CC1(CC=CC1)NC=O,0.2584
CC1COC2CC1C2=O,0.2114
C1C=Cc2c1c(n[nH]2)N,0.1838
CC1N2CC2C=C1CO,0.2317
CCC12OCC1C1OC21,0.2967
N#CC12C3CCC1CN23,0.2553
CC1C2C(C1C#N)N2C,0.2768
OC1COC2CC=CC12,0.2609
CCC12CC1OC1CC21,0.3118
CCC(O)C1=NC=CN1,0.2481
CCC#CCO,0.279
CC1(O)CC(=N)OC1=O,0.2559
CC1(O)C([NH3+])C1C([O-])=O,0.2697
CC1C2OC3C2C3N1C,0.273
OCC1CC(C=O)=CN1,0.1788
OC1CC2CC1CC=C2,0.2593
CCC(O)(CO)CC#N,0.3149
C1COCCC(=O)OC1,0.267
OC1COC23CN(C2)C13,0.2729
CC(O)CCC(C)CO,0.3351
Cc1cnc(nc1F)C,0.2243
O=C1NC(=CO1)C1CO1,0.2239
CCCc1coc(=O)o1,0.2526
N#CC12CC1OC2,0.2717
CC1OCC2NC1C2O,0.3161
CC12CCC(O1)C2(C)C,0.3198
CCC1(CC1)C(=NO)C,0.2507
N#CC1CN2N=CC=C12,0.2612
NC(=O)C1=CNCC1O,0.1997
CN1CC1C12CCC1O2,0.2911
CCOCCC(C)OC,0.3265
CCC1=CCCCC=C1,0.2064
CC1(C)CC2(NC12)C#N,0.2626
CC1C2C(C=O)C(=O)N12,0.2086
Cc1c(cc(o1)N)C#N,0.1896
c1nc2c(o1)c(on2)N,0.1835
CCC1OC(C#N)C1N,0.2575
C(=O)C(=O)C(=O)N,0.1265
OC1CC2C3CC2C1O3,0.3117
CCOC(=O)C(C)CO,0.2807
O=CC1CC2(NC12)C=O,0.1969
CC1CC2C1CC2(C)C,0.3374
OCC1C2NC(=N)C12O,0.2455
CC1C(O)C(O)C1=O,0.2208
CC1OC(CC=O)C1C,0.2245
C1CC11C2OC1C21CN1,0.3085
CC1CCC1C1CN1C,0.2965
CC1CC(C=O)C(=N)O1,0.2253
C1N2C3C4CCC13C24,0.3052
C1C2(CO1)C=CC(=O)O2,0.2129
CC#CC1CC1(C)CO,0.2789
CC#CC1CN1CC#N,0.2539
CC(CC(=O)C=O)C#N,0.1575
C1CC(O1)C1=NC=CO1,0.2345
OC12CNC1=NC1CC21,0.2265
CC1=CC2CC2CCC1,0.2328
CC1CN(C)C1C(N)=O,0.2415
C1C2CC3CC(CC13)C2,0.3647
Cc1nc2n(n1)CCC2,0.2624
OC1C2CC3C=CC2C13,0.2469
C1C2CCC3CC=C1C23,0.2328
CC(C#C)C1CNC1=O,0.2772
CC1CC2CCC2CO1,0.3216
CCC1CCC1(C)O,0.3268
O=C1OCC2C3CC12O3,0.2485
CCC(O)C(=O)N(C)C,0.2685
CC1CC2OC1C21CN1,0.3163
COc1ccccc1F,0.2203
CC1(CC2(O1)COC2)C,0.3054
CC(C#C)C1=CN=CO1,0.2419
O=CC1CCC(N1)C#N,0.2092
CC12C3C1C1(C)C3C21C,0.2987
C1C2C3C4C5CC1(C24)C35,0.3285
CC(C)(C)CNC(=O)N,0.2979
C1OC2C3CN(C3)C12,0.3087
C1C2C3CC4OC1C4C23,0.3118
Cn1nc(nn1)CCO,0.2436
CC1N=COCC1(C)O,0.2742
OC1C(CC1=O)C#N,0.2185
OC12CCC1OC1CC21,0.3059
COC(C)C1(C)CO1,0.3357
C1C2CCC3OCC2C13,0.318
OCC1=CC(=N)N=NO1,0.1622
O=CNC1CCC=C1,0.2519
C(COC(=O)CN)O,0.2591
C(COCC(F)(F)F)O,0.3385
CC(C)NCC#N,0.2706
Cc1c(c(nn1C)N)N,0.2182
CC(O)C1CC(O1)C=O,0.2141
CC1OCC23CC12CO3,0.2857
CC(C)(C)CC(=O)CO,0.2346
CC(C)N(C)C(=O)N,0.29
Cc1c(=NC)ncon1,0.1986
NC(=O)C(CC=O)C#N,0.2272
CC(=O)CCC(C)(C)C,0.2347
N#CCC1CCCO1,0.3016
O=C1C(NC11CC1)C#C,0.2052
CCC1C2C=CC1C2=O,0.2471
OCC1CC(=O)C=CN1,0.1881
CC(C)C1OC1C#N,0.2923
[NH3+]C(CN1CC1)C([O-])=O,0.2726
O1C2C=CC3C1C=CC23,0.2288
CCC(CO)C1CO1,0.3312
CC(C)(C(CO)CO)O,0.3097
NC(=O)CC1(CO1)C#C,0.2522
c1c(cnc(n1)CO)N,0.1937
NC(=O)C1CCOC1,0.2716
CC(=O)COCC1CC1,0.2344
CCC1CC1CCC=O,0.2278
O=CC1CC2CCC2C1,0.226
Cc1cnc2n1cco2,0.2149
COC(=O)C(=O)N1CC1,0.1986
CC1=C2CCC2CC1=O,0.1981
c1c2c(c(o1)N)nc[nH]2,0.1724
CC1C=CC(=O)CN1C,0.1715
C1C=CCOCOC=N1,0.2389
OC(CCCC#N)C#C,0.2969
COC1(C#C)C(O)C1O,0.2476
CCC1C=CCC1=NO,0.2455
OC12CNC1C(C2)C#N,0.2598
C(C#CC(=O)N)C#N,0.233
CC1OC2CC2C1C#N,0.2797
CCC(C)C1C(C)C1O,0.3018
CCNC(=O)C(=NO)C,0.2096
C(C(CO)COC=O)O,0.2857
CC1NC(=N)C11CO1,0.2535
OCC1(OCC1O)C=O,0.2088
CCC(COC)CC#N,0.3003
C1OC1C1CCCC=C1,0.2638
OCC1CC2OC=NC12,0.2613
c1c(c(c(cn1)O)F)N,0.208
OC1CC1C1CC2CC12,0.3267
OC1CN2CCC12C=O,0.1931
O=C1CC2=NCC3C1N23,0.2056
CCC1(C)C(C)C1O,0.2986
C1C2C3C1N1CC3=CC21,0.11
C1NC11CCC11CN1,0.2845
C#CC12OC3CC1CC23,0.2588
CC12OC3OC1C2C3=O,0.2017
CC12C(OC1=N)C2C#C,0.257
CCC1COCCC1O,0.3022
C#CCN=C(C(=O)N)N,0.2177
CC1(C)CC2CN3C2C13,0.3026
OCC12OC1C(=O)C2O,0.2023
Cc1ncc(o1)CC#N,0.2375
CC12OC1C1CC2C=C1,0.2528
CCC12OC1C(C)C=C2,0.2455
CCC1C(O)C1OC=N,0.2526
c1c(nco1)CCCO,0.247
CC1OC2(CC2)C=C1C,0.2278
CC12CCC(C#C)C1N2,0.2927
CC(O)CC1CN=CO1,0.2707
CN1CC2=CCC(O)C12,0.237
CC12CC1OC2(C)CO,0.309
CC1C(O)C(C)(O)C1O,0.2835
CC(CCCO)C#N,0.3124
CC1(C)NC1(C=O)C#C,0.2134
NC(CCC#N)CC#N,0.2897
CC#CCOCC=O,0.2253
OCC1(O)CCC11CC1,0.3066
CC(C)NC(=O)C=O,0.175
CC1C2C3C4C(C=C13)N24,0.1768
C(=O)c1[nH]c(c(n1)O)O,0.1558
OC1C2C3C2N2CC1C32,0.2716
CC1C2CC1(C#N)C2O,0.3073
Cc1c(cco1)OC,0.2165
c1c([nH]c(n1)C#N)N,0.1897
OCC(O)C1NC1C#C,0.2802
Cc1cc(nc(n1)F)F,0.2353
NC1C2NC2C1C#N,0.268
C(c1c([nH]nn1)N)O,0.2282
OC1CC1NCC#N,0.2596
CCCCC([NH3+])C([O-])=O,0.2682
CC12C3CC=C1C=CC23,0.1749
CC12CC=CC(O)C1N2,0.2483
O=CC1=NCC2CN12,0.18
O=C1CC2NC2C1C#N,0.2267
OC12C3CCC1OCC23,0.3134
CCC(C)C#CC=O,0.2051
c1c2c(n[nH]c2on1)N,0.2083
NC(C#N)C1CC(=O)O1,0.272
CC1C(=O)CN(C)C1=O,0.2097
N=C1ON=CC(=C1)C#N,0.1509
CN=COCC(=O)C=O,0.1378
CC(O)(C#C)C(N)=O,0.254
c1c([nH]c(n1)O)C(=O)N,0.2008
N#CC1CC11CC2CN12,0.2805
OCC(O)C1C2CN1C2,0.3058
COC1CC(C)C(=N)O1,0.2895
C1CC2CCCC1O2,0.3144
O=C1C=CC2C=CCN12,0.2102
C#CC1(COC1)N2CC2,0.2759
C1CC2(C1)C=CCCO2,0.2586
CC1OC2(C)CCC12,0.3169
C1CC=C(C(=O)C1)CO,0.194
CCC(C)(O)C1(C)CO1,0.3356
Cn1cc(cn1)C2CC2,0.2408
COC1CC2CC1(O)C2,0.3327
CC1(COCO1)C1CC1,0.3398
COC1C(O)C(O)C1O,0.2829
C(#N)c1c(c([nH]n1)O)N,0.2121
C#CCc1conc1N,0.2326
N#CC#CC1CC1C#N,0.23
OC1C=CNC(=O)C=C1,0.1788
COC1=CN=COC1=N,0.1784
C#CC1(C(=O)CN1)C#C,0.2064
CCC1(C)C2OCOC12,0.3332
CC1OCCCOC1C,0.3222
OCC1OC2CC(=O)C12,0.2174
CC1C2N1C1CC21O,0.2879
OCC(C1CC1)C1CO1,0.3381
CC1C2(O)CNC12C=O,0.193
OCC1OC(=O)CC1O,0.2758
CC1=CC(OC1=O)(C)C,0.2296
CCCOC1C2CC1C2,0.3392
OCC12C3C4C(C13)N24,0.2771
CC(CO)CC(C)=NO,0.2544
CC(=O)CC(O)C=O,0.2203
O=C1C2CC2CC2CC12,0.2231
CNC1(CC1C#N)C=O,0.1933
CC1CC2COC2(C)C1,0.3163
CCOC1CC(C1)(C)C,0.3238
OC1CC2(CC2)C1C=O,0.2137
OC12CC3C1N3C21CC1,0.2991
OCC12CC1C1(CC1)O2,0.2921
OC1C2C=CCN2C1=O,0.2444
O=CNCC#CC1CN1,0.2551
CC#CC1CC(=N)O1,0.2753
CC1=CC(C#N)C2NC12,0.246
CN1C2CC1C2CC=O,0.1875
OCC(=O)C(=O)C1CN1,0.1596
C1C(CO1)C(C=O)C=O,0.2004
CC1COC2(C)CC12O,0.289
C1C2OC22CCCCC12,0.323
OC1CC2C3C1CN23,0.2996
CCOC(=O)C(=N)OC,0.2263
CC1(C)C2CC2C1(C)C,0.3278
Cc1cccn1C2CC2,0.2348
O=C1C2CC3C2N3C1=O,0.158
CC1(CO)CC2CC1O2,0.3127
COC1CC1(C)CC#N,0.2857
CCC12CCC1COC2,0.3265
CC12CC3C=CC(O1)C23,0.2349
CC1CC2CCOC12,0.3159
C1OC2C1C1CCOC21,0.2894
OC12CC1C=CC=CC2,0.1929
CC1CCC(=O)C(C)=C1,0.1918
OC12CC1C(OC2)C#C,0.2897
CC1OC(=N)C1(O)C#C,0.2665
CCCOC1CNC1=O,0.2563
OC1=C(F)C(=N)N=CO1,0.1867
CC(C#C)N1C=NN=C1,0.2633
N=C1NC(=N)C(=C1)C#N,0.1638
O=C1NC2CC2C2CC12,0.26
CC1NCC(=O)NC1=N,0.2283
CC(O)C1CC2(CC2)O1,0.3072
O=C1CC2CC2(N1)C#C,0.2576
CC1C(C2CC2)C1(C)C,0.3214
CCC1OC=NCC=C1,0.2328
OC12C3NC3C1C2C#N,0.2565
c1c(c([nH]c1N)O)O,0.227
Cc1c(cno1)OC=O,0.2303
CC12CC3C(=O)C1C23O,0.2409
CC(=O)C(=O)COC=O,0.1557
C(CO)c1c(non1)N,0.2122
CCC1CC11CC(C)O1,0.307
c1cc([nH]c1C=O)C=O,0.1655
COC(=O)C1OC1C=O,0.2143
O=CC1OC2C3OC3C12,0.2243
Cc1c(oc(n1)C)C=O,0.191
c1c(non1)NC2CC2,0.2051
CC12CC3(CO3)C1C2O,0.3271
CC1C(O)C11CC=CC1,0.2642
OCC1CC(O)C11CO1,0.3155
NC(=O)C1C2C(O)CN12,0.2598
CC1C2OC1(C#N)C2O,0.2556
CC1(C)C(=O)CC11CO1,0.2129
CC1C2C(O)CC12C#C,0.2666
CC1(CCC(=O)CC1)C,0.2231
CCC(=NC)NC(=O)N,0.2429
CC1(CC1)C#CCC#N,0.2666
CC12CC3(C)C=CC1C23,0.2357
C1C2C3N1C1CC3=CC21,0.122
CC1CC2(CCN12)C#N,0.2394
OC1CCC(O)(C1)C=O,0.2241
CC1=CCCCCC1,0.2526
OC1CC11CCC(=O)C1,0.2208
CCCCC1CC1CO,0.3358
CC1CC2(CN2)C1=NO,0.2309
C#CCc1[nH]cc(n1)O,0.2272
NC(=O)CC1CC=CC1,0.2654
CC12C=CC(C=C1)C2O,0.2216
C1C(CN1C=O)(C=O)O,0.1971
N=C1C(CN1C=O)C#C,0.2259
Cc1c[nH]nc1NC,0.2288
CC1OC1C(O)CC=O,0.2298
CC(O)CC#CCC=O,0.2194
C1CC1N1C2C3CC3C12,0.2709
CC12COCC1CC=C2,0.2653
OCC1NC1C(O)C=O,0.2175
CC(=O)C1(CC#N)CO1,0.2226
CC1OC2OC1C1CC21,0.3364
OC12CC1CC=CC2=O,0.1869
CCN=C(C#C)OCC,0.2266
CN=C1OCCC11CO1,0.254
OC1CC(OC1=O)C#N,0.2705
CC1N(C)CC1=NO,0.2263
O=C1CC2(CCC=C2)O1,0.253
CC(C)C1(O)CC1C=O,0.2255
O=CCCC1CN1C=O,0.2255
O=CC1(CC(=O)N1)C#C,0.2101
O=C1C2CCOCC1O2,0.2268
O=C1NCCCC2CN12,0.2833
C1CC(=O)C(=O)C=C1N,0.1567
OCC1C2C3CC2N13,0.3144
CC1(C(=O)C(O1)(C)C)C,0.218
CC(CC=O)C(C)(C)O,0.2294
O=C1CC2C3C=CC2C13,0.1975
CC1CC(C)=CCC1O,0.2609
CC1(CC1CO)OC=O,0.2744
CC1=CC23OC4C2C1C34,0.2166
O=C1CCC2N=COC12,0.2033
CCC1C2COC1C=C2,0.2481
CCCC1=CCC2NC12,0.2464
CC12CCCC1(O)CO2,0.3092
Cc1cnn(n1)CCO,0.2495
CC1COC(C)(C1)C#C,0.2936
N=COC1C2COC12,0.2734
O=CN1CCC1CC#N,0.2616
N#CC1(CO1)C1COC1,0.2565
CC1OC(C)(C)OC1=N,0.2893
C[NH+]=CNCC([O-])=O,0.2405
CC1(COCC=O)CN1,0.2216
CC(=O)C1OC1CCO,0.2211
COC(CO)C(=O)C#C,0.1892
CC(C)C1(CC1O)C#N,0.3098
CC1C(C)C(=O)CN1C,0.2062
OCC12CCN1C(=O)C2,0.2374
CC1=CCCC2CC1O2,0.2404
CCC#CCCC(C)C,0.2986
OC1C2CC3CC(C3)C12,0.3119
CCNCC(NC)C#N,0.266
CC1(CC(N1)C=O)C=O,0.2094
FC1=CC(=N)NC=N1,0.1788
NC(=O)C(=O)CC1CN1,0.1647
CC(=O)N1CCC1C#C,0.2646
CC(C)CCCCOC,0.3335
CC1CC11CCNC1=O,0.2718
Cn1ccc(c1O)C#C,0.215
CC1NC(C=C1)C#N,0.2344
CCC1CC2COC1C2,0.3156
CC12CC1C(O)C2C#C,0.2922
Cc1coc(n1)C,0.2414
C1OC11C2CC1C=C2,0.242
CC12OCC1C2OC=N,0.2633
COC1CNC1CC#N,0.2772
OC1C2(O)CCCC12O,0.2928
CC1=CC2(CN2)C(=O)C1,0.2053
OCC1CC2(CCO2)C1,0.3128
CCC(O)C1(CC1)C#C,0.2912
CC1(C#C)C2C3CN1C23,0.2748
OC1C2C(O)C=CC12O,0.2301
O=CC(=O)C(=O)C1CO1,0.1293
COCCC1(CN1)C=O,0.222
c1c[nH]c2c1nc[nH]2,0.2215
Cc1[nH]c2cn[nH]c2n1,0.2137
C1CC2(C1)C1OC2C=C1,0.2323
c1cc(c(cc1N)N)N,0.1909
CCOC(=O)NC(=O)N,0.2732
CC#CC1C2OC(=O)C12,0.2419
CC1CCN1C(=O)CO,0.2666
CC1C(C)C1(C)CO,0.328
OC12CC3C1C(C2)C3=O,0.2204
CC(=O)CNC(=O)CO,0.2189
OCC1CNC=CC1=O,0.1848
N=C1CC2CN2C(=O)O1,0.2554
COC12CC3C=CC1C23,0.2254
OCC(C#C)C1CC1,0.3023
CC#CC1OCCC=C1,0.2575
CC1C(O)CC=C1CO,0.2586
[NH3+]C1CC1[N-]C(=O)C#N,0.21
Cc1nc(n(n1)C)C,0.2572
CC1C2CC1C(O)C2O,0.3177
CCC(C(=O)C)C(=O)C,0.2176
CC1(CO)CCC2CN12,0.3
CC12CC(C1)CC2C#N,0.3343
C1C2CC1CCCC2,0.3568
C1OC1C1COC=NC1,0.2712
CC1OC=NC1CCO,0.2666
CCC1OC(=N)C1(C)C,0.2919
CCC#CC(C)OC,0.2887
CCC12NC1C(O)C2C,0.2991
CC1C(C)N1C(=O)CO,0.2574
CCC(=O)C(=O)N(C)C,0.1868
OC1C2(O)CNC12C#N,0.2388
Cc1cc(=O)ccnc1,0.1538
CC#CC(=O)CC(C)O,0.1952
c1c[nH]c(c1N)N2CC2,0.216
OC12CC3C(C13)C21CC1,0.3094
CC1CC2CC1(C2)C=O,0.2218
COC=NCC1CO1,0.267
[NH3+]C1CC2(CC12)C([O-])=O,0.1161
C1N2C3CC=CC=C1C23,0.1946
OCC1=NC2C(O)C2N1,0.2367
COC(C#N)C1(C)CN1,0.2621
CC(O)CC1=NNC=N1,0.2435
CC12CC3C1N2C3C=O,0.2178
c1nc(no1)C2COC2,0.2222
CC(=O)CCN(C)C=O,0.2173
COC(C)C(O)CC#C,0.3034
CN1C2CCC(=O)CC12,0.2081
OC(C#N)C(O)C#N,0.2988
CC1C(CO)N2CC12C,0.3045
OC1C2CC1(OC2)C#N,0.2597
CN1CC1C1=CN=CN1,0.238
CC(=O)C#CC(=O)C=O,0.1532
COC(C)C1=COC=C1,0.2422
ON=C1CCOCC1O,0.2401
NC1=CC(=N)C=NN1,0.1726
CC(N)(CC#C)C#N,0.287
C1CC2C1OC1COC21,0.3112
CC1CC2C3OCC1C23,0.3064
CC1NC(=O)NC11CC1,0.2947
CN=C1NCCOC1=N,0.1894
CCC1(OC2CC12)C=O,0.21
OC1C=CCNC1=O,0.2516
OC1CC2(O)C3OC3C12,0.3024
CCCC1(O)CC(C)C1,0.3228
COC1CNC(=O)C1C,0.2751
CCC1CN1CCO,0.3155
C1NC1C#CC1CO1,0.2593
CN=C1CCO1,0.28
O=C1C2NC3C2OCC13,0.2131
OC(CC#N)CC1CC1,0.3081
CC#CC1CN(C1)C=O,0.2663
O=C1NCC2(CN12)C#C,0.2674
CC1C2COCCOC12,0.3131
CC1C(O)C=CCC1=O,0.2229
N=C1COC(=O)N1,0.2669
CC12CC1(CC2)N1CC1,0.3008
CC1CC1C1CNC1=O,0.2771
OC1CC2C3CC3C2=C1,0.2386
Cc1cnc(nc1O)F,0.2228
CC1CCOC(C)C1C,0.3208
CC12CC=CC(=O)C1N2,0.189
CC1CCC1O,0.3274
CCc1c(c[nH]c1O)C,0.2299
CCCC#CC1(CC1)O,0.2714
CCC1OCCC1(C)O,0.3161
OC1CNC1(C#C)C#N,0.254
OC1CC(=O)OCC=C1,0.2328
CC12CC(CC1C#C)O2,0.2895
CC1(OC(=N)C1N)C#N,0.2616
O=CC1CC1CCC#C,0.2284
CC1=CC23COC2C1N3,0.2244
CC12COC1C2NC=O,0.2664
CNC(C#N)C(C)CO,0.2753
CC1CN2CC3(O)C1C23,0.2881
CC1CC=CCCC=C1,0.2562
CC1C2N1C=CC2=NO,0.1765
CC1(CO)NC1C=O,0.2203
O=CN1C2C3OC2C13,0.2539
CC(C)C1OCC2CC12,0.3326
CC(C#N)C1COCO1,0.2972
NC1=C(O)N=NOC1=N,0.1431
OCC12CC1CN2C=O,0.259
C1C2C3CC1CCOC23,0.3045
CN=CN(C=N)C=NC,0.2183
CCC1=COC(=N)N=C1,0.1616
CC12CC3(CC3)C1C2O,0.3125
CC1C(C)N1C=O,0.2562
C1OC23CNC2=NCC13,0.2325
Cc1cc(c[nH]1)CC#N,0.2392
C1CC(O1)C1=COC=C1,0.2409
CC1(O)CC2OC1C2=O,0.2369
CCN1C(=O)C=CC1=O,0.1757
COC1C2CC(C2)C1C,0.3242
C1C2CC3C=CCC3C12,0.2619
CC1(C)CC(C=C1)C#N,0.2633
O=C1C2NC3CC1OC23,0.1973
N=C1CCCNC(=O)O1,0.2613
CC1CC2(C1)CC(=O)O2,0.2853
CC1(C=CC2CC12)C#N,0.2442
OC12CN3CCOC1C23,0.2727
O=CCCC1NC1C#N,0.2284
COC12CC1OC2CO,0.2999
CC1CC2OCC1O2,0.3318
CC12CC3C1OCC3C2,0.3232
CC1=CCC(O)CC1,0.2617
C1CC1C1C2C3OC1C23,0.3102
CCOC(=N)C#CC,0.2369
CCC1(CC(C1)O)CC,0.3251
COc1c(c([nH]n1)N)N,0.2458
CC(CO)C1=NC=CO1,0.2445
CC(O)(C#C)C1(O)CC1,0.2868
CC(C)N(C)C(=O)CO,0.2698
C(#CC#N)C#N,0.2113
OC1C2CC1OC(=O)O2,0.3118
c1c(cnc(n1)C#N)N,0.1886
COCC1CCC1C=O,0.2222
OCCC1CC1(O)CO,0.3033
N#CCC12CC=CC1O2,0.2475
CCOc1c(c[nH]n1)O,0.2315
OC1(CC2(CO2)C1)C=O,0.2253
CC1=C(C)C2CC2C1,0.2421
CC1C2OC3C2C13C,0.309
CC1CCCCC1=O,0.2242
O=CC1(CO1)C1COC1,0.2035
C1CC1OC2COC2,0.32
CCC1(CC1(C)O)C#N,0.3111
C#CC1C2OC1C21OC1,0.2906
Cc1ccc(c(c1)O)F,0.2177
C#CC1=NC2CC3C2N13,0.2022
C1CC23OC4C2CC1C34,0.2961
CC12CN1C1C(O)C21O,0.2771
OCC12CC3CC1CN23,0.3205
CCC1OC1(C)COC,0.3363
CN=C1OCC1C(C)O,0.2768
CC1(CC(F)(F)F)CN1,0.3247
CC1=CC(=O)CC11CN1,0.1873
CC1NC(=O)C1NC=O,0.2753
Cn1c(nc(n1)N)C=O,0.1539
OC(CC=O)CN1CC1,0.226
CC(NC(N)=O)C=O,0.2214
c1c(cc(cc1F)F)O,0.2344
N#CCC1CC1C#N,0.3118
CC1CC(CC#N)C1O,0.3074
CC1(O)C2CC(=O)C1N2,0.216
CCN1C2CC3(CN3)C12,0.298
CC1C2C3(C)CC1C23C,0.3203
OC1CC11C2C3CC2N13,0.296
Cc1nc2n(n1)CCN2,0.2468
CC1=C(C)CC(CO)C1,0.2542
c1coc2c1c(co2)N,0.2188
Cc1cc(cn1C)NC,0.2185
C1C2NC2C2=C1NN=C2,0.2451
CC1=CC2C(O)C2OC1,0.2316
CC1C2OCC(C)(C)C12,0.3016
c1c(ncnn1)CC=O,0.1625
CCC1=CCCC1C#N,0.2588
CC1C2OC2C1OC=O,0.2703
c1cnn2c1cncn2,0.1761
C#CC#CC1CC1C#N,0.2177
CC1CC11OCC1C,0.3038
N=CN1C(C=O)C1C#N,0.1947
CC12NC3COC1C23O,0.2806
O=C1C2C3OC(=O)C1C23,0.2283
Cc1cn(cn1)C(=O)C,0.1918
CCc1nc(no1)CO,0.2527
ON=C1CC(C=O)C=C1,0.1792
C#CC1C2OC1C2C#C,0.2732
C#Cc1c(=O)ncon1,0.1762
CC1CN2CC1C2C#N,0.2659
CC1=NC2C3OC2C3O1,0.2408
C1C2NC1C1=C2OC=C1,0.2088
CC1CC2C(C#N)C12O,0.2943
CC1C(O)C1(C)C(C)=O,0.2309
CC1CN(C1)CC=O,0.2024
CC(=O)C1CC1OC=N,0.2317
CC1C2CC3CC1(C)N23,0.2973
CCC(=O)C(C)C1CN1,0.2221
C#CC#CC1CN1,0.2103
CC#CC#CC#CC#C,0.1589
CC1C2OC2C11CO1,0.3253
C1CC(=O)C=CC1=O,0.1622
CCC1NC2C1OC2=O,0.2427
COC1C=CC(O)C1O,0.2398
CC1=CCCC2CC2C1,0.2549
CC1CCC(C)C1C,0.3636
CC1=CCC2(OC12)C#C,0.2406
O=CC1OC2CC12C=O,0.2107
c1c(oc(n1)O)CCO,0.2418
CCN(C=O)C(=N)CO,0.2358
CC(=O)N1CC1(C)C,0.2547
CN1CC1C1NC1C=O,0.2034
O=CC1CC2(CO2)CO1,0.2175
CC1(O)CC1(C#C)C#C,0.264
CC1C(O)C=CC1C#N,0.2566
CC(C)c1ncno1,0.2635
CC1=CC2NC1(C)C2=O,0.2463
Cc1c(nn[nH]1)CC#C,0.245
OCC(O)C1(O)COC1,0.2979
C1C(=O)CN=CNC=N1,0.2059
CC(C)N=COC=O,0.2515
CC12OC1C(O)C1CC21,0.3165
CCC(=O)NC(=O)CC,0.2242
CCC1CN2CC12CO,0.3081
C(C(C=O)C=O)C(=O)N,0.214
C#CC1C2C3OC1OC23,0.2865
CN1C(F)=CC=NC1=N,0.1696
COC=NCCCC#C,0.2681
OC1CC(=O)C2(CO2)C1,0.2058
c1cnn2c1CNC2=O,0.2364
CCCOC1COC1C,0.3226
OC1C2CC3OC2CC13,0.3149
O=C1NC2C3CC3OC12,0.2514
CC1OCC2(C)CC12,0.3396
CC(C#C)C(C)(C)C#C,0.2942
CC1(COC1)N=COC,0.2556
CC12CC1N1CC1CC2,0.2991
CC12CC(CC1)C2(C)C,0.3472
CC1(O)CCCNC1=O,0.2646
Cc1c(c([nH]n1)N)C=O,0.1901
O=C1CC(O1)(C#C)C#N,0.2565
CC1CC1CCC1CO1,0.3505
O=CC1C2C3C4C3N1C24,0.2
CC1C2C3C4CC3C4N12,0.3032
C1CC1(C=O)C#CC#N,0.2233
CCOC1=NC2CC2C1,0.2592
COC1CC(C1)NC=O,0.2789
O=CC1=NCC2(CC2)N1,0.1539
CCC(O)(C#N)C(C)O,0.3208
C1CN1C(=O)OCC=O,0.2298
CC#CC(=O)C=O,0.1504
C1C2C3OCC33CN1C23,0.2737
CC1=CCC(=O)C11CO1,0.2055
c1cncc2c1c[nH]n2,0.1734
N=C1NC(=O)C2CNC12,0.2315
CCCCc1cnoc1,0.2451
CC1CN(C=O)C=N1,0.2218
CC1(C)C2CN2CC1=O,0.2039
N=C1C(C#N)C2CN12,0.2483
COc1c(non1)CN,0.2194
CCC(C)(C)C(=O)NC,0.2756
OCCCCC1CO1,0.3423
CN1C2CC(O)C=CC12,0.2228
CC(C)C1CC1(C)O,0.3219
OC1C2NC(C#N)C12,0.2526
COC12C3CC1CC23C,0.3168
COCc1cnon1,0.2334
OC1(COC2CC12)C#N,0.2597
C1C2C3CC1C=CC23,0.2475
CN1C2C3NC3(C)C12C,0.2998
CC12C3CC3C1(C)C2O,0.3071
C#CC1CC2(CC12)C#N,0.2785
CNC1CC(=N)OC1=O,0.2266
C(C=O)C#CCC#N,0.2241
CNC12COC1=NCC2,0.2285
COC1C2C3CC3C12C,0.2803
OC12C3C1N1CCC2C31,0.271
CC1C(O)COC1(C)C,0.3016
CC#CC1CC(C1)(C)C,0.2939
C1OC11CN2N=CN=C12,0.2622
CC1CC(=N)N1C(C)=O,0.234
COc1nccnn1,0.1664
CC1(C)COC(CO)C1,0.3143
CC1OC1C12CCC1O2,0.3156
OCC1(O)C2CC1O2,0.3206
COc1c(cno1)N,0.212
CCCc1c(cn[nH]1)N,0.2253
CCOC(=O)C(C)NC,0.2317
C1CC2(C1)CCOC=N2,0.2683
OC12CC(C1)CCC2,0.3239
c1c(cc(=O)[nH]c1N)O,0.19
CC12CC3C1C1C2N31,0.2992
O=C(C#N)N1C2CC1C2,0.2107
COCc1c(n[nH]n1)O,0.2342
CC1CCCC=CC1=O,0.1925
CC1CC2=CC3CC3C12,0.2377
CC1(C)C2C(=O)CC12O,0.2287
c1c(onn1)N(=O)=O,0.1926
c1nc(=O)c(no1)C=O,0.149
CC#Cc1cnnnn1,0.156
NC(=O)C(O)C#N,0.2779
C#CC12CC1C1OC1C2,0.2754
O=C1OC2C(NC12)C#N,0.2427
CNC(=O)COC=NC,0.2554
C1C2CC3(CN=CO3)C12,0.2704
ON=C1C2CNC1CN2,0.231
CC1C2OCC1(C)C=C2,0.2479
CC12NC1CC=C2CO,0.2488
CC12OCC=C1C1CC21,0.2208
CCCC1OC1(C)C=O,0.2198
CCC(=O)C(NC)C=O,0.1902
CC#CC1NC(=O)C=C1,0.2147
Cc1cc(cc(n1)O)O,0.2241
NC1=CNN=C(F)C1=N,0.1601
C1OC2CC3OC(C2)C13,0.3195
C#CC12CN(C1)C2,0.2782
c1cc(c(cc1N)F)O,0.1919
O=C1CCC2COC1O2,0.2082
O=CC1CC=CCC=C1,0.2145
CCC1CC2CC1C2O,0.3168
O=CCN1C2CC2C1=O,0.2024
COc1coc(=O)cn1,0.1384
Cc1c(ccn1C)C=O,0.1951
O=CC1C2OC2C2CN12,0.2082
CC1(CC1(O)CO)C#C,0.2754
CCC(CC=O)C(C)=O,0.2154
NC(C#N)C1CC2CN12,0.2675
CN=c1oc(=O)nno1,0.1616
CC1C2C3OC3CC12C,0.3245
COC1C2NC(=O)C12N,0.2321
N#CC1CC2(CCC2)O1,0.2731
O=C1C2COC2C1C#C,0.2073
CCOC1=NCC(=O)C1,0.2121
CC1(C)OCC1C#C,0.2858
OCC1NC2C(C#N)C12,0.2718
OC12COCC1C1CC21,0.307
CC12C3C4C1CC4(C)N23,0.3035
OCC12CC(C1)CC2O,0.3092
NC1=CC(=O)C(O)C1,0.2078
CC1CC1(C)NC(N)=O,0.297
CCC(=O)C(=N)N(C)C,0.1854
CC1N(C)C(C)C11CO1,0.2679
CNC12C3OC(C13)C2=O,0.2168
OC(C=O)(C=O)C1CN1,0.1859
CCCC(CCO)OC,0.3222
O=CC#CC1C2CN1C2,0.1795
CC(O)CC1(C)NC1C,0.3045
N#CC1C2C3OC2C13,0.2763
c1(c(=O)onc(n1)N)F,0.1574
CC(O)C1OC(=N)C1O,0.2751
CC12CC(CC=C1)C2=O,0.2162
N=COCC1COCO1,0.2815
CC12OC3(C)CC1C23,0.3136
Cn1ccc(c1C#N)N,0.1914
OC1C2C=CC(=O)C12,0.1817
Cc1coc(=O)cc1F,0.1833
OC1CC2NC(C#N)C12,0.2674
[NH3+]CC1=COC([O-])=N1,0.2326
C1CC(=O)CCC1O,0.223
O=C1CC2CC3C2OC13,0.2076
CC12CC3C(O1)C23C#C,0.2542
CCOc1c(cno1)N,0.2118
CC1(C)CC=C2COC12,0.2415
C1C2CC11CCC3C2N13,0.2851
C1COCC2OC2C1,0.3264
CC1CC=CC(O)CO1,0.2553
CC(=O)c1nnn(n1)C,0.199
COC1C2CC1(O2)C=O,0.2038
CC1C2OC(=O)C1C2O,0.2703
N=C1NC(C=O)=NC=N1,0.1349
C1CN2C3C4NC3(C1)C24,0.2794
COC(=O)C(=O)C1CO1,0.1728
CCC(C)(C)C1CCO1,0.3167
CC(=O)C(C#N)C1CC1,0.2291
CC(C)(CO)C(O)C=O,0.2216
C1OC2CC=CC12,0.2614
CC(O)(C#C)C(O)C=O,0.2253
CC1(CC2CC1C2)C=O,0.2263
CCC1(CO)CN=CO1,0.273
CC(=O)C1OC2(C)CC12,0.2202
CCc1cocn1,0.2473
CC12CC1C1(CO)CN21,0.291
CC12CC(C)(C)C1(C)N2,0.2861
CC(CO)C(O)CC#N,0.305
CC(C)c1cc(on1)N,0.2327
O=C1CC2CCCCC12,0.2223
OCC1OC2CC12C#C,0.2658
CC(O)CN=C1CCO1,0.269
O=C1CN2CC3OC1C23,0.1847
[O-]C(=O)C(NC=[NH2+])C#N,0.1387
C1CNC(=O)C=C1CO,0.2093
CC(C)CC1(CO)CN1,0.3108
CCn1c(c(cn1)O)C,0.2266
O=C1CC2C3C4CC13N24,0.217
N=CN1C(=O)CC11CC1,0.2194
CC1=CC2NC1C2(C)O,0.2213
CC1CC(=N)OC1C#C,0.2815
CC1C2(O)COC12C=O,0.2165
N=C1OCC11CO1,0.2721
CC1CC1C(=O)C(C)=O,0.1569
CC1(CC#N)C2COC12,0.2782
COCC1CC11COC1,0.3121
CC12C3N=CN1C=NC23,0.203
c1c2c(n[nH]1)OCC=C2,0.1902
O=C1CC2OC3C2CC13,0.2261
C#CCC#CC(=O)CO,0.2089
CC1OC11COCC1=O,0.1996
CC(C)(C#N)NCC=O,0.216
COCC(O)CC(C)=O,0.2315
C1C=C(C(=O)N1)C(=O)N,0.194
CCNc1c[nH]cn1,0.2202
COc1ncc(o1)N,0.2405
OCC1OC(CO)C1=O,0.2143
CC1(O)CC11CCCO1,0.2933
CC(C)OCC1(CC1)C,0.3287
CCC1C2NC(=O)NC12,0.2798
CC12CC1CC2(C)O,0.3127
CC(=N)N(C=O)C=O,0.214
C#CC1C2COC=NC12,0.2499
OCCC1(O)CCC1=O,0.2181
CN(C=O)C1=CCCC1,0.2138
CC(CC1(C)CO1)=NO,0.2526
OC1C(=O)C=CC11CO1,0.1899
Cc1coc2c1[nH]cn2,0.2067
OC1C=CC2CC2C=C1,0.2302
CC(CC1CO1)C=O,0.2261
CCC(=NO)CC#N,0.2551
C1C(CC1=O)C2COC2,0.2228
N=C1NCCOCC1=O,0.1684
CC1C2N1CC1CC21C,0.2992
CC12NC1C1(C)CC2C1,0.3024
C1CC2C3C=CCC23C1,0.2471
CC1OCC2C3C1CN23,0.3062
CC1COC(NC=O)=N1,0.2276
CC1=CC2OC2CC=C1,0.1897
c1c(oc(=O)o1)N2CC2,0.2471
COCc1cc(no1)N,0.2343
CC(CO)C1CC2CC12,0.3299
CC1C(C)C11CC(C)O1,0.2937
CC1(CCO)OC1C#N,0.2727
OC1C=CCC=CC1O,0.2541
COCC#CC#C,0.2212
CC1CC(N1)C#N,0.2672
c1coc2c1CCC=C2,0.1726
O=C1NC2(CC2)C2OC12,0.2479
CC1CC(=O)C(C)=CN1,0.181
COC1C=CC2(C)OC12,0.2398
CCC1C(O)C1CC,0.3049
COC(C)C(C)(C)C,0.324
CCOc1cc(c[nH]1)N,0.2341
CCC1OC2CCC12C,0.3123
NC(C#CC#N)C1CN1,0.2068
COCCC(C)CC=O,0.228
CC1(CN1)C(C#C)C#C,0.2824
CCCC1CC2CC12C,0.327
COCCC12CN(C1)C2,0.3042
Cc1c2n(cn1)CC=C2,0.1787
CCC(C)CC(C)CC,0.3736
N=C1OCC2CC(C2)O1,0.2849
CC(C)C1C(O)CC1=O,0.2195
C[NH2+]CC1(CO1)C([O-])=O,0.2572
O=C1CN2CCN=C2N1,0.2202
CC1C2CCCC12C,0.3302
Cc1c(nc([nH]1)C)CO,0.2336
C(CC1CO1)OC1CC1,0.3387
C1OC11CC=CC1,0.2683
CC1C2OCCC=CC12,0.2491
CC(O)C1(CN1)C=O,0.2224
N#CC12CC3OC1C2O3,0.2889
OCC1(O)C2CC2C1=O,0.2099
OC12CC1(O)CC2,0.2944
CC1OCC2NC2C=C1,0.2398
C#CC12CC1CC=C2,0.2387
C#CC1(CC(=O)C1)C=O,0.2112
CC(=NO)C1NC1(C)C,0.2372
N=C1NC2=C(NC=C2)O1,0.2134
CCC1=NCC(O1)C#C,0.2653
C1CCC2C3OC3C2C1,0.3315
CNC1=NCC(O1)C#N,0.2386
CC1C2CC2C1C1CC1,0.3356
OC(C#C)C(=O)NC=O,0.2169
CC(OC=N)C1CN1,0.2614
C1C(CN1CC#N)C=O,0.219
COCCC1C2CC1O2,0.318
OC1C(CC=O)NC1=O,0.2162
CC1CC(C)(O)C2CC12,0.3276
COc1coc(n1)C#N,0.176
C1C2CC11OC=NC21,0.2604
CC#CC(C)C(C)C,0.3027
C1COC(=N1)CCC=O,0.2279
NC1=C(O)NN=NC1=N,0.1617
CC1NC11CCN2CC12,0.3062
CC1C2CC1CCC2,0.3523
ON=C1C2NC1C1OC21,0.2542
c1nc(c(o1)C=O)C=O,0.1685
CN1CC1C(C#C)C#N,0.2575
OCC12CC3OC1C3N2,0.2939
CCC12CN1CC(=O)C2,0.2046
CC1=CCC2CC12O,0.2479
CC1(NC(=O)C1O)C=O,0.2145
CCCCC1COC1=N,0.2895
OCCC1C2OC2C1O,0.3183
CCCCNC(=N)C=O,0.1695
CC(O)C(C)(C)C,0.327
COCC1CCO1,0.3208
CN1CCC(=O)NC1=O,0.2434
CN=C(COC)NC=O,0.2264
C1C2C3C=CC4C3C2N14,0.2013
C#CCCc1cnc[nH]1,0.2455
CC1C2CC2C1=NO,0.2448
ON=C1CCC1C1CO1,0.2477
CCOC=NCC1CN1,0.2704
CC#CC1CC=C(C)C1,0.2597
CCC#CCCNC=O,0.2694
Cc1ccc(nc1)CO,0.2207
O=C1C2CC(O2)C1C#C,0.2051
CC(C)CNC(=O)N,0.3012
OCC12C3C4CC(C14)N23,0.3059
CNC12CC1OCC2=O,0.1908
CC1CCC=CC1C,0.2684
CC1CNC(=O)C1,0.2741
c1c(c(co1)C=O)C=O,0.1915
c1c(c(co1)N)C(=O)N,0.1773
NC(=O)C1C2CN2C1=O,0.2226
CC1OC1C=O,0.2169
CN1C(=N)C=CN=C1O,0.1874
CNC1(C)C(C)OC1=N,0.2563
CC1OC(C#N)C1=NO,0.2455
C1C2C=CC3(COC3)N12,0.2275
COC1CCC1(C)C#C,0.2989
CCC1NC(=O)NC1=N,0.2571
N#CC12CN=C3OC1C23,0.1614
CC12C3C(C1O)C(=O)N23,0.2449
CN1CC1C1C2COC12,0.2925
CC1=CCc2n1ccc2,0.2011
OC1C2CC=CCC12O,0.2364
CC12C=CC34CN(C13)C24,0.2206
CC1(O)C2CC1(N2)C#N,0.2663
CCC1NCC1(N)C#N,0.2726
CC1C(=O)CC11CCC1,0.22
Cn1cc(oc1=O)OC,0.2362
O=CC1=CC2COC1C2,0.1831
CC12CC1CC2CC#C,0.3019
CCC(C)CCC#CC,0.3039
OCC1(CNC=O)CN1,0.2792
CC12CC(C=C1)C1CC21,0.2554
OC1(C#C)C2CCC1O2,0.2818
OC1CC2OC2C2CC12,0.3193
C1C=CC(=O)C(=O)C1=O,0.1228
c1c[nH]nc1C2COC2,0.2603
O=CC1C2CCC(=O)C12,0.194
c1c(ncnn1)N,0.1798
Cc1c(ccn1C)C#N,0.2215
CC(C)(CO)C#N,0.3217
CCC1C2NC(=O)C12,0.2532
CCCC(O)C#CC#N,0.2373
CC#CC12CC1C(C)O2,0.2468
CC12C3C4C3C1C=CC24,0.2483
CC(C)C1COC1=O,0.2806
c1c[nH]c2c1oc(c2)N,0.1972
CCCC1CCCC1C,0.3672
N=C1OC2CC12C1CO1,0.2766
CC1C=CC2CC=CC12,0.2619
OCC1CCCC1C#C,0.3036
CC12CCC3C4C1N4C23,0.311
C1C=CC2CCC=CC12,0.2575
Cc1c(c[nH]c1OC)O,0.2337
CC(=O)NC(CO)CO,0.2749
C1C2C3CCC1C1C3N21,0.3117
CCN1C2CC1C2C#N,0.2428
OCC12OC3CC1CC23,0.314
CC(O)C(C)C(F)(F)F,0.3412
CC(=O)c1c(cn[nH]1)N,0.1623
CC1(CC2OC12)C=O,0.2228
CC12OC3CC1C2OC3,0.2989
CC1OC2CCN=C2O1,0.2724
CCc1cc(=O)[nH]cn1,0.1981
C(C#N)NC(=O)N,0.2877
CC12CC3(CC=CC13)O2,0.234
CCC1(O)C(C)OC1=O,0.2618
CN1CCC2=C1ON=N2,0.1621
COc1conc1O,0.2326
[O-]C(=O)C1CCC[NH2+]1,0.2656
C#CC(=O)c1cc[nH]n1,0.1963
C#CCCO,0.3174
CCC1CC1OC=NC,0.2702
CC12CC3OC1C3CO2,0.3173
CC1C2NC2C(O)C1O,0.3047
CC1C2C1C(C)OC2C,0.3223
CC1C2NC1C2(C)C#N,0.2756
O=C1NC(C#C)C11CC1,0.2675
CC1C=CC2=CN=CN12,0.1817
CCC12CC(C1)C2=NO,0.2716
C1CC2N=COCC2O1,0.2616
COC(=O)N1CCC1=N,0.2472
CCn1ccc(c1)NC,0.2162
C1C2CN1C1=NC=NN21,0.2462
c1c(c[nH]c1N)CC=O,0.1838
OCC1=CCC2CC1O2,0.2424
CC1(CCOCO1)C#C,0.2931
CCC#CC1COC1=N,0.2735
CCn1ccc(c1C)O,0.2237
O=C1CC2(CC2)N2CC12,0.2196
CC12CC1N1N=NC=C21,0.2357
OC12CCC1CC1CC21,0.3231
CCC12CC1(C)OC=N2,0.2591
CCC1COC1(C)C,0.3175
CC1C2CC(=CC12)C#N,0.2046
Cc1cc(no1)C#C,0.2223
CN1C(C=O)C1C(N)=O,0.2028
CC(O)C1OC2(C)CC12,0.3009
N#CC12C3C1N1CC3C21,0.2542
C1C(=O)NC=CN1C=O,0.1853
N#CC12C3C1C1CC3C21,0.2749
C1C=CC#CCOC=N1,0.205
CC12NC1C(C)(C)C2=O,0.2153
C1OC2CCCC1O2,0.3298
Cc1c[nH]cc1O,0.2382
CC1NCCC(=O)C1=O,0.1565
COCC1=NCC(=N)N1,0.2311
CC1(O)C(O)CC1O,0.316
CCC(O)C1COC1=O,0.2796
CN1CC2NC2C1=O,0.2537
C#CCC#CCC#N,0.2827
NC(=O)C12CC3OC1C23,0.2604
CC1CC2CC(C2)CO1,0.3245
CC1=CC(=NO)CCN1,0.179
CN1N=CC(=N)N=N1,0.1695
CN(C(=N)C#C)C(=O)N,0.2023
CCCC(=O)CCC#N,0.2352
OC1CC1C1(CC1)C#N,0.2663
CC1C2N(C)C2(C)C1=O,0.2046
CCC1=CCC(=O)C1,0.2243
CC1=CC(CC#C)CC1,0.2581
c1[nH]c2c(n1)C=CCO2,0.1786
O=C1CC2CC(O2)C1=O,0.1519
OC1CN2C(CC12)C#N,0.2501
CC(C)CC#CC=O,0.2054
CC(=O)C(O)C1CN1,0.2131
OC1C(C#N)C1N1CC1,0.2831
CN1CC1C1NCC1=O,0.1908
CCN(C)C(=O)C1CC1,0.2608
CCC(C)COC=O,0.2862
CC12CCC(=O)C1C2O,0.2251
CC1CC(C)(C=O)C=C1,0.2209
CCC1CC(CO1)C=O,0.2256
CC(=O)C1(O)C2CCC12,0.215
CN=C1OC=CC=C1N,0.1594
CCC12CC1C1C(C)N21,0.2772
OCC1CCCCC1O,0.3181
CC1C2N(C)CC12C#N,0.2409
CC1CC(O)C2CC12O,0.3224
c1c(c(no1)O)CO,0.254
CCOC1CC1C(C)C,0.3132
CN=C1C2OCC2N1C,0.2342
O=C1NCC2=CCCC12,0.2384
CCCOC1CC(=O)C1,0.2211
C1CC2CCC=C2C1,0.2501
OC1CC=CC1(O)C#N,0.2552
CCCC1(CCC1)C#C,0.3043
c1c(c(n[nH]1)C(=O)N)N,0.1867
COC1CC2C3OC2C13,0.3068
CCC1=CCC(C)CC1,0.2601
Cc1[nH]c2conc2n1,0.201
CC12CC(OC1)C2O,0.3247
CC1(CO)CC1C#C,0.2879
CN1N=NC(=N)C(N)=N1,0.1709
c1cc(=O)c(cnc1)N,0.141
CC1OC2CC1C=C2C,0.2467
CC1CC2(O)CCOC12,0.3098
N#CCN1C2CC1CC2,0.2604
NC(=O)N1CCC(O)C1,0.2786
CNc1cc(c[nH]1)C=O,0.1788
c1coc(n1)C#CC=O,0.1633
OC1C2NC1C2=O,0.2345
CCC(O)CC1(C)CO1,0.3228
OCC(O)(CO)C1CO1,0.3021
CC1CC2NC(=O)C12O,0.2555
CCNC(=O)CC(C)O,0.2683
CC12CC1OC2C(N)=O,0.254
C1C(CO1)OCC#N,0.2651
c1cc(cnc1)OC=O,0.2237
c1c(c(cnn1)F)F,0.1976
C#CCOCC1CC1,0.2884
COC1CC(C)C(C)C1,0.3193
CCC1COCC2NC12,0.3073
CCC1OC1(C)CC#C,0.3037
ON=C1CC=CC2OC12,0.2284
CC1CC(O)C1(O)C#C,0.2692
CC12CC(C=C1)C(=O)N2,0.2163
CCCCC1(CO)CO1,0.346
Cn1c2c(cn[nH]2)nn1,0.2242
O=C1CC23CCC2CC13,0.2167
CC12CC1C(O)C2O,0.3153
CC(=O)C1NC1CC=O,0.2096
CC12CN3C(C=CC1)C23,0.2245
c1c(nc(cn1)F)F,0.2096
C#CC12CN=C3NC1C23,0.1708
CC1(CC=O)COC1=N,0.2237
CN1C2CC(=O)CC12C,0.2111
CC(=O)C(=O)N(C)C,0.1853
OCCC(=N)OCC#N,0.2675
CCC(O)C1CC2CC12,0.3155
C#CC1OC1CC#N,0.2802
CC(O)C1=CC2NC2C1,0.2386
COC1OC(C=C1)=NC,0.2104
OC12C=CC3C1C1C2N31,0.2231
CC(=O)C1(O)CCC1=O,0.2022
OCC1(C#N)C2CNC12,0.2763
CC12OC3C=CC1NC23,0.2242
COCC12CC(O1)C2=O,0.2479
CC1OCOC1CCO,0.3342
COC1(C)CCOC1=N,0.272
O=CC12CN3C4C3C1C24,0.2032
CC(=O)C1C2OCC12C,0.2171
CC(C)Cc1cocn1,0.245
CCC12CC1(O)C(=O)O2,0.2617
FC(F)(F)C1CN=CO1,0.2758
N#CC1C=CC2CC12,0.2476
CC12CCC3C(OC1)C23,0.3145
NC(N)=[NH+]CC([O-])=O,0.2648
N=C1OCC2CN2C1=N,0.2038
CC1CN2CC12CCO,0.3081
CC1(CN(C1)C)OC=O,0.2339
CC1C2C3OC3CC12O,0.3199
OC1CC(=O)C2(CN2)C1,0.2177
OCC(OC=O)C=O,0.2264
CC1OC(C)=NC1CO,0.262
CC(C)C1CN1CCO,0.3116
COC1CC=CC2NC12,0.2407
CC12CN3C1C2C3CO,0.3067
CN1CC1C1C2CC1C2,0.3103
N#CC12COCC1O2,0.2739
CN1C2C(O)C2C1=O,0.2467
C1C=CCc2c1n[nH]n2,0.2388
CCC(CO)OCC#N,0.2716
CN1CC(C)(O)C1=O,0.2686
OCC1CC=C(C1)C#N,0.2207
c1coc(=O)n1C(=O)N,0.2338
CC(C)C1=CC(C)CC1,0.2579
COC12CC1(CC2)C#C,0.2698
CC1(C#N)C(N)C1C#N,0.2461
ON=C1CNC1CC#N,0.2312
CC(=O)OCCC#C,0.2827
CC1CN1C(C=O)C#N,0.2149
NC(=O)NC1CC1C#C,0.272
CC1NC(=O)C2(O)CC12,0.2639
ON=C1CC(C=O)C1O,0.2189
CC(C(C)=O)C(=O)CO,0.2264
CC12CC1COC2,0.3401
CCCOCC1CC1C,0.3363
CCC12C3CC1CC23C,0.3181
CC1(C#N)C2C3CC3N12,0.2506
OC1(CC1)C1CC=CC1,0.2654
CN1C2COC2C1C#C,0.2529
CC1C2C3CC3CC12O,0.3158
OCC12CC(O)(C1)C=C2,0.2394
CNC12CC1NCC2=O,0.1836
OCC1(O)C2OC=NC12,0.2377
c1coc2c1nco2,0.2197
CC1CCC(C=O)C1O,0.2172
CN=C1OC=CNC1=N,0.1803
CC(C)C1(O)C2COC12,0.2886
NC(=O)CC(=O)C1CO1,0.1977
CNc1c([nH]nc1O)N,0.2441
CCC(C#C)N1CC1C,0.2756
OC1CC2C3C4C3C1C24,0.3124
CC(O)CC1CCC1O,0.3244
CC(C)C#CC(O)C#N,0.267
C#CCCOCCC=O,0.2282
N#CCC12CC(C1)O2,0.2801
CC1CCNC(C)C1=O,0.2101
CCNC(=O)C,0.2783
CNc1conc1C=O,0.1456
CC(O)(CCCO)C#N,0.2927
CC(C)(c1ncon1)O,0.2448
CCC(CC(C)=O)OC,0.2314
CC1(O)CC(O)C(=O)C1,0.2216
CC1CC11OC(=N)C=C1,0.194
Cn1ncc(=O)c(n1)O,0.176
C#CC1(CC1)OC(=O)N,0.2799
CC12C(O)C1CN1CC21,0.2805
OC1COC11CC1,0.2893
c1nc(c(o1)CCO)N,0.2095
CC1OC(C=C1)C1CO1,0.2473
Cn1c(cc(c1O)O)N,0.2238
N#CC12NC1CC=C2,0.2405
CC1OC11C(C)CC1=O,0.2016
CCC1CCCC1CC,0.3725
O=C1OC2CNCC1O2,0.2507
NC1=COC(O)=CC1=N,0.1885
CCC12CC3CC1N2C3,0.3198
OCC1C2CC1(N2)C#N,0.266
O=CC12CC1OC=N2,0.2192
CC12CC(C)(O1)C2C#N,0.2752
CC1CC(O)CC1(C)C,0.3301
C#CC1C2C=CCCN12,0.2254
CC1COC1C#N,0.2783
CC(C)CC1CC1O,0.3314
C1C(CO1)CC#CC#N,0.219
C1CC23CC4C(C2)N4C13,0.3119
C#CCc1c[nH]nc1,0.26
CCC1(C)CC2OC2C1,0.3384
c1cnc([nH]1)C#N,0.2111
OCC1CC2NC2CO1,0.3126
OC(CC#N)CC1CO1,0.3098
N=C1OC2CCC3C2C13,0.2769
CC12OC1CC2C#N,0.294
CC1(O)CCCC1=NO,0.2506
C#CCn1cnnn1,0.265
CC1CCC(C)C1C=O,0.2219
CC1C(O)C11C2CC1C2,0.3059
CC(C)OC1CC1C#C,0.2775
CC1(CC1C[NH3+])C([O-])=O,0.1052
CC1(O)C2C(O)C1C2=O,0.242
CCC1CC(C)C1(C)C,0.3484
CN1CC(=O)C2CCC12,0.1945
C(=O)c1[nH]c(c(n1)N)O,0.1677
CCc1c[nH]c(n1)O,0.255
C1OC2C1CC1OCC21,0.3087
CCCCNC(=O)C,0.2786
CCC1(CO)COC1C,0.3058
COC1CC1C(C)C#C,0.2956
CC#CC(C)N(C)C=O,0.27
OCC1CCN2CC2C1,0.2891
C1CN1C(=O)CC(=O)N,0.2317
CC(=O)C12NC1CC2=O,0.2116
CC12CC(O)(C1)C21CC1,0.3308
CC#CCC#CCCO,0.2883
C1C2C3C4C5C(C5N34)N12,0.2694
COCCc1ncco1,0.2453
N=C1N=CON=C1C#C,0.1836
C(=N)Nc1nc(no1)N,0.2101
OC1CC2OC12,0.3294
N#CC1NC2C3CC1C23,0.2608
C1CC2(C1)CCCOC2,0.3231
NC1=NOC(=N)C=C1,0.1561
CN1C2CC(NC=O)C12,0.2647
CN=C1NC(=N)OC=C1,0.198
CC1C2CC2C1(C)C=O,0.2277
CC(C)C#CC(O)C#C,0.2659
CC(C)N=C(N)NC=O,0.2169
CC1OC2C=CC(O)C12,0.2434
N#CC1N=CN2CC12,0.244
OCC1C[NH2+]C1C([O-])=O,0.263
C#CC1CC2CC1CO2,0.2896
CC1NC1C#CC#N,0.2246
COC12CC3C4C1N4C23,0.2956
C1CC1N(C=O)C2CC2,0.2546
COC1(C)CC2CN2C1,0.2973
CC(=NO)C1CC(=O)N1,0.2443
CN=C1OC(C)C2CC12,0.2686
N=COC1C2CC(=O)C12,0.2296
COC(=O)CNC(=O)N,0.2561
C#CC1CC2COC1C2,0.2912
CC#CC(CO)CCO,0.3039
CCCC1COC(=N)C1,0.2868
CCC#CC(O)C(N)=O,0.2597
CC1OC11CC(C)C1,0.3307
CC12COC1C1CN21,0.282
CCC1CN1CC(C)O,0.319
CC1C2C3C(N12)C3(C)O,0.2974
CC1(CC2(C)CO2)CC1,0.3349
CC(N)(C#N)C1(O)CC1,0.2897
OC1CN2C1=COC2=N,0.1995
CC1CC(C)=CC1C#N,0.2571
CC(CO)OCC#N,0.2777
Cc1ccnc(c1)F,0.2301
COC1OC(C)C=C1C,0.2602
OCCC1OC11COC1,0.322
c1cn(c(n1)O)CCO,0.2506
C1CC2CCC1COC2,0.3107
C#CC(NCC#N)C#N,0.2593
OC1C2CC3CC2(O)C13,0.318
CC1OC11CNC1=O,0.2597
COC1C=CC2C(O)C12,0.2276
O=C1CC2C(CC#C)C12,0.2287
OCC1OC1COC=N,0.283
CCN=CNC(=O)N,0.25
COCCN=C(C#N)N,0.2082
OC1C2CC1C(=O)C=C2,0.1874
CC1=NC=COC1=N,0.1668
COC1(CC1[NH3+])C([O-])=O,0.1683
CCc1ccc([nH]1)N,0.2315
COC1CC1C(C)C#N,0.2946
CC1CC2=NOC=C2O1,0.2169
NC(=O)C(C#N)C1CN1,0.2598
CC1=CC2NC3C1C23O,0.2268
COc1c[nH]c(n1)O,0.2379
CC1C2CCC1C=C2,0.2579
CCOC1(CC1N)C#N,0.258
CC(=O)C1OC1CO,0.223
O=CC1CN2CC2CN1,0.1881
O=C1C2C=CC1C1NC21,0.2373
COC1CC1C#CC#N,0.2154
CC(C)C12COC1C2C,0.2991
CC12CC1(O)C(C2)C#N,0.2919
CC12CCC(O1)C2C=O,0.2147
O=C1C2CC11CCC1O2,0.2099
N#CC1CC11CC2OC12,0.2937
C#CCOC(=N)NC=O,0.2461
CC1CC(C)C1CC=O,0.2283
CC(N)C1(NC1C)C#N,0.2627
COC1=NC(C)(C)CN1,0.2767
N#CC12CC(CC=C1)O2,0.233
C1CC1C12CC1OCC2,0.3101
N#CCCC1C2CCN12,0.2747
CC12C3CC1C1(CO1)C23,0.3377
CC(O)COC1CC1C,0.3157
CCCC#CCCCO,0.3028
CCOCCC=O,0.2284
COCCN(C=N)C=O,0.2343
CC#CC1C2NC(=O)C12,0.2393
COc1ccn[nH]c1=O,0.1802
Cc1c(c(co1)NC)N,0.2227
CC12OCC1=CCC2O,0.2421
OC1CC11OC2COC12,0.2873
c1(c(nc(=O)on1)F)N,0.1653
CC1OC11C2C3OC2C13,0.3156
CC(C)C(O)CC1CO1,0.323
CC1OCC2COC12C,0.3197
CC1C(O)C1C#CC#C,0.2141
CCCC1CC1C#N,0.3164
C1CC2OC2CC=C1,0.2667
CC1(CC1)C1CC1CO,0.3257
CC1C(C[NH3+])C1C([O-])=O,0.2687
N=COC1C=CC2NC12,0.2324
CC1C=CCC1O,0.2638
CC(C)COC=NC,0.2731
CC12C3CC(N13)C21CN1,0.2951
CC1OC11CCC1C#N,0.2956
C1CC1CNC(=O)C=O,0.1745
CC1COCCC1(C)C,0.3152
CC12CCC11CC2OC1,0.2957
CC(C)c1ccon1,0.255
C#CCOC12CC1OC2,0.2635
OCC12CC1OC(=N)N2,0.2778
CCCCC(O)C(C)=O,0.2383
COCC(=O)C(O)CO,0.2138
OCC1=CC2CC3C1N23,0.22
CC(=O)C1CC2CC2C1,0.2307
OCC12CCC3C1CN23,0.3108
CCOC(=N)OCC#N,0.268
CCC1C2CCCCC12,0.3311
CCN1C(=CCC1=O)C,0.209
CC1OC1(C)C1CN1,0.3315
N#CC1CCC2OCC12,0.2924
C1CC(=NO)CCC=C1,0.2468
CC1(C(=O)OC1(C)C)C,0.2796
C1C2OC3C4OC4C2C13,0.3268
C1COCOCCC1O,0.329
CCC(=O)C1(CC1)C#N,0.2346
O=CC12CC(C1)(O2)C#N,0.2162
Cc1c(nno1)CC=O,0.2135
C1CC11OC2CCC=C12,0.2274
C#Cc1ccc(cc1)N,0.1874
NC1=NC(=N)N=CC=N1,0.1444
OC1C2OC2COC1=N,0.2812
O=C1NCC2(CN2)CO1,0.3062
O=CC1C2OC1C1OC21,0.2146
CC1(O)CCC=CC1,0.2688
CC(O)C#CCCC#N,0.2863
c1c[nH]nc1CCC#N,0.2692
CC12CCCC1COC2,0.3213
Cc1cccc(c1C)C,0.2348
Cc1c(c([nH]n1)OC)N,0.2501
C#CC1CCC2CC2C1,0.3122
C1C=C(C(=O)N1)CO,0.2259
CCN(C)c1c[nH]cn1,0.2084
FC1=CNC(=N)C(F)=N1,0.149
OC12CCC3OC1C23,0.2863
N=C1OC2CCCC2O1,0.3065
CC1COC2CC2C1=O,0.2177
O=C1OCC23CC(O2)C13,0.2599
CN1C2C3(C)CC1C23C,0.2891
CN1C(CC1C#N)C#C,0.2442
C1OCC1C12CC(C1)C2,0.3237
C1CC2(C1)CCC23CC3,0.345
O=CC1NC2(CC12)C#C,0.1934
N=C1NC2(CNC12)C#N,0.242
OC1C(O)C11CC=CC1,0.2588
O=CC12CN1CC1CC21,0.1983
N#CC1CC11CN=CO1,0.2591
C1OCC23N=COC2C13,0.2497
O=CC1OC1C#N,0.2161
COC(=O)CC(C)CO,0.2834
Cc1cc(co1)C2CC2,0.2339
CN=C1C2(COC2)CO1,0.2721
COCC1CC(=O)N1,0.2865
COC12C3OC(C13)C2O,0.2919
CC1C2CC11OCC1O2,0.2926
CNC(=O)C1(CN1)C=O,0.2148
C1NC1C12NC1C1NC21,0.2618
CC1C2C=CC1(C)C=C2,0.2156
CN1C=NC(=N)N=N1,0.1766
C1OC2C1C1OC=NC21,0.2577
c1c(c(c[nH]1)C#N)CO,0.2242
C1CC12CN(C2=O)C=O,0.2182
O=CC1CC1CC#N,0.2266
CCCC1CC(C)C1C,0.3534
CC1OCOC1CC=O,0.2268
CC1(O)CCC11CC1,0.3232
CC(C)CC=O,0.2284
CN1C2CC(C#N)C12,0.2733
CC1CC(C)C1(C)O,0.3193
CC(CO)(C#N)N1CC1,0.2774
COC1CC1(C=O)C=O,0.2146
CCc1ncc(o1)C#C,0.1985
CC(O)CC(C)C#N,0.317
N#CC#CC1=NCCN1,0.1647
CCCCC(O)C#N,0.3131
CC12CC3OCC1C23O,0.2974
CC1(CC=O)COC=N1,0.222
CCC12CC1(C)C1OC21,0.3283
CN1CC(O)(C#C)C1=N,0.2442
COC(C)C(C)(O)C#N,0.2882
CC1CNC2C1OC2=N,0.2541
CCC12CC1CC1OC21,0.3313
C1COc2c1oc(n2)N,0.2095
CCC1C2C(C)C1C2C,0.3801
CCc1c([nH]c(n1)C)O,0.2341
CC1C(C#N)C1(N)C#C,0.2443
CC#CC(C)(C)CCO,0.3055
C1OC2C=CC3CC12O3,0.2271
O=C1NC2CC=CC2N1,0.2509
COC1CC2OC1C2C,0.3319
CC1CC1C(=O)C1CO1,0.2181
c1c(cn(n1)CC#N)O,0.2244
C#CC1(CN1)C#CC#N,0.2131
OC1CCC11C2CC1C2,0.3198
CC1C2C3OCC3CN12,0.282
OC1CC(O)C1C#N,0.2882
CC1CCC11CCO1,0.3121
N=C1OC(CC#C)C=C1,0.2124
C(=Nc1nc(no1)O)N,0.1897
c1cn(cc1O)CC#N,0.2114
OC12C3C4CC1CC2N34,0.2792
CC12OC3(CNC13)C=C2,0.2049
CC(C1CO1)N1CC1C,0.3101
CCC(C)(C)OC(=O)N,0.3168
Cc1cc(c[nH]1)CC#C,0.2407
OCC1CC2(O)CC12,0.3252
NC1=NCC(=N)N1C=O,0.1955
CC12OC1CC2(O)C#C,0.2689
CCC(=O)c1ccc[nH]1,0.1878
CC1=CC(=O)C=CNC1,0.1726
CC1C=CC(O)C2OC12,0.2637
O=C1C2C3C2C2C3CN12,0.2386
CC1(CC1)C1CN=CO1,0.2713
Cc1c[nH]ccc1=NO,0.1736
CC(C(=O)N)(C(=O)N)N,0.2486
CC12CC(C1)CC=C2,0.254
OCC1NC2C1NC2=O,0.2502
CC1OC(C)(CO)C1=O,0.2157
CN1C2C(O)C2C1C#N,0.2366
C#CC1OC23CN(C2)C13,0.2379
CC(CO)C1CC1C,0.3268
CNC1=NCC(O)C1=O,0.1709
C1C2OCCN3CC3C12,0.2929
c1c(cn[nH]1)C2(CC2)O,0.2459
CCC1OCC1(C)C#C,0.2916
CN=C1OC(C)C1(C)O,0.275
COC(=O)C1OCC1=O,0.2223
OC1C2N3CC2(C=O)C13,0.1969
Cc1cnnn1C(=O)N,0.2228
OCCCCC1CC1O,0.334
COCC(=O)NC1CC1,0.2664
CCOC(=O)C(=N)N,0.2124
COC1COC(C)OC1,0.3197
NC12CC3C1NC23C#N,0.0719
N#CC1NC11C2CC1C2,0.2818
CC1C=CC2(CO)CC12,0.2479
CC1OC2COC1C2C,0.328
CC1(O)CC2OCC12O,0.2949
NC(=O)CC1COCO1,0.2721
N=C1NC2COC2C1=O,0.1695
OC12CC1CC1CC1C2,0.3271
OCC1(CCC1=O)C#N,0.216
CN1C2C3C(O)C3(C)C12,0.3072
O=CNC1CC1C1CC1,0.2744
NC1=COC(=C1)C1CO1,0.2049
c1c2c(on1)NC=NC2,0.1978
C1C2CC=CC3NC3C12,0.2323
O=CC1COC(=O)CO1,0.2147
OC12CC1N(C2)C=O,0.2559
CN1C2C(=O)CC12C,0.2098
NC(=O)NC1C2CC1C2,0.2951
OC1(C=O)C2CCOC12,0.196
OCC12CC1C1CCC21,0.3045
c1c(oc(=O)o1)C#N,0.207
CC1CCC(O)CC1C,0.3309
CC1=CC2N=CN3C2C13,0.23
CC1(O)CC2(C)COC12,0.311
CC#CC1(C)CC(O)C1,0.2965
CC1OCC2OC12C=O,0.2119
CC1(O)CC1(O)CC=O,0.2135
OC1CC(C#N)C11CO1,0.2898
c1c(ocn1)NC=O,0.2419
OC(C=O)C1CCC1=O,0.2121
CCCC1(C)OCC=C1,0.2487
CC12OC(=O)C3C1CC23,0.2658
Cn1nc(c(n1)O)C=O,0.1954
C1CC12CNC=C2C=O,0.1696
CC1C2CN2C1C(N)=O,0.2627
CC(C#N)C1C2CC1C2,0.344
NC(C#C)C1=NOC=C1,0.2325
Cc1c2c(ocn2)on1,0.2263
c1c[nH]cc1NC2CC2,0.2252
N#CC12CC1C1CC1C2,0.2902
O=C1CCC11CC2CC12,0.2048
CC12OC3C1OC(=O)C23,0.2408
C(C1CCCO1)N1CC1,0.3119
COC1CC(N)=CC1=O,0.1902
CCC12CC1CCC2C,0.3331
CCC12COC1CCC2,0.3171
O=C1OC2CCC1CC2,0.2753
CNc1cc2n(n1)CC2,0.2211
CNC(C=O)C#CCO,0.1939
O=C1CC(C#N)C1C#N,0.2203
OC(CCC1CC1)C=O,0.232
CC(C=O)C12CC1OC2,0.2055
CNc1c([nH]cn1)N,0.2219
O=CC12CN3C1C2C3=O,0.1997
OC(CC1CC1)C1CO1,0.335
OC1C2CC1(CC#N)O2,0.2863
OCC(O)C1CC1C#C,0.2887
c1c(nnc(n1)C=O)F,0.1624
c1cn(c(n1)O)CC#N,0.2266
CC(O)C1=NN(C)N=C1,0.2455
C1CN(C=N1)C=O,0.2221
CC(CO)C1COC=N1,0.268
OCC1CCC2(CC2)O1,0.3119
N=C1NC(=O)CC1C=O,0.2225
CC12CN3C1C3(C2)C#C,0.2686
COC1OCCNC1=O,0.262
C(C=O)c1nc(no1)N,0.2032
CC1OC(CO)OC1=O,0.2688
CC1(CC1)c2ncon2,0.2374
CC1(CC1)NC(=O)OC,0.3082
OC1CCC2(O)CC12,0.3263
CC1=NC(=N)C(F)=CN1,0.1967
C(C(=O)CO)C(F)(F)F,0.2309
CC#CC1CC1OC=N,0.2554
C1CC1OC1C2CCC12,0.3206
CC(O)(C#N)C(O)C#C,0.2792
C(CC(F)(F)F)C#N,0.3585
N#CC1NCC2OC12,0.2732
CC1C2CC(O)(C2)C1O,0.3076
CC1(O)CC2CC2(O)C1,0.31
CC1OCC11CC2OC12,0.3218
CC1C2C=CC3C2C13O,0.2247
CCc1c[nH]nc1C#C,0.2245
CC(=O)COCC(=O)C,0.2119
COC(C(C)O)C1CN1,0.3211
CCC1C2CC2C11CO1,0.3286
O=CN1C2CCC12C#N,0.2354
CC(C)C#N,0.3545
OC1CC23CC(OC2)C13,0.2829
O=CN1CCC2CC1C2,0.2666
CC12NC1C=CC2O,0.2354
c1c[nH]c2c1cn[nH]2,0.2246
O=CCC1CN1CC#N,0.217
NC(=O)C1NC1CO,0.2616
CCCCC(C)CC=O,0.2279
CC12CC1C=C(C2)C#N,0.206
C#CC12OC1CC2C#N,0.2633
O=C1CN2CC2C11CC1,0.2053
CCC(=O)c1[nH]ccn1,0.1908
C1CC11C2CC1OCO2,0.3252
C(CC#N)CC#N,0.3341
COCC1=NC(C)CO1,0.2616
OCC1CN2CC12C#N,0.2567
ON=C1CC2(NC12)C=O,0.2033
CC1CN(C)C(=O)C1C,0.2672
C1CC(C1)(CC=O)O,0.2228
CC(C)N=COCC#C,0.2667
CC12CC(CO1)C(=O)C2,0.2234
COC(C)C1(C)CN1,0.3126
N#CC1COC2CC2C1,0.2777
N#CC1CC2=CC=NN12,0.2464
COC1CC1,0.3395
CC1(CC1)CNC(=O)N,0.2986
CN1CC([NH3+])C1C([O-])=O,0.2467
CN=C1NC(=O)CCO1,0.2348
Cn1c(=O)nc(nn1)N,0.1751
Cc1c2c(n[nH]1)ocn2,0.2119
O=C1C2NC2CC2NC12,0.2066
OC12CCC1(OC2)C=O,0.2069
O=C1OC2C3NC3C12,0.2568
Cc1ccc([nH]c1=O)F,0.183
C#CCC(=O)NCCO,0.2753
C1C2OCC=C3COC123,0.2149
CC1(C)OC1CC#C,0.3083
NC1=NCC2=C1ON=N2,0.1734
C1OCC1C1CC=CC1,0.2642
OC1CC2OC1C21CO1,0.3095
CC1C=C(CN1C)C#N,0.1775
OC12CC(C1)NC(=O)C2,0.2679
CC(=N)OC12CC1CC2,0.2778
CCOC(=O)N(C)C=N,0.2498
CC12CC(C)(OC1)C2O,0.3195
CCC(O)C1CC1C,0.3305
CC1(C)C2OC11CNC21,0.2622
CC12CC1C(=O)NC2=N,0.2388
OC1C2CC=CC=CC12,0.1859
CCCC(C)CC#CC,0.3014
CC(OC=O)C#CCO,0.2693
CC(C#N)C1COC=N1,0.2675
N=C1COCCN1C=O,0.2174
c1c([nH]cn1)C#CC=O,0.1635
OCC1(O)C2NC1C=C2,0.2206
CNC1(C)C(O)C1C#N,0.2484
CC1N2CC(N)C12C#N,0.2435
CN1N=CC(O)=CC1=N,0.1582
CCN1C=NC(=N)C=N1,0.1789
OCC12COC1CC=C2,0.2612
O=CN1C2CCC(=O)C12,0.2122
CN(CCO)C(=O)C#N,0.2012
FC(F)(F)C1CC2CN12,0.3193
CC12CN1CC1(O)CC21,0.2979
CC#CC1OCCC1O,0.2818
CC1(CN1)C1=NON=C1,0.2263
CCC1(CO1)C1NC1C,0.3158
CN=C1ON=C(O)C=C1,0.1572
OC12C3CC1C1OC3C21,0.2906
Cn1cnc(n1)C(=N)N,0.2129
C1CC1N=C2CN=CN2,0.2123
O=C1NC(C#N)C2CN12,0.2766
CNc1c[nH]nc1,0.2174
CC1CC=CC2CC1C2,0.2509
CC1C(O)CN1CC=O,0.2007
C1CC1C#CCC=O,0.2119
CC(=O)Cn1cnnc1,0.2064
CC1(CCC=CC1=O)C,0.1868
COC12CC3C1N3CC2,0.3177
N=C1COC(=O)C(=O)N1,0.2029
OC1CC(CCC=O)C1,0.228
CCCn1c(ccn1)O,0.2545
CCN=c1cconc1,0.1735
CCC1C2C(C)C2C1O,0.3135
OC1C2CC(NC12)C#N,0.2607
NC1COC1=O,0.2493
CC(=O)CN1CC2CC12,0.2091
CC1CCCC2(C)CC12,0.3329
c1c(c([nH]c1O)N)CO,0.2191
CCCCC1NC1C=O,0.2218
CCCC1(O)C(O)C1O,0.2748
CC1(C)OC(=O)CC1O,0.2767
C1CC2=CC3CC(C3)C12,0.2395
OC(C=O)C1CC(=O)N1,0.2067
C1CNC(=O)OCC1=O,0.2147
C1CN2C3C2C2OC3C12,0.2887
NCC1(OC1C#C)C#N,0.2395
CC1CCC2CC(C1)O2,0.3164
NC1(C#N)C2CC=CC12,0.2222
OC12C(NC1=O)C2C#C,0.2303
C1C2OC3=COC=C3C12,0.2269
C1CC1C2=CCOCC2,0.2539
C(c1c(c(n[nH]1)N)O)O,0.2249
c1cc(oc(=O)c1F)N,0.1641
CCOCc1cnc[nH]1,0.2484
OC(C#C)C1C2COC12,0.2699
CC12OC3C(NC13)C=C2,0.2242
COC=NCC(O)CO,0.2562
OCCC1C2OC1C=C2,0.2362
N=C1N=CON=C1C#N,0.1837
CC1C(=O)CC1(C)C,0.2217
COC12CC(C1)C1CC21,0.3325
CN(CCC1CO1)C=O,0.2726
CC1C(C#N)N1CC=O,0.2237
OC1(CC1C#C)C#N,0.265
CC1CC2(CC2)C1C#C,0.2966
C1OC2=NCC3OC3C12,0.2671
N#CC1OC2(CC12)C#N,0.2438
c1(c(n[nH]c(=O)n1)O)N,0.1772
CC1C(O)CC11CN1,0.306
C1CN1C(=O)OCCO,0.2883
CC(C(N)C#N)C1CN1,0.2793
N#CC12OC3C1OC23,0.2515
CCC(O)C1(O)COC1,0.3043
C#CC12OC3C4C(C14)C23,0.2643
CC1COCC(C1)C#N,0.3002
CC(C)CC(C)CC=O,0.2279
c1nc(c(o1)NC=O)N,0.2036
CCC1(CCCCC1)O,0.3223
C1COc2c1nc(o2)N,0.2179
C1OC11CC=CC11CO1,0.2512
O=C1OCC2NC=NC12,0.2384
CC#Cc1ncc(o1)C,0.1937
CC(C)C(C=O)(C=O)O,0.1891
c1[nH]nc(n1)O,0.2475
O=C1C=CC2CN=CN12,0.1938
O=CCC12CN(C1)C2,0.2072
CC(=O)C12CC(=O)C1N2,0.2026
CC12OC1C(=O)C1CC21,0.2034
CC12C3C4C3C1(C#N)N24,0.2344
CC(C)(C[NH3+])CC([O-])=O,0.1053
C#CC1CC2(CC12)C#C,0.2621
CN(CC(F)(F)F)C=O,0.2746
OC1C=CC2CN2C1=N,0.2196
CC(C)C#CC1(C)CN1,0.2715
CC#CC(C=O)C1CC1,0.216
Cc1ncc(cn1)C=O,0.1806
OCC1C2OCC12O,0.2876
C#CC1CC(N1)C#N,0.2571
CC1C2CCC1C2(C)C,0.3566
C1CCOC=NC1,0.2609
ON=C1C=CC(O)C1=O,0.1724
CC(C)N(C)C(=O)C=O,0.1769
CC(CC(N)=O)C1CO1,0.2786
N=C1C(OC=O)C2CN12,0.2452
CC1C(CO)C1CO,0.3164
CC(C)(C)C(C)(O)C=O,0.2225
CC(=O)C1(C)NC1C=O,0.2116
COC1OC2C3CC2C13,0.3467
CC1NC(=O)C2C1N2C,0.2517
CCC(=O)NC=NCC,0.236
OCC1OC11C2CC1O2,0.3159
CC1(O)COCC1=O,0.2141
N=C1CC(CO1)N1CC1,0.281
C1C2CC3C4OC4C2C13,0.3456
C#Cc1c2n(cn1)CC2,0.2208
CCn1ccc(c1)C#C,0.2187
O=C1CC2C3OCC1C23,0.2169
CC(C)C#CCOC=N,0.2786
NC1C2OC2C=C1C#N,0.1895
CC1C(CC#C)C1C=O,0.2251
CC1(C)CC2CCC2=C1,0.2455
CC(C)(C#CC#N)OC,0.23
C1CC(O1)C1=CC=NN1,0.2508
CC1CC2C(CN12)C#N,0.2483
CC1CC2C3OC1C23O,0.2905
N#CC1OCCC11CO1,0.2881
CCNC(C#N)C#CC,0.2615
CCC1(OCC=C1)C=O,0.1987
CCC1CCC=C1C#N,0.2194
CC1C2NC1(C#C)C2O,0.2641
COCC1C2CC2C1C,0.3333
CC1(CC1)C1(C)CO1,0.3526
CC1CC11C2OC1C2=O,0.2459
CC1C2N3C2(C)CC13C,0.3184
COC1C2C1C1OCC21,0.3024
N=C1CC2CCCC2O1,0.284
C1CC(=CC(=O)C1)C=O,0.1535
CC(=O)C1(C)NC1(C)C,0.2187
CCC12CC1C(=O)CO2,0.2157
O=C1NCCC1C#C,0.2592
CC(O)C1(CCC1)C#N,0.3044
OCCC(CC=O)C=O,0.2178
OC(C#N)C(=O)C#C,0.2094
CC1C2C3C=C(C)C1C23,0.2328
OC1CC2CC1OCC2,0.3016
CCOC(=N)OCC#C,0.281
CC1(CCO)CC2OC12,0.3275
C1OC23CC4CC12NC34,0.3008
CC1CC=CCOC1=O,0.246
C1CN(C1=O)CCCO,0.2792
C1C=Cc2c1[nH]nc2N,0.1925
CC1=CNC(=O)COC1,0.2084
c1cc([nH]c1)C=O,0.1863
O=C1C2OC3C4C3C1C24,0.196
OC(C=O)C1=CC=NN1,0.1918
COC12CCC1=CCC2,0.245
O=CC1CC2COC1O2,0.2305
c1c(non1)OC(=O)N,0.2405
CC1(O)C(O)CC1C#C,0.3008
c1cnc(nc1)CO,0.2046
O1N=CC=C2N=CN=C12,0.163
CC(C#N)N1N=CN=N1,0.2581
CC1OC(C=O)C1CO,0.2124
CC1C2CN2C(=N)C1=O,0.1659
OC1C(NC1=O)C1CC1,0.2667
CCC(C#C)C(=O)C#N,0.1935
OCCC12CC1C(=O)C2,0.2327
C1CC11OC2C=CCC12,0.2349
c1c2c(c([nH]1)N)OCC2,0.229
C(C#N)C(F)(F)F,0.3547
COc1ccncc1,0.2376
[NH3+]C1CC(CC([O-])=O)C1,0.2777
CC(O)C1(NC1C)C=O,0.2144
CC1NC1C(O)C1CC1,0.312
COCC1=CCC(=O)C1,0.225
N=C1OC(=O)OCC=C1,0.214
CC(=O)C12CC1CCC2,0.2305
CC(=O)C12CC(C1)C2=O,0.2159
CCC1OC(C)C2OC12,0.3428
CC1COC1C1(C)CO1,0.3149
CC(=NO)C1CC1C#C,0.2395
CC1NC1C1(CO1)C=O,0.2162
OCC1NC11CCC=C1,0.2378
CC1CC(=O)CN1C=O,0.2161
O=C1OCC=C1C1CN1,0.1944
CN=c1cnonc1F,0.1807
C1CC1O,0.3166
CC1(CCC11CN1)C#C,0.2792
CC(=O)C1CC(C1)C#C,0.2305
CCn1c(coc1=O)C,0.2374
N#CCOC1=NCCC1,0.2739
c1cc-2nccc2oc1,0.1494
CC1=CCC(=O)C1(C)O,0.2203
c1(c(non1)N)C(=N)N,0.1856
CCc1cnc(n1C)O,0.2415
CC1OC(C)(C)OC1=O,0.274
N#CC12CNC1C1OC21,0.2465
CC1(CO1)C1=COC=N1,0.2404
C1CC12CNC2=O,0.2815
CC1=CCCC2OC12C,0.2467
CC#CC1C(C)C1C#C,0.2629
O=CC(C1CN1)N1CC1,0.2156
CC(=O)NC1CC1(C)C,0.2683
CC(=O)C1(CCC1)C#N,0.2287
COC1CC11CC(=O)N1,0.264
CCC(CO)C(O)C#C,0.2807
C1OC2C3C=CC1C23,0.229
CCC12CCC3C1CC23,0.3664
OC12CC3(CC1)OCC23,0.2908
CNc1ncnc(n1)O,0.2188
OC1C2C3CN4C1C2C34,0.2657
CC(C)C1(C)NC1C#C,0.2772
CN1CC2OC3C2CC13,0.2833
O=CCC1COCCO1,0.2174
CC12CC1(CC=C2)C#N,0.2494
C1CN(C(=C1)C=O)C=O,0.155
CCC1CC(C)CC1C,0.3701
CN1C2(C)CC1(C)C2O,0.2635
O=CC12CC1N1CCC21,0.2044
CCC1CC(O)CC1O,0.3084
CC(O)CC(C)C(C)O,0.3255
O=C1C=C(C#C)C2CC12,0.1684
OC12CCC=C1C1CC21,0.2267
CN1CC11CCCC1=O,0.2045
COCc1[nH]cc(n1)O,0.2285
O=CC12C3CN4C(C13)C24,0.2107
CNc1ccc([nH]1)C#N,0.1867
COCC1CC2(O)CC12,0.3302
CC1C(=O)C=CC1=O,0.1542
C1C2COC3CCC3C12,0.3154
O=CNC12CN(C1)CC2,0.2497
NC(=O)COC=N,0.2552
CC12COC1CC(O)C2,0.3237
OC1C=CC2OCCC12,0.2525
[O-]C(=O)C1CC2[NH2+]CC12,0.2642
N=C1OC23CN4C2C1C34,0.2571
c1c(onn1)C#CCO,0.1952
CC1C2CC2C2OCC12,0.3137
C1C2OC2C11CCCO1,0.314
OCC12CC1CC2,0.3263
OCC(OCC#C)C=O,0.2181
CC1CN1C1CCC1,0.3027
CC12CC1N(C2)C(N)=O,0.2809
CC(O)CC1=CC=CN1,0.2386
C1CC2C1N1N=CC=C21,0.2578
CC(O)C1=CC=CC=C1,0.2399
COC(=O)C#CC(C)O,0.2353
CN1CC2=CCC(=O)C12,0.1987
[NH3+]CCOC1=CN=N[N-]1,0.2478
C#CC1C2C3CC1OC23,0.2821
N=C1OC2CCC12C#N,0.2768
CC1OC(=O)N2CCC12,0.2905
C1C(=NO)C(=O)C=CN1,0.1669
c1nc(nc(n1)F)N,0.228
CCC(C(C)C)C1CO1,0.3384
CCN1C2COCC12C,0.3053
N=C1ON=C(O1)C1CN1,0.2324
O=C1C2NC2C2COC12,0.1887
CC1CC2CC2C(C)C1,0.3374
C1C2C1C1OC3CC1C23,0.3209
Cc1c(c(n[nH]1)CO)O,0.2224
C1CC1C12NC1C1NC21,0.2648
CC1C(O)C2OCCC12,0.3127
OCCC1(O)CCC=C1,0.2588
OC12C3C=CC1C(=O)C23,0.2054
CC1CCOC(C)C=C1,0.2625
CC12COCC(O1)C=C2,0.2381
CC1CC2(C1)OC2CO,0.3232
c1c(cn[nH]1)CN2CC2,0.2407
OC1CC2CC2OC1=N,0.2806
CC12OC1C(C#C)C2O,0.2852
CC#CC(C)(C)C1CO1,0.3026
CC1NC1(C#C)C(N)=O,0.258
CC1=NCC(=O)C2CN12,0.1957
NC1=C(N)C(=N)N=CO1,0.171
CC12CC1C(CC2)C#C,0.3085
C#CCn1cc(nc1)O,0.2195
C1C2OCCC3OCC123,0.3179
CC1=CC(=O)CCCN1,0.1888
CC1(CC1)C(=N)NC=O,0.2275
CCC1OC(=N)C1NC,0.2503
CC1(CO1)C1(CN1)C#N,0.2906
CC(=O)C1(CN1)C#N,0.2327
CC1=NC(=N)NC(F)=C1,0.1733
CC(=O)CCCOC=N,0.2354
c1c(c(c([nH]1)CO)N)N,0.2157
CC(=O)c1c(cn[nH]1)O,0.171
CC1(COCC1O)C#C,0.2939
CC1C2OC3CC2OC13,0.3215
CC12C3C4C1C1C2C3N41,0.2537
CC(C1CO1)C(=O)C#N,0.19
N#CC1C2C3CN=C1N23,0.1898
CCN(CCO)CC#N,0.2524
C1OC2C1C1C3OC2C13,0.2913
CNc1ccccc1F,0.2036
O=C1NCC(C#C)C1=O,0.1696
c1nc(c(o1)OC=O)O,0.2144
OCC1(O)CCOC1,0.3032
CCC(=O)C1CN1C,0.2044
ON=C1CC(=O)C2CC12,0.2174
C1OC2C3OCOC1C23,0.2935
CC(O)CC1=NOC=N1,0.2515
OC1CC2CC(C#N)C12,0.2809
CC1C2C3COC3CN12,0.2909
C1CC1(COCC#N)O,0.2643
CCC12OC(=O)C1C2O,0.2614
Cc1nc(nc(n1)N)C,0.2255
OC(C=O)C12CC(C1)C2,0.2298
O=C1C2C3C4OC1C4N23,0.2034
Cc1cnn(c1CO)C,0.2405
CC(NC=O)C1(C)CO1,0.2808
NC(=O)C1(CC1)C1CO1,0.2706
OC1C2CC(O)C12O,0.2999
CC12CC1CC1CC2O1,0.3242
C#CC1CCC(=C1)C#N,0.2187
O=CC1(OC1C#C)C#N,0.2073
Cc1nc(on1)CO,0.2546
N=COC1CCOC1=O,0.2466
CCC1(C)C(C)N1C=O,0.2547
CN1C2C3CC3C12C,0.2795
CCC#CC(C)C(C)=O,0.2203
CCC(=O)N(C)C,0.27
[NH3+]C12CNC1C2C([O-])=O,0.2266
CC(O)C1=NNC(=O)N1,0.2328
CC(OC(N)=O)C(C)=O,0.23
Cc1nc(co1)C(=O)C,0.2036
CCC1C2OC1C2CC,0.3163
CN(C)c1nc(co1)N,0.2187
ON=C1CC(C1)N1CC1,0.2483
C1CC23CCC12C1OC31,0.29
CC1CC2(C)CC2C=C1,0.2472
CCOc1c(nn[nH]1)C,0.2417
C1C=CC2C=CCOC12,0.2472
COC1CC(OC)C1=O,0.185
CC1=CCOC=NC1,0.2331
COC(=O)C1CCC=C1,0.2482
O=C1CC2CC3COC123,0.2081
c1c(con1)CNC=O,0.2417
CCc1[nH]nc(n1)NC,0.2256
CC1OC2COC12C#N,0.2565
CCOC12CC1CC2=O,0.22
CC(C#N)C1=CNC=N1,0.2545
C1OC2CC34CC(O3)C124,0.2914
CCOCC1CC1(C)O,0.3241
OCC12C3C4C(C13)C24O,0.2768
CC#CCC1(CO)CO1,0.2937
CCN1C2C(C)C1C2O,0.2708
CCC1N=CNC1=O,0.2294
CCC12NC3C1OC23,0.2911
CCC1=CCNC(=O)N1,0.2239
OC1C2CCC1(O)CC2,0.31
CN1CCc2c1nc[nH]2,0.2023
N=C1OCC2C3CC3C12,0.274
CCC(=O)C(C)(O)C#C,0.2196
[NH3+][C-]1C=CC2=C1NN=N2,0.1394
OCC1OC=NC11CC1,0.2496
CC(CC#N)C1NC1C,0.2939
O=CC1CC(CC#N)N1,0.202
C1OC23C=CC4C(C24)C13,0.2289
c1c2c(on1)CCCC2,0.2365
CC1C2CC2(O)C2CN12,0.3015
CC12OC1C1(O)CCC21,0.3107
CC(C)(C)C(=O)COC,0.2289
CC1(C)CN2CC12C#C,0.2505
C#CC1(COC1)C2CC2,0.291
O=CC1CN(C=O)C1=O,0.2071
CCC1CC(=O)C2CN12,0.2175
CN1CC2(C)C1CC2=O,0.1975
NC1=NC2CC2C(=O)N1,0.2266
c1c(=O)[nH]nnc(=O)n1,0.1612
CC1(O)CC11CC(=O)O1,0.2796
N=COC(=O)CCC=O,0.2272
C1CC1OCC(=O)N,0.268
CCC#CC(=O)C(C)O,0.2039
CCOC(C)(CO)C=O,0.2135
CC#CC(C)(O)CC#N,0.2858
CCC12CN3CC1(O)C23,0.2824
O=C1CC2CCOC2C1,0.2233
OC12CC1C1(CN1)C=C2,0.2361
OCC12NC1C=CC2O,0.2368
CC(C)C1C=CCC1C,0.2599
OC1=CNC(=N)C=N1,0.1295
Cc1c[nH]c2c1ocn2,0.2013
CC1CC1(CC#N)C#C,0.2832
CC#CC1(C)CN1C=O,0.2458
CC(O)C1CC1(C)C=O,0.2275
CC12CC1(O)C1NC1C2,0.3088
NC1=NC(O)=NC(=N)N1,0.2056
CCCc1cocc1C,0.2413
CCNc1cnon1,0.2034
CCC1N=C(C)NC1=O,0.2324
CC1(CCOC=N1)C#N,0.2683
CC(CCC#C)C#N,0.2983
CN1C=CC(C#C)C1=O,0.2092
CC1(CN1)C(CO)C=O,0.2209
N=C1OC2C3CC3NC12,0.2472
CC1(C)CCC(O)C1,0.3321
C1C2CC3=C(COC3)C12,0.2385
CC1=CCCC1(C)CO,0.259
NC(=O)C1OCOC1=N,0.2464
C(C=O)OCC(=O)C#N,0.1758
CC12CCC(C1)OC2=O,0.2758
CC1C2C(C#N)C2C1O,0.2841
CC(C)C=O,0.2281
C1CN1C1CCCC=C1,0.2544
CC(C)C(=NO)COC,0.2513
CC1NC(C)C1(O)C#N,0.2539
CC(CO)(C=O)C#C,0.2233
CC(=O)C1CC(=O)N1,0.2217
C(C1CO1)N1C=CN=C1,0.2508
CC1OC2CC12C1CC1,0.3089
CC12OC3CC1CC2C3,0.3277
C1CC12CN=CO2,0.2598
c1c(nc([nH]1)OC=O)N,0.1821
Cc1ccc(cc1)C#N,0.2095
CC12OC1CCC2=NO,0.2454
c1cc(ncc1N)C=O,0.1747
CC1(CCC11CO1)C#N,0.3066
CC12CC3C1C2C3CO,0.3178
CC(=Nc1ncon1)N,0.2061
CC1C2C3CC(N13)C2=O,0.2081
CC1(C#N)C2NC2C1O,0.2921
c1c(onc1N)C2CC2,0.23
CC1(C)OC11CC(O)C1,0.3179
O=CC1COC=NC1,0.2143
O=CC1NC2CC12C=O,0.2014
CN1CC1C1(C)CCC1,0.296
O=C1NCC2CC2N1,0.2903
CC1C2OC3C2COC13,0.3136
C(=O)Nc1nc(no1)N,0.2055
C1C=CC2C3C4C3N1C24,0.226
N=C1NC2=CCOC2O1,0.2323
Cc1cc(c([nH]1)C)N,0.2213
CC1(COC(=O)O1)C#N,0.2993
CN=C1ON=CC(C)=N1,0.1561
c1c[nH]c2c1NCC2=O,0.1736
OC1COC2=C1NC=N2,0.2142
CNCC(=O)OC=NC,0.2118
O=CC12COCC1N2,0.2188
C1CC11CC2CC=CC12,0.2608
N=C1OC(CC1=O)C#N,0.189
CC1C2NC(C2O)C1=O,0.2084
CC1CC2CCC12CO,0.3262
OC1COC2C3NC3C12,0.295
OC1=CC(=N)NC(O)=N1,0.1926
CCC1NC1C(C)=O,0.2226
CC1OC2(C)CC2C1O,0.3061
CC1CN(C1)C(=O)N,0.2886
CC12OC3CC1C3C2=O,0.2092
NC(CO)C(C#C)C#N,0.2712
CN1CC1C1OC2CC12,0.2926
OC1C2C1C(C#N)C2O,0.289
c1n[nH]c(=O)n1C(=O)N,0.2166
CC1OC1CC(=O)CO,0.2367
C#CCOCCO,0.2895
CC1(O)CC2(CO2)C=C1,0.2469
CC1(C)N2CC2C11CC1,0.3076
CC(C)(C#C)C(=O)N,0.273
CC12CCC(CO1)C=C2,0.2493
CC1(O)CC2CN3C2C13,0.3
CC1(CO)C2NC1C2=O,0.2556
N=C1OCOC2COC12,0.256
O=CC1CCN2CC2C1,0.2057
CC1NC1C([NH3+])C([O-])=O,0.264
C(C#CC=O)NCC#N,0.1983
CN1CC2C1C2(O)C#C,0.2535
CCC1OCC(=O)O1,0.2764
N=C1OC(=O)NC1C#C,0.2703
CC1=CC2NC2CC1O,0.2389
Cc1c[nH]nc1C#N,0.2351
CC(=N)NC(=O)C(=O)N,0.1929
C1C2C3CC4(CN1C24)O3,0.2357
CC(=N)OC1(CO)CC1,0.274
C1C(=O)CC(=O)NC1=O,0.2164
CCc1ccoc1CO,0.2281
C1COC(=O)N1C(=N)N,0.2521
O=CCC12NC1C1OC21,0.1953
CC1CC2(C)OC(=N)C12,0.2819
N#CC1C2C3OC3CN12,0.2555
CC12CC3CC1C1C3C21,0.35
OCC12CN3C4C(C14)C23,0.2835
CC12CN1CC(=O)NC2,0.2601
CCC12CC1COC2=N,0.2795
CC(=O)NC(=N)CC#C,0.2446
CC(C=O)C(C#C)C#C,0.2239
O=C1CCC1CC#N,0.2212
OC12C3C1N1C=NC3C21,0.2249
C1CC(C1)(CN2CC2)O,0.3191
CCCNC(=O)N(C)C,0.2913
O=CC#CC1CC2OC12,0.2028
O=CC1OCCCC1=O,0.2069
N=C1C=COC(=N1)C#C,0.1761
CC1N(CC11CC1)C=O,0.2643
CC1(C)CCC2CN2C1,0.2859
CC1COCOC(=O)O1,0.3047
CC1COC(=N)NC1=O,0.2441
CC1C2CC1(O)C=CC2,0.2505
CC1=C2C=CC3C2N3C1,0.1712
CC1(CN1)C1OC1CO,0.3179
CN=C1CN(CCO1)C,0.2484
CN1C(CC#N)C1C#C,0.2543
O=CCC1OC1C1CN1,0.2223
CC1CNC(=O)C1=O,0.1713
CC(=O)Cc1conn1,0.2308
CC1(CNCC#N)CN1,0.2707
O=C1OC2C3NC2C3O1,0.2967
Cc1c[nH]c(nc1=O)F,0.2164
OC1(CC1)C(=O)C1CN1,0.2212
CCC1CCC=C1CC,0.2545
CC12CC1(C)N=C(N)O2,0.2696
CC1OC1CC1COC1,0.3221
CC1C2CC2CC1(C)O,0.3293
CC1(CCCC1)CC#C,0.3093
CC#CC1C(C)C2CN12,0.2635
N#CC1C2CC1C1NC21,0.2822
CCC(=O)COC=O,0.2313
c1c(c([nH]c1N)N)CO,0.219
c1cc(=O)[nH]cc1F,0.1673
O=C1CC2OC2C1C#C,0.2198
CC(C1CC1)C1CCC1,0.3509
CC12CC(C1)CN2C=O,0.2703
c1cc(=O)[nH]c(c1)F,0.183
CC1C2COC1(C)C2=O,0.2062
CCC(=O)CC1(CC1)O,0.2185
COC1CC1COC=N,0.28
O=C1NC2CNC(=O)C12,0.2559
CC1CCC2(CC2O)O1,0.3024
CNC(=O)C(=NO)C#C,0.1849
[NH3+]CC1OC=N[C-]1C#N,0.2621
OC12CC3OC1CCC23,0.3006
CCn1ccc(n1)C#N,0.2359
COC1(C#C)C2CC1N2,0.2698
c1c2c(no1)NCC2,0.2248
CCc1cc[nH]c1N,0.2462
CC12OC1C(=O)C21CN1,0.2019
CC1OC(C)C2(C)NC12,0.3061
OC12CC3C1N(C2)C3=O,0.224
OC1CC(O)C(=C1)C#N,0.2251
OCC1CN2CC(O)C12,0.2632
CC1(CC1)C1NC1C=O,0.2217
CC1CC11CCC(=N)O1,0.2729
Cc1cnoc1OC=O,0.2212
CC1NC1C1=CN=CN1,0.24
CCC1C2CN3C2C13C,0.3137
CC1CC2N1C1CC21O,0.2839
CC1(CC(=O)OC1)C,0.2783
CC1CC(=O)CC=C1,0.225
C1C(C(=O)O1)(CO)CO,0.2637
COCC(=O)NC(=N)N,0.2253
CC(C)C1(O)CC1CO,0.3193
C1C(CO1)CC#CC=O,0.1942
CCCCC(=O)OCC,0.2859
CCc1c[nH]nc1C,0.2589
CNc1n[nH]c(=O)o1,0.2525
CC12CCC1C2CC#C,0.3021
CC1OC2CC=CC12C,0.259
CN1CC2C1C=CC2=O,0.1699
Cc1[nH]cc(n1)OC,0.2222
COc1[nH]cc(n1)C=O,0.192
CC(CO)C(O)C1CC1,0.3312
CNC(=N)c1cnon1,0.1715
C1C2C3CC4OC1C4N23,0.3011
CC1C2C(=O)OCC12C,0.2701
C1NC11C2CC1C21CN1,0.3194
CC1NC(=O)C11CCC1,0.2754
OCCC12CC1CO2,0.3104
CCC1(C)C2C3CC2N13,0.3054
C1CC1CN=C(C=O)N,0.1821
CC12CN1C=NC2CO,0.2374
c1c[nH]nc1NCC#N,0.2312
CC1C2CC(N)(C#N)C12,0.2946
CCOC1(CC1)C1CN1,0.3299
CC12CC(O)(C1)C2(C)O,0.3226
CC1NC(=O)C1C(N)=O,0.2618
N#CCC(C#N)C1CN1,0.2756
C#Cc1cc(=O)onc1,0.1671
CC#Cc1nc(co1)O,0.1809
CC1C(O)C11CCCO1,0.2956
C1NC11C2C3C1CCN23,0.2997
c1c(coc1C=O)C#N,0.1907
O=CC1C2C3N1C2C3=O,0.2031
CC12CCC1(O)C(=O)O2,0.2608
CCC1(CN2CC12)OC,0.3083
CCC(C)C1=NON=C1,0.2559
COC12C(O)C1NC2=O,0.2354
CN1CC11COC1=O,0.2494
C1OC2C1N1N=NC=C21,0.2509
N#CCC1NC11COC1,0.2884
C1CC11C2C3OCC1C23,0.3151
O=CC1CC2C3OC1C23,0.2174
OC1CC2C(C#N)C12,0.2893
C(C1CC2OC12)N1CC1,0.3226
CC1CNC2=NC=NN12,0.2467
Cc1c(coc(=O)n1)F,0.176
C1CNc2c1nc(o2)O,0.2186
O=C1OCC1(C#C)C#N,0.2604
COC1CCOC(=O)O1,0.3167
c1c([nH]c(=O)n1C=O)O,0.1925
CC1C2(C)CC(O)C12O,0.3111
OC1CC(C#C)C1C#N,0.2852
C1OC=NCC2NC12,0.2621
CC12CC3C1N3C2(C)C,0.3082
Cc1coc(n1)COC,0.2358
C1COCC=C1CC#N,0.2562
CC12CC3OC1(C)C23,0.3068
CN1CC(O)C1C(N)=O,0.2488
CC#CC1(CC#N)CO1,0.2746
COC1CC2OC1C=C2,0.2518
CC12CC(O)C1(N2)C=O,0.2171
C1CC(=CCC=C1)C=O,0.1975
C1OC23COC4C2CC134,0.2791
CN1C=NC(CO)C1=O,0.226
CNC(=O)C1OCC=C1,0.2341
NC(=O)CC(CO)C#N,0.2753
CC12C3CC1OCOC23,0.319
CC1CC(O)C(=C1)C#C,0.2086
CC12OCC3COC1C23,0.303
C1CC2CC=CC2O1,0.2625
CC1=CC(=O)CC2CC12,0.1873
CC1CC2OC1OC2C,0.3361
CN1CCc2c1ocn2,0.2026
C#CC12C=CC3OC1C23,0.2102
OCC1(O)C2NC2C1=O,0.2046
CC(C)C1CC(C)C=C1,0.2611
COC(CO)C(=O)CO,0.2231
CC1OC2CC1C2=NO,0.2455
CN1C=[NH+]CC1C([O-])=O,0.146
C1C2CCOC3COC123,0.2979
N#CC1CC2CC=CC12,0.2596
C1C2C=CC3OC3C12,0.2399
CCC1CC(C)C1CO,0.3337
CNC1=CC(=O)NC1=O,0.164
Cc1c([nH]nn1)NC,0.2249
N=C1NC(=O)COC1=N,0.2087
OC1C2CC1C(=O)C2=O,0.1524
CC(O)C12C3C4C3C1C24,0.2885
COCc1ncon1,0.238
O=C1NCC=CC2CN12,0.2254
COC(C1CO1)C(N)=O,0.2603
CC1C2CC1(C)O2,0.3189
CC1C2OC1(C)C2C,0.3217
OC(CC1C[NH2+]1)C([O-])=O,0.2826
O=C1C=CC23CCC12N3,0.1669
N=COCC1=CNC=N1,0.2472
CC1CC2CC(C2)C=C1,0.2503
CC1CC(C)(C#N)C1O,0.295
C1C2C3CC=C1C23,0.1787
C1C=CC2N=COCC12,0.2535
OCC1C2OCCC12O,0.3029
CC12NC1(C)C(=O)C=C2,0.1771
C1CC(C1)C2=NCCO2,0.2668
C1OC23C1NC1C2OC31,0.2714
CC1CC2C=CCC12,0.2597
CC1=NC(=N)C=CN=C1,0.152
C1CC2(C1)CN=COC2,0.2702
CC1N=COCCC1O,0.2586
c1coc(c(c1=O)N)O,0.1684
Cn1cc(cn1)N(C)C,0.2107
O=CC1CC11OCC1=O,0.1989
CC1(CC(O)C#C)CO1,0.292
OC12CC1OCC21CO1,0.2989
CC#CCC(C)OC=N,0.2756
CCC12CC1OCC2=O,0.2141
C1C2C3OCCCC3N12,0.3035
CC1CC(O)C1N1CC1,0.3119
CCC1(O)CC1OC=N,0.2708
OCC1C2N1CC2=NO,0.231
CC1(CC1C1CO1)C#N,0.3107
CCNC(C=O)C(C)=O,0.1863
C1C2NC3=C(NN=N3)C12,0.1999
CCC1CCCCC1,0.3717
OCC1COC(C=O)=N1,0.1844
CC12CC3C(COC1)N23,0.3191
N=C1NC=NC1C#C,0.2288
CC(C)OCC(=O)C#N,0.1843
CNC1=NC(=O)N=NO1,0.259
CC1(O)C2NC(=N)C12O,0.2315
CCC(O)(CC)C(C)O,0.3212
NC(=O)C1CC2CC12,0.2661
CN1N=C(CN)OC1=N,0.2181
CC1=CCCC(=O)C1=O,0.1508
CC1(CC1)OCC=O,0.2278
CC1CC(C)C(O1)C#C,0.2839
CC12C(C=O)N1CC2O,0.1913
CC1(C)NC1C(N)=O,0.261
CC1CCN(C)CC1=O,0.2048
CC(C)(CNC=O)C#C,0.2768
CN=C1OCCC2OC12,0.2533
O=C(C#N)C1CC1C#N,0.2041
CCC1C(C#N)N1C=O,0.2535
O=C1CC23CNC2C1O3,0.2105
COC12CC1NC2C#N,0.2515
NC1(CC1CC#N)C#N,0.2959
CC1=CC=CCC2NC12,0.183
C1C2CC3CC2C1CC3,0.3454
CCC(C#N)N(C)CC,0.2668
CCC12CCC1CCC2,0.3502
CCc1cc(oc1)NC,0.2193
CC(=O)N1CCCCC1,0.2651
C1C2OCC11N=COC21,0.251
C#CCC1C=CC2OC12,0.2438
O=CC12C3CCC1OC23,0.2161
CC1C2OC1(CO)C2O,0.3067
C#CC12CCC(CO1)C2,0.2801
OC1CC(=O)C1CC#N,0.2215
CC1=CC(=O)C2CC1C2,0.1887
C1N2C3C=C4COC13C24,0.1663
O1C2C3C4OC2C1C34,0.3348
C1CCCOC(=O)CC1,0.2727
NC1(C#N)C2CCC12O,0.2915
O=CNC1CCCC=C1,0.2515
CC1N(C)C11CCOC1,0.2993
CC(CC([O-])=O)C1C[NH2+]1,0.1159
O=CCC12OC3C1CC23,0.2136
CC1(CO)CCC1=NO,0.2466
CCOC(=O)C=O,0.1809
CCc1c(nc([nH]1)O)N,0.2236
O=CC1CCOC1,0.2282
CC1OC1(CN)C#N,0.2644
O=CN1CC(C=C1)C#N,0.2098
C1CC11C2C3CC1CC23,0.3412
CC(=O)C12CC1OC=N2,0.2249
O=C1NCC2CNC=C12,0.1889
C#CC1CN=C2CCN12,0.2385
CC(CO)OC(C)C=O,0.2239
OC1C2C=CC1(O)C2O,0.2345
OCCC1OCOC1=N,0.288
CC12CC(O1)C(CO)C2,0.3194
N=C1OCC2CC12,0.2792
CCCCC1CC1C,0.3528
CC(C)CCOC(=O)N,0.3232
CC1C(=O)C2CCC12C,0.2153
C1C2C3C4OC3C4N12,0.3038
CC1CN1C1=CC=NO1,0.2232
CC#CC(=O)NCC#N,0.2349
C1C2C=CCC3CCC123,0.2491
OC1=NC=C(F)OC1=N,0.1664
CC1CN2CC12C#N,0.2577
CNc1c(cc[nH]1)O,0.232
C1OC2C1C1C3CN1C23,0.2969
CC#CC1(C)CC2CN12,0.2684
CCOCC(C)CC=O,0.2294
CC1(C)CC2OC12,0.337
C#CC1=CCCOC1=O,0.1903
CCC(C=O)C1CO1,0.225
N=C1OCC=CC1C=O,0.2238
O=C1CCCOC1C#C,0.2064
CC1CC(=O)N2CCC12,0.2576
CC(C[NH3+])(C#C)C([O-])=O,0.2759
CC1CC1CC(=O)C=O,0.1522
CCC1(CCC1)C,0.3582
OC12CC3CC1C2(O)C3,0.3019
Cn1cc(cc1N)C#N,0.2097
COC1CC1NC=O,0.2627
COC1CC=C(C)CO1,0.2621
CC1=CCC2(C)CCC12,0.2576
C1C2C=C3CCC3C12,0.2369
CC12COCOC1C2O,0.3133
CCC1CC(O)C11CC1,0.3288
OC1CCN2CC2C1,0.2969
CC1=C(N)COC1=N,0.2105
CNC1(CCOC1)C#N,0.2823
O=C1C2CC3CC3C1N2,0.2314
C1C=CCOC(=N1)C=O,0.192
CC1(CC1C#C)NC=O,0.2619
COCC(C)N(C)C=O,0.2703
C1CC(=O)C(=O)NC1,0.18
OC1C2C1C1C3OC1C23,0.3053
CC(O)C1(C)CC2CC12,0.3137
CCOC(CC=O)C#N,0.2233
N#CC1CCCOCO1,0.2952
CCOC(=N)C#C,0.2386
N=C1NC(=CO1)C1CN1,0.2132
COC12CNC1CC2=O,0.1933
c1cc(=O)occ1N,0.1549
CC#CC1C2C3NC3C12,0.2485
COC12CC(C1)C(C)=C2,0.2381
N#CCOC12CC1OC2,0.2497
OC1CC(C1)OC=N,0.2779
C1CC2CCC1CO2,0.3024
CC1CCC(C)C(C)C1,0.3595
OC1COC1C#CC#C,0.216
NC(C#N)C1(N)CC1O,0.2626
OCC1CC(O)CC1O,0.3097
OCC12COC(O1)C=C2,0.2467
CNC1(C)C(N)C1C#N,0.2672
CCC12NC1C1C(O)C21,0.2784
c1[nH]c(c(n1)NC=N)N,0.1998
C1C2CC1C1=NNC=C21,0.2497
NC1=COC(F)=NC1=N,0.1904
OC1CC11COC(=N)N1,0.2822
CC1OCC2NC2C1=O,0.2055
OC1C2CC1(O)C=CC2,0.2516
C1CC1C1OC2COC12,0.3042
OCC(O)C12CC(C1)O2,0.3145
CC1C2COC(O2)C1O,0.3253
CC(O)C1(O)COC1=O,0.256
O=C1NC(C=C1)C1CC1,0.2147
C1CN1C1C2C3CC1N23,0.3103
CCCc1cocc1N,0.2258
OCC(O)C#CC1CN1,0.2561
c1c(c([nH]n1)N)CCO,0.2387
CCOC1CC1(O)CC,0.2969
CCCN1CCOC1=O,0.3006
CC1C2(C)OC2C11CO1,0.3223
CC12CC(C1)C(C2)=NO,0.2582
Cc1cnc(n1C=O)C,0.1844
O=CC12NC1CC=C2,0.2172
C#CC1(OC1C#N)C#C,0.2444
CC1(C)OC(=O)C11CO1,0.2562
COC1C2CN2C1(C)C,0.3075
CC1(CO1)C1(C)CO1,0.3387
CC12CCOC11CC2C1,0.3206
C#CC1CC1C1CO1,0.2908
N=C1NC(=N)C(O1)C=O,0.2145
CC12OC3CN(C13)C2=N,0.2252
CCC12COCCC1N2,0.3181
C1C(=C(CO1)C=O)CO,0.1783
COC(C)C1(CN1)C#C,0.2832
O=C1CC2C3CC(C3)N12,0.2362
CC12CN(C1)C2(C)C#C,0.2576
OCC1C2OC2C1=NO,0.2389
OC1CC(O)C1C#C,0.2842
CCNc1ccoc1C,0.2125
O=C1NC2C3CC2C1C3,0.2683
CNC1(CC#N)CC1O,0.2662
C1C(=O)NC(=O)NC=N1,0.2295
O=COC1CCC(=O)C1,0.2222
CN(CC1CCO1)C=O,0.2684
C[NH2+]C(C)C(C)C([O-])=O,0.162
C#Cc1conc1C#C,0.2072
Cc1nc(c(o1)OC)N,0.2042
CC1C2OC1C2C#N,0.2773
C(CNC=O)COC=O,0.2669
CC12CC1C(C=O)=CC2,0.19
CC12CC3C(C13)C2=NO,0.256
CC(CCO)CCC#C,0.3158
COC(CC#C)CC#N,0.2795
CC(=O)C1CNC(=O)O1,0.2258
CC#CC1=CC(=N)OC1,0.1824
CC1C2COC2C1C#C,0.2837
CC1(C2CO2)C2COC12,0.3113
CC12CC(C)(C1)C1CC21,0.3429
C1C2C=CC3CN2C13,0.2227
CC1(C)CC1CCC#C,0.311
O=CCN1CC2OCC12,0.2011
O=C1OC(C#N)C11CN1,0.2625
CCNc1ccnn1C,0.2381
COCCC1CCC=C1,0.2631
CC1C2C3C=CC1(C)C23,0.2361
CCCC(C#C)(C#C)O,0.2784
CCC(CC)OC=O,0.2858
CN=C1ON=NC(C)=N1,0.1478
Cc1nc(nc(=O)o1)N,0.2152
COCC1(CC#C)CN1,0.2932
CCc1c(nno1)C#N,0.2207
CCOC1COC1CO,0.3069
OC1CCC2OC(=O)C12,0.2726
C#CC1N2CC2C11CO1,0.259
CC([NH3+])C(C)(N)C([O-])=O,0.2688
C1C2N=CN3C=NC1C23,0.2173
CC1COC(C)C2NC12,0.3097
O=CCC1CCC(=O)O1,0.2251
CC(=O)N1C2CCC12,0.2441
OC1C2CC(C1O)C2=O,0.2263
CN=C1N=NOC(F)=N1,0.2482
C1CNC(=O)C(=C1)C=O,0.1686
CC12OC1CCC21CC1,0.3362
CC(O)C(O)CC1CC1,0.3103
CC1(CN1C(=O)NC)C,0.2904
O=C1OCC2C=CCC12,0.2668
OCC1(CCC#C)CO1,0.3135
CCC1C=C(C)C2CC12,0.2447
CN1CC1(C)CCC#N,0.2781
CN=c1[nH]c(no1)O,0.2465
CCC(CC)CCO,0.3418
CC1CN1C1=NOC=N1,0.2205
CC1(CC1)COC=O,0.2837
C#CCOC=O,0.2768
CC1CC2(CC2)C1O,0.3195
CC1CC2C1C21CCC1,0.3314
CC1=C(C=O)C(=N)OC1,0.1795
CC#CC1(C)NC1C,0.2816
CN=C(C#N)N(C)C=O,0.2016
O=C1C(CC11CO1)C#C,0.1966
CN1C2CC(CC12)C=O,0.2027
COCC1(C)CC1OC,0.33
CCC1CCCC(=O)O1,0.2711
OC12CN=C3NC1C23,0.1789
N#CC1OC2CN3C2C13,0.2666
NC(=O)CC(CO)C#C,0.247
CCC1CCCC(=O)N1,0.2669
CC12OCC1N1CC21,0.2868
COc1cccnc1F,0.2103
CN(C)C(=O)CCO,0.2691
CCC#CCCOC=N,0.2724
COC1C=CCC1(C)O,0.2586
O=CNC12CC3OC1C23,0.2492
CCC12C3CC1CC2C3,0.3293
CCC(O)(C#N)C1CC1,0.3118
CCC1NC(=O)C1C=O,0.2217
N=C1CN=C(CC#N)N1,0.2297
CN1CC11CC=CC1O,0.2611
CC#CC1CC(CO)C1,0.2918
NC1=CC=C(O1)C1CN1,0.2065
CC1C=CNC(=O)N1C,0.2256
CC1=C(F)N=CC(=N)N1,0.1391
O=C1C=CC2(CC12)C#C,0.1811
CNc1c(cncn1)O,0.2013
CN1C=NC=C1C1CN1,0.24
CC1C(C)C11COCO1,0.3109
CC1C2CC2C1(C)C#C,0.3024
C1C2CC3OCC2CC13,0.3219
COc1n[nH]nn1,0.2305
CCN1CC1C1OC1C,0.3114
OC1CC2CC1N2C=O,0.2605
CCC1(C)COC1C,0.3154
OC1CCCC(=O)NC1,0.2694
CCC12C=CC3C1CC23,0.2257
OCC1COC2CC2O1,0.3011
COCCC(C)C(C)C,0.3314
CC1=CCC(OC1)(C)C,0.2628
NC1=CC(=N)C=C(F)O1,0.2026
OCC12CC1C(=O)N2,0.2543
C1C2C3CC22C=CCC132,0.25
OC1CNC(=N)NC1=O,0.2253
CC1=C(CNC1=O)C#C,0.1945
CC1C(CC=C1C)C#N,0.2599
O=C1CN2CC2CC=C1,0.1663
CC1(CC1)C12CCC1O2,0.323
CC(C)C1=CCOC1=O,0.2282
O=CNC1CNC1C#N,0.2651
Cc1c(nco1)C#N,0.2245
OC1CC(C=O)N2CC12,0.2169
C1OC23CCC(OC2)C13,0.3038
COC1COCC11CO1,0.3041
CC1N2C(=O)CCC12C,0.2394
C1CC11C2CN1CCO2,0.2978
Cc1cc(nc(=O)[nH]1)N,0.197
C1C=CCc2c1non2,0.2228
N=COC1=NC=NC=C1,0.218
OCC1OC2C3OC2C13,0.3052
OC1C2OC=NC1C=C2,0.2329
CN1C2CC11COCC21,0.3056
OC12CN(C1)C(C2)C#N,0.2652
NC(C#N)C1OC2CC12,0.275
CC12OC1COC2(C)C,0.3279
COC1(CO)CC1C=O,0.2247
C1CC23CN4CC12CC34,0.3092
OC1CC1(C=O)C#N,0.2117
OCC1CCCC2CC12,0.3375
c1n[nH]c(=O)n1CC=O,0.1889
CC1C2NC3C2C13C#N,0.2557
C1CC2(O1)C=CC1NC21,0.2354
N=C1OC2COC1OC2,0.2825
OC1CCC11NC1C=O,0.2195
N=C1OC2CC12OC=O,0.2696
CC1OCCC(O)C1C,0.3221
Cc1ccno1,0.2456
C(C(=O)C#CC=O)O,0.1917
CCN1C(C=O)C1C#N,0.2068
CC12OC3CC1C3C2O,0.3188
CC1(C)COC2CC12O,0.287
O=CC12CCN3C1CC23,0.1986
CC(O)(COC=O)C#N,0.2848
CCC#CCC#CC=O,0.1995
CC1C2N(C1=O)C2(C)C,0.23
C#CCC#CC#C,0.2294
CC(O)C1=CN=CC=C1,0.2228
CCCOCC1CN1,0.3229
[NH3+]CCC1=NOC([O-])=N1,0.2481
CC1C2C(=O)OC12C#C,0.2443
OC(C#N)C1OCC=C1,0.2545
C1OCC2NC2C=C1,0.2482
c1c(=O)c(c([nH]n1)O)N,0.1901
CC1CC2CC(C)C=C12,0.2459
CCCOc1conn1,0.2016
c1c2c([nH]n1)N=COC2,0.1918
CC(O)CN1C=CN=C1,0.2507
CC1CC23CC(O2)C13C,0.2989
O=CNC1CC1CC#C,0.2697
C1C(=O)NC(=N1)C(=O)N,0.1999
CC(C#C)C(O)C(C)=O,0.2227
N#CC1N=CNC11CC1,0.2389
CC(=O)NCCC#N,0.2747
CCC1C2C1C(C)C2C,0.3297
OC1CC1C1=CC=NO1,0.22
CC(C)C12CC(O1)C2C,0.3136
CC12OCC1OC2C=O,0.2147
CC1OC11CC2CC12,0.3349
Cc1ccccc1O,0.22
CC(C)c1cnnn1C,0.2517
CC1CNC(=O)C2NC12,0.2558
CCC(CO)(C#C)C#N,0.2868
C1C2CC3C4C3N1C24,0.2854
CC1(C)CCOC1=N,0.2877
N#CC12COC1COC2,0.2867
C1C(=CC(=O)CO1)C#N,0.1566
CC1=N[N-]C(=N1)[NH+]=CN,0.1265
CN=C1OC=CC=C1C,0.1656
CNC(=O)C(CO)OC,0.2671
CC1(OCCO1)C#C,0.2986
CC#CC1N=CNC1=N,0.2289
O=CC1C2CC1(N2)C#N,0.2034
CCC1COC1=N,0.2896
N#CCC12NC1C1NC21,0.2384
C#CC1COC1C1CO1,0.2886
CC1CNC(=O)C2OC12,0.2526
OC1CCCC1OC=O,0.2765
CC1C2COC(C)CC12,0.3188
CNc1c(cnn1C)O,0.2263
CC1C=CC(=O)C1=NO,0.161
OC1C=CC(=O)NC1=N,0.2093
N=C1C=NN2CCC2=C1,0.1652
CC#CC(C)C(C)C#N,0.2874
CC1=NCC2(CO2)CO1,0.272
CC(C#N)C1CC2OC12,0.3059
CC1C2CC1(C)OC2=N,0.2852
COC(=O)C1(C)CN1C,0.231
COC1CC=CC1O,0.2629
C1OC2CC=CCC12,0.2573
C1C2CC3=C(C=NO3)C12,0.225
Cc1cc(c(nc1)O)F,0.2047
CC1(C2CO2)C2CN1C2,0.3049
OC1CC1(C#N)N1CC1,0.2616
O=CC12CCN1C2C#C,0.1933
CCCOCCNC=O,0.2831
CN=c1n(cco1)C,0.2122
CC1(O)C2CC3C2C13O,0.2948
C(CO)C#CCCO,0.3008
NC(=O)OC1COC1=O,0.2727
CC1CN1C1CC2OC12,0.2936
C1CC1(C(C=O)C=O)O,0.2066
c1c(=O)ncon1,0.184
OCCC1COC1CO,0.3098
C(CO)C(=NO)CCO,0.2536
N#CC12NCC3OC1C23,0.2415
CC(=O)C(=N)OC1CC1,0.1952
CC12OC1CC=CC2=O,0.188
CN(C)C1C2CN2C1=O,0.2084
C#CC(=O)C1COC1,0.1889
CCC(C)(C)C#CC=O,0.2052
COC1(C)OCC(C)=C1,0.2626
C1CN2C1C1OCCC21,0.2853
NC12C3NC1C3NC2=O,0.2401
C#CC12CN3C4C(C14)C23,0.2544
OC1CN2CC2C1O,0.2922
O=C1CC2(CC12)C#N,0.2258
N#CC1CN1C1COC1,0.2584
CC#CCN1CC1C,0.2687
Cc1nc(co1)C#N,0.2241
CN=COC1CCC1,0.2725
CC1(CO1)C1=CN=NN1,0.2477
C1C2CN=C3NCC3N12,0.2399
CC1=CCOC12CCC2,0.2452
CC#CC1OC2CC12O,0.2515
COCC1OCC1CO,0.3109
NC1=NCC(=O)OC1=N,0.1943
CC1OC2(C)CC2C=C1,0.2369
O=CC1C2C3OCC1C23,0.2186
CC1=CC(O)CC2CC12,0.2438
CC(=O)C(C)(C=O)C#C,0.1906
CCC12CCC1OCO2,0.3295
CC(=O)C(C)(C)N1CC1,0.2219
CCC1CC2C(C#C)N12,0.2565
CC1NC1C12CC(C1)O2,0.3004
C1OC2CCC3OCC123,0.3161
OCCC12CC3C1CC23,0.3437
C1CC1C1COC=N1,0.2702
Cc1nc(no1)N=CN,0.2139
CNC(=[NH2+])C(N)C([O-])=O,0.2175
OC1CC1OC=O,0.2593
CC(C)(C)C1NC1C#C,0.2799
CCC12N=COC1C2O,0.2495
C#CCN1C2C3CC3C12,0.2666
CC1=CCC2NC1C2=O,0.2137
C1OC11C=C2CN3C2C13,0.1692
CCC1CC1(CO)CO,0.304
CC12CC1(O)C(O)C=C2,0.2183
CC1C2C(O)COC12C,0.2971
CC1CC(=O)C1C,0.221
O=C1C2CC1N2CC#N,0.2363
C1C2CC3C4CCC13C24,0.3501
Cn1c(cnn1)OC,0.2449
CC12OC1C1NC21,0.2803
CC1CC11CCOC1=O,0.2775
CC12CN1C(=N)C2O,0.2458
CCC1COC2C(C)C12,0.302
O=C1OCCC11CCN1,0.2379
CCCOC1CCC1=O,0.2008
OC1CCC11C2CN1C2,0.2891
C1CC1OC(=N)NC=O,0.2465
c1cc2n(c1O)CCO2,0.231
C1C2NC22COC3C1C23,0.3154
C1OC23CCC4C2CC134,0.2888
Cc1nc(no1)OC=O,0.248
COC12CC(C)(C1)C2=O,0.2341
CC1OC1C1OC2CC12,0.3031
c1c(nc(o1)N)O,0.2288
CCN1CC1C1CN1C,0.3024
O=CCC1NC1C1CO1,0.2197
O=COC1C2CC=CC12,0.2376
OC1CCC2CC2CC1,0.321
CC1C2C1(O)CC21CO1,0.3183
CC12COC1CC1OC21,0.3178
CC12CC3(C)C1CCC23,0.3512
NC(=O)C12CC1OCO2,0.2668
CC12C3CC1(C)COC23,0.3015
Cn1c(nc(n1)CO)N,0.2492
c1nncn1CC=O,0.2012
N=C1NC(=O)CN2CC12,0.2195
COC12CC(=O)C1C2O,0.2308
C1C2CCC12C1CCO1,0.3165
CC1C2OC1C(=O)C2C,0.2118
CN1CC2CC(O2)C1=O,0.2483
NC(=O)C12CN1CC2O,0.2601
CCOC(C)C(C)C,0.33
O=CC12COC1C(=O)N2,0.1987
c1c[nH]c2c1[nH]c(=O)[nH]2,0.2133
CC1C(C=O)C2CC12O,0.2151
CC1(CN1)C1=CN=CO1,0.2347
CC12CC1C(C)(O)CC2,0.3259
C1CC12CC(=O)CNC2,0.1971
OC12CC3(O)C1OC23,0.2879
CCC1C2CC3C2C13C,0.3252
CN1C2C3CC3C1C2=O,0.233
C1NC1C1C2CN1C2,0.2924
CCCCC(C)(C)CC,0.3671
C1c2c(nn[nH]2)N=C1N,0.193
Cc1cn(cn1)C(C)C,0.2487
C1OC1C1(CN1)C1CO1,0.3253
CNC1C2OC2C1=O,0.1925
CC1(CN1)C1=NNC=C1,0.2546
C#CC(=O)CO,0.2088
O=C1CCNCC11CO1,0.2158
OC1C2CC1C=CC2,0.2494
C#CCC(=O)C(=O)C=O,0.1307
O=CC1C2CC=CCN12,0.2038
CN=C1CN=C(N1)C#C,0.1857
CCC1OC(=N)NC1=N,0.2528
CC(=O)CC12CC(C1)C2,0.2317
CC12NC1CC2CO,0.2974
C1C=C(NC1=O)C=O,0.1619
C1COCC(CO1)CO,0.31
CC1=NCC2OC2CO1,0.2577
CN=C1OCC(=O)C1O,0.2015
C#CCC1CCOCO1,0.3112
COC12COC1C2CO,0.2992
O=C1COCC2CC2O1,0.2577
CC1C2N1CCOC2=N,0.2438
CCC(=O)COCC#C,0.235
CC(=O)C1CC(=O)O1,0.2257
c1c(c(n[nH]1)NC=O)N,0.1929
C(c1c(oc(=O)[nH]1)N)O,0.218
CC1CC1NC(=N)C=O,0.1683
CC1(C#C)C2C3OC3C12,0.264
CCC1(COC)CN1,0.3153
C1CC2(C1)CC1OCC21,0.3128
CC1=C(CCN1C)C=O,0.1716
C1C2OC11COC3C2C13,0.2633
OC12CC3(OC1C23)C#C,0.2401
CC1CC2(CC2(C)O)C1,0.3164
CCOC(CO)CC=O,0.2233
CCC1(COC1)C(=O)C,0.2249
CC(C)c1coc(n1)O,0.2468
CC1(C)C=CCC1C#N,0.2649
CCC1=NCCCCO1,0.2524
C1CC1C=O,0.2329
CC1C2C(CN12)OC=N,0.2557
C1CC2NC2C2OC2C1,0.3129
CC1OCC1CC(C)=O,0.2243
Cc1cc([nH]n1)OC=O,0.2262
CC12CC1C(=O)C21CO1,0.2172
CCCC1CN1C=O,0.2531
CC1CCC(O)C(=O)C1,0.2134
c1cn(nc1O)CC#N,0.2325
C1CC2C3OC3C2C1,0.3345
CNc1cc([nH]c1)N,0.2231
CC1C(O)C2C3CC12O3,0.2701
OCCN1CC(O)C1=O,0.2656
c1cn[nH]c1OC=O,0.229
CN=C(CC=O)OC,0.2178
COCC1(CCCC1)O,0.3328
CC12OCC1OC2C#C,0.2599
CC1C(OC1=N)C(N)=O,0.2685
CC1C2NC2(C#N)C1=O,0.2162
CC(C)C1(CC1)C=O,0.2249
CC(C)C#CC(C)C=O,0.2166
CC1=NCCC2CC2O1,0.257
OC1CC=CC1CC#N,0.2638
CN=COc1cc[nH]n1,0.2359
C1CC23OC4CC12OC34,0.2865
NC1(CC2C(O)C12)C#N,0.2769
CC1(C)OCC1(N)C#N,0.2791
COC(=N)N1CC1C#N,0.2545
COC1(C)C2OC(=O)C12,0.266
OCC1CCCC2CN12,0.2989
NC1=CNC(=C1)C1CO1,0.2093
ON=C1C2CC1(C2)C#C,0.271
O=C1C2CC(C#N)C1O2,0.2339
CC1(NCC1C#N)C=O,0.2014
CC1N(CCC1=O)C=O,0.2107
CC12NC(C1C=O)C2=O,0.2137
c1c2n(cn1)C=CCC2,0.2053
c1cnc(c(c1F)O)N,0.2039
CC1(CC1)C#N,0.3224
OCC1OC(C#C)C1O,0.2574
CC1(C)C(O)C1OC=N,0.2544
c1c(nc([nH]1)N2CC2)O,0.2258
CN1CC(=O)C2OCC12,0.1775
CC1=C(CNC1=O)CO,0.2228
CN1CC1(C)CO,0.311
CC1OC(CC#N)C1=O,0.2208
Cn1ncc(=NO)cn1,0.1581
CC1COC(C1)OC=N,0.2869
CCC1C2COC12C#C,0.2444
CC1OCCOC1C,0.3178
CCCCC(=O)CCC,0.2342
Cc1c(cn[nH]1)N(=O)=O,0.1997
CC#CC(=NO)CC=O,0.1931
CC12C3CC1C3CC2O,0.3376
O=C1CCC2CC2CO1,0.2716
NC1=CN=CC(=N)C=N1,0.132
Cc1c(n[nH]n1)NC=N,0.2153
COc1c(n[nH]n1)C=O,0.1943
CC1CN1CCC(C)=O,0.2143
CC#CCOCC1CC1,0.2835
CC12CC1(CC2)C1CC1,0.319
C1C2OCC3CCC12C3,0.3189
CC#Cc1cnon1,0.207
CC1C(C)C1C(O)CO,0.3149
C1C(=C(NC1=O)C=O)N,0.1488
CC1(CC1)C1(C)CC1O,0.3118
CN1CC=C(C1)C#N,0.1776
Cn1cc(c(=O)nn1)N,0.1692
OC1CC23CCC12CC3,0.2846
CC(CC(F)(F)F)C#C,0.3153
N=C1NCC2=C1C=NO2,0.2144
CC1OCC2CC(C2)O1,0.3278
CCCCCC(=O)C=O,0.1565
N#CC1CCC=CC=C1,0.1925
CCC12NC1COC2=O,0.252
CC12NC1C(=O)C1CC21,0.2024
CC(NCCC=O)C#N,0.2206
CCC1(O)C2CCCC12,0.3121
CCCCC=O,0.2292
COc1cnccn1,0.1992
CCC(CO)(C#N)C#N,0.2975
CC12CC3(C)CC1N23,0.3262
[NH2+]=CNC1=CN[CH-]C1=O,0.1875
OC1CC2C1CCC2=O,0.217
CC(CC#N)OC(C)=O,0.2851
CN1C2CC1(CC#N)C2,0.2553
CN1CC1C1NC1C#C,0.245
O=CC1=CC2NC2CC1,0.1912
C1OC2C3C4C5C4C12N35,0.2893
O1C2C3C4C5C2C5C1C34,0.3183
CCNC(=O)C(C)O,0.2764
CC1CC(O)C1C1CC1,0.3234
NC(=O)CC1CC(=O)N1,0.2583
CC1OC11CCCCC1,0.3339
COC(C)CC#N,0.305
CC1=NC=C(O1)C1CN1,0.2199
O=CCC(C#N)C1CC1,0.2249
CC(O)CCNC(C)=O,0.2767
CC1C2C3CC3(O)CN12,0.2889
CC(O)CC1OC1C=O,0.2156
CC1C2C3C=CC2(C)C13,0.2249
CC1C2CCOCCC12,0.315
C1CC(C1)OCC2CC2,0.3299
CC(CC#C)C1COC1,0.2946
NC1(CC(CO)C1)C#N,0.2924
CCCc1c(nco1)C,0.2372
CC1(CC1(O)C#N)C#C,0.2719
CC1OC(C=C1C)C#N,0.2542
C1OC2COC1CCC2,0.3183
CC1C2NC2C=C1C,0.2432
CCC#CC#CC(=O)N,0.195
COC(=O)C#CCC#N,0.2366
CC(C)COC,0.3384
O=C1CC2(CC1N2)C#C,0.2214
CC1(CN1)C1C2CCN12,0.2956
OCC1CC1C1CO1,0.3382
COCC12OC1CC=C2,0.2487
CCC1=CC2(CN2)CC1,0.2345
O=C1NCC1OCC#C,0.2511
COCC(N)(C#C)C#N,0.2601
CC(C)C(C)C#CCO,0.2767
O=CC12CN1CC2,0.2145
C1Oc2c(noc2O1)O,0.2182
COC=NC1(C)CC1O,0.2334
CCOC1CC2(CN2)C1,0.3178
CC1(C)OC1CCC#N,0.3101
CN(C)c1cnc([nH]1)O,0.2364
CCc1ccn[nH]c1=O,0.1777
c1c2c(ncn1)onn2,0.1866
O=C1CCC2C3OC2C13,0.2121
Cn1c(ccc1N)N,0.2284
CC12CN1CC2(C)CO,0.2934
Cc1cc(c([nH]1)C)C#N,0.2159
CC1=CC2C3CC(C1)C23,0.2428
CC1=CC=CC2NC2C1,0.1948
CC1OC2C(OC12)C#N,0.2664
OC12COC1C1CC2C1,0.3108
CC#CC1CC(O1)C#C,0.2538
CN1C2C3C(C#N)C2C13,0.2555
CCC(C#N)N1CC1C,0.2754
Cc1c([nH]c(n1)C=O)O,0.1684
N=C1OC=NC=N1,0.1854
CC1C2NC2(C)C1=O,0.2165
CCc1cc([nH]c1)CC,0.2401
OC1CC2CCC12C=O,0.2177
CN(C)CC(=O)OC,0.2309
Cc1cccc(n1)O,0.2101
CC#CCC1CC1O,0.3035
C1COCCC1CC=O,0.2244
CC1C2CN1CC(=N)O2,0.2481
CCC1CC2=CN=NN12,0.2608
COC1CCCCCC1,0.3212
c1cnc(=O)[nH]c1N,0.1858
CCC(=O)C(=NCC)N,0.1878
CC12CN1C1COC1C2,0.3084
CC1(C)CN2C1CC2=O,0.2378
CC(O)CC#CC(C)O,0.2855
CC(OC=O)C#CC#N,0.2322
O1C2C3OC4C2C1C34,0.2939
CC12C3CN1CC23,0.3148
CNC1(CC1(C)N)C#N,0.2665
CC(=O)OCC(N)C#N,0.2686
O=C1C2CC3OC2C1O3,0.2028
CC1(C)CC1C(F)(F)F,0.3646
C1OC2COCC1CO2,0.3159
[O-]C(=O)CNC(=[NH2+])C#C,0.2081
CC(=O)c1cccn1C,0.1887
O=C1COC2CC1CO2,0.2159
O=C1NCC2CCC2N1,0.3001
CN(C(=O)CN)C(=O)N,0.2406
CC(CC#N)OC(C)=N,0.2929
CC(C)C(C)C=O,0.2268
CC(=O)CN1CC(=O)C1,0.2068
CCOC1COCC=C1,0.2581
N#CC1OC11CC2NC12,0.2516
CCC1C2OC2C1C=O,0.2131
CC1CCC(CO)CO1,0.312
OC1C(C#N)C1C#N,0.2759
CC1(O)CC2(CO2)C1,0.3232
CC1CC2CC2N=CO1,0.2532
C1CC(C1)COC2CC2,0.3345
CC1(CN1CCC#N)C,0.2782
CC(O)CCCOC=O,0.2847
OC12COC1C2OC=O,0.2613
CN=c1nn[nH]nn1,0.1599
CC1=CCC(O)C2NC12,0.2407
OCC#CC12CC(C1)O2,0.2539
O=CC1NC(=O)C11CN1,0.2031
CCC1OC(=O)C11CN1,0.2586
CCC1CC(=O)OCO1,0.2725
C1OC2CC=CC2=C1,0.1949
NC12CC1(COC2)C#N,0.2646
C#CC1C2CCCCN12,0.2513
CC12CC(O)C1CCC2,0.3128
CC1C2C3C4C3C1CC24,0.347
CCC1(C)C2OC2C1=O,0.2094
O=CC(=O)C#CC1CN1,0.1542
O=C1CC2N3CC2(C3)N1,0.2499
ON=C1C2CC2CC1=O,0.1699
CC(C=O)C(O)CCO,0.2212
c1nc2c(o1)N=C(C2)N,0.1787
O=CN1CC2OC(=O)C12,0.2373
[O-]C(=O)C1CC2(CC2)[NH2+]1,0.2596
CC1=CCCNC1=O,0.2135
CC1CCC2OCCC12,0.3067
CC1OCOC=NC1C,0.2584
O=C1NC2CC12N1CC1,0.2296
CCCN=COCC#N,0.2647
CC1C(C=O)C2CC12C,0.2159
c1c(c(no1)C#N)CO,0.22
O1C2C1C1C3OC1C23,0.3012
OC1CN=COC1C#N,0.2627
CC1=CC2C(CC2=O)C1,0.2056
COC1(C)CC1(O)C=O,0.217
COCC(O)C1COC1,0.318
C#CC1(C#C)C2CN1C2,0.2348
COCCOCC1CN1,0.3136
CCC12CC1OC(=N)C2,0.2715
CCCC1=CC2NC2C1,0.2424
COC1CC11CCCC1,0.3058
CCC1(NC1C#C)C=O,0.2102
O=C1OC2CNC(=O)C12,0.2502
O=CC1CCOCC=C1,0.2209
C#CC#CC12CC1CO2,0.1942
COC1C2NC(=O)NC12,0.2736
C(#N)c1c(oc(n1)N)N,0.1976
CC1NC(C)(C#N)C1O,0.2694
C#CC1=C(COC1)C#C,0.1729
CC12C[NH2+]C1C2C([O-])=O,0.2627
Cc1c(cnc(n1)C)O,0.2046
c1c(n[nH]n1)CCC=O,0.224
CC1C2N1C1C(C)C21C,0.282
Cc1cc(c([nH]1)O)N,0.2188
[NH3+]CC1[N-]C(=O)NC1=O,0.2523
COCC(O)CCC#N,0.3181
CCCc1c[nH]cc1C,0.249
O=CC1C2CC1C2(C)C,0.2225
CCC1(O)C(C)OC1=N,0.2847
CC(=O)OC1(CC1)CO,0.2682
Cc1c(n[nH]c1NC)C,0.2381
OC(C#CC#C)C1CN1,0.2118
Cc1cncc(n1)C,0.1957
CCC1(O)CCCC1C,0.3259
C1CC2OCC=CC2C1,0.2592
c1c(nc[nH]1)NC=O,0.2192
CC(O)(CC(N)=O)C#C,0.27
O=C1OCC2OC2C=C1,0.2108
CC1(C)C2OC11COC21,0.2649
CC1CCC2CCC=C12,0.251
CC1OC2(C)CCC2=C1,0.2341
CC1C2CC3N1C23C=O,0.2175
CCC12OCC1C1CC21,0.3132
CC1C(O)C1C1CN1C,0.2822
CC1(CO)OC1C1CO1,0.329
CN1C2C3C1CC23C#N,0.2477
O=C1OC2(CNC12)C#C,0.2391
Cc1c(nc(o1)NC)O,0.2193
CC1COC1(C)CC#C,0.2896
CC(O)CCC1(O)CC1,0.3221
C#CC#CCOC(=O)N,0.2217
OC1C2C3OC2C13C=O,0.203
COCC12OC1C1CC21,0.2898
CC(=O)C#CCOC=N,0.2067
CC1CC(=O)NCC1=O,0.2178
OCC12CN3C(CO1)C23,0.313
COC1(C)CCC1=NO,0.2434
NC12CCC1NC2C#N,0.2517
CC(=O)NC1CC(O)C1,0.2772
CC1CC2=CCCOC12,0.2488
N=C1NC=C(O1)C1CC1,0.2159
O=CC(OCC#N)C#N,0.2288
CN(C)c1ncccn1,0.1819
CC1(COC=N)CC1O,0.2834
CC1C2OC(C2O)C1C,0.3206
CC12CC(C1)C2(O)C#N,0.3038
N=C1NCC11OC1C#N,0.2347
CC1CC2C(N12)C(C)=O,0.2214
C1CN1C12CN3CC1C23,0.2933
CC1CC=C(C)C(=O)O1,0.2227
OC1COCCC11CC1,0.3244
C#CC1CC2(CC2)O1,0.2561
NC(CO)C#CC#N,0.2165
CC#CC1(CCC1)OC,0.2843
OC12CC(CC1)C21CO1,0.3179
CCC1(O)CC2NC2C1,0.3121
CC1=CCC(=O)C1O,0.2227
OCC1C(O)C(O)C1=O,0.2159
[O-]C(=O)C1CC11CC[NH2+]1,0.1614
CC12COC=NCC1O2,0.2586
CC1=C(C)CC2(CO2)C1,0.2563
CCOC12CC1C1OC21,0.2938
CCC1=CCC(=O)OC1,0.2558
OC1C=CC2(O)CC12O,0.2266
CC1C2C3CN1C23C#N,0.2522
CCC1(COC1=O)C=O,0.2157
O=C1NC2CC3CC12C3,0.2567
CCCCNC(=O)CO,0.2667
CC12C3CCC1C=CC23,0.2387
CC12NC(=O)C3C1CC23,0.2519
CCC12CC3CC3C1O2,0.3316
CC(O)C1=NNN=C1C,0.248
CCNc1ncnn1C,0.2451
N#CCC1CC2OCC12,0.2864
CCC1C2COC(C)C12,0.3229
CC12CN3C(C13)C(=O)N2,0.2476
CCNC=O,0.2834
OC(C=O)C1CC1C=O,0.1894
CC12C3NC(C1O)C23O,0.2807
CC1OCC(=O)C2NC12,0.2074
COC12C3C1N1C3C21C,0.2636
c1cnc(oc1=O)CO,0.1956
COc1cc(c([nH]1)O)O,0.2239
CN=COc1c[nH]nn1,0.2213
CC1CC2OCC2C1=O,0.2128
CC1=CCC(N)(C1)C#N,0.2612
CN1CC(=O)C(O)C1=N,0.1831
CCC1CN(C1)C(=O)N,0.2887
OCC12C3COC1CN23,0.3072
CC(=NO)C(=O)N,0.215
CCC1=CC(O)C(C)C1,0.2555
CCN1C2C3CC2C13,0.2966
c1c(cn2c1CC2)C=O,0.1921
OCC1NC(=O)C2CC12,0.2671
CC(C)(C)C1=NCCO1,0.272
CCC(C)C1(O)CC1,0.3023
CN1CC1(C=O)C#N,0.1982
N=C1CC2(CC=CC2)O1,0.2674
CC1(O)C2CC2C1CO,0.3086
CN=C1NC(=O)CC1C,0.2405
CCC(CN)(C#N)C#N,0.2598
O=C1[CH-][NH+]2CCCC2=C1,0.1459
CC1CCN=C(N)C1=O,0.1706
O=C1NCC2OC12,0.2514
N=C1OC(=O)C(=C1)C#C,0.1689
CC1=C(CCN1)C(=O)N,0.1913
CC1=CC2CN3C2CC13,0.2283
CC1C(OC1=O)C1CO1,0.2815
Cc1ccc(o1)C(=O)C,0.1836
C1C2(CNC(=O)N1)CO2,0.3008
CC(OC(=O)C=O)C=O,0.1758
CC#CC(C)C1CC1,0.3012
OCC1(CN1)C(=O)C=O,0.1457
O=C1CC2C3CC2C1O3,0.2125
NC1(COC1=N)C#C,0.2567
OC12CC1C=C(C2)C#N,0.2058
OC1=CNN=C1C1CO1,0.2291
c1c2c(c([nH]1)O)C=CC2,0.1888
CC1OC23CC(C=C2)C13,0.2254
CC(O)C(O)C1OC1C,0.3149
CC(C)N1C(C)CC1=O,0.2733
C1CC2(CCCOC2)O1,0.3066
CCC1COCC(=O)C1,0.2117
C1C2C3C4C3C1C=CC24,0.2571
c1coc2c1OC=NC2,0.2134
CC1OC(=N)C2CCC12,0.2783
Cn1c(c(cn1)OC)N,0.2239
c1c(cncn1)C=O,0.1818
OC1CNC1C(=O)C#N,0.162
CC1CCCOC(=O)O1,0.2956
OC1COC(CC=O)C1,0.2246
CC1(C)C(O)C1(O)CO,0.2767
CN1C=C(C)C(=O)C1=N,0.1386
COCC(C)(OC)C#C,0.2959
CC(C=O)N=C1CCO1,0.2261
OC12CC3CC=CC1C23,0.2397
CC1C2C3CC1OC23,0.3205
OCC12CCN1CC2O,0.2632
Cc1c(c(n[nH]1)OC)O,0.2286
CN=COC(=O)CCO,0.2433
COC12CC1OCC2,0.3157
C1CC2C1C=C1CCC21,0.2442
C1CC=CC(=O)OC1,0.2209
C1CC1c2noc(=O)o2,0.2547
O=C1CNCC2CC2O1,0.2172
CC(C)c1c(cco1)O,0.2207
C1COCc2c1n[nH]n2,0.2479
CC#CCC1OCC1O,0.2889
CC1=C(CCC1)C(C)C,0.2531
CC(C)C1CC(O)C=C1,0.258
CC1C2N1C(=O)C2(C)O,0.2218
C#CCN=COCCO,0.2691
CC1N=C(N)C2(C)OC12,0.2472
CC12OC1C1CC1C2=O,0.2043
Cc1c(nno1)CCO,0.221
CN1CC2C3OC2C13,0.283
CC(C#N)C(C)(C)C#N,0.3286
CC1OCC1C1CO1,0.3233
OC1CCC(NC1)C#N,0.2637
CN1N=CC(=N)C=C1N,0.1685
Cc1cnc(o1)NC,0.2269
C(c1nc(no1)N)N,0.2321
CC1=NC2CC(C2)O1,0.2648
COCC#CC#N,0.2281
C1C2CCOCCC12,0.3209
CC1=CCOC1OC=N,0.2607
CCC(C)C(C)CC#C,0.3137
O=C1CC2OC12C#C,0.2123
NC12C3NC1C(=O)OC23,0.2334
OC1CCC2CC2OC1,0.3211
CCN=C1OCOC1=N,0.2259
C1C2CC3CCC1C2O3,0.3099
CNC1=C(CCC1)C=O,0.1756
CCC1C(=O)N2CC12C,0.2319
CCC(NC(C)C)C#N,0.2699
CC1OCC(CO1)=NO,0.2496
OC12CC3C(OC1=N)C23,0.2706
CCCC1CC(C1)OC,0.3282
CC(C=O)N(C)C(N)=O,0.2114
O=CC12OC3C4C(C14)C23,0.214
C1C2NC3=NCCOC123,0.2421
CC12COC1CN1CC21,0.3013
CC(C)(C#CC#N)C#N,0.2429
CC1OC(C)(CO)C=C1,0.2439
CC1N2C3CCC1(C)C23,0.2991
OC1CCCCCC1=O,0.2347
CC1C=CC2C1CC2=O,0.2086
CCCC1(CC1)CO,0.3328
CC(C#N)C1C2CC1O2,0.2822
CCC12CC1(O)COC2,0.3197
CC1OC2C3OC3C12O,0.2955
C#CCOC1CC=CC1,0.2682
CC1OC23COC2CC13,0.3005
C1C(CO1)(C#N)N,0.2849
COC1CC(O)C11CO1,0.3036
CC1=CCC2C1C2(C)C,0.2437
OC12CC3CC1CC2O3,0.3041
Cc1ccc(nn1)C,0.1815
N=C1C=NNC=C1C#C,0.1596
C1OC2=NCCC3NC123,0.2569
ON=C1C2CCC1OC2,0.2462
CC(C=O)C1CC(=N)O1,0.22
CC1CNC=CC(=O)O1,0.2038
CCCn1cnc(n1)C,0.2643
N#CC1CC(N1)C1CN1,0.2562
c1c(cnc(c1N)F)O,0.1911
CCCC(O)(C=O)C#N,0.2192
OCC1NC2C1OC2=N,0.2572
CC1(CC1)CC2COC2,0.3161
CC1CC2CC1N=CO2,0.2669
OCC12CC1(CC2)C=O,0.2184
CC12CC1C(O)CC2,0.3282
Cc1c(non1)NC=O,0.2202
CC1(COCC#N)CO1,0.2809
C1CC1C1C2C3CC2N13,0.3169
CC1=CCOCCOC1,0.236
CC1OC1C12CC1CO2,0.2957
Cc1cc(oc1C)C#C,0.1897
CC(C=O)(C#N)C1CN1,0.2103
CC1(C)C2CC(=NO)C12,0.2422
C12CC34CC(O3)C4(C1)C2,0.3216
O=CC1C2CC1OCO2,0.2115
NC(=O)C12CCC1C2O,0.2643
CC12OCC(O1)C=C2,0.2454
NC1C2N=COC12C#N,0.2272
CCC(CC)C1(C)CO1,0.3324
CCc1ncc(o1)NC,0.2156
Cc1[nH]nc(n1)CCO,0.2569
CCC(=O)C(=O)CC#N,0.1588
Cc1c(c(c[nH]1)CO)N,0.2305
N=C1OCC=CC2CC12,0.2312
CC1=CCOC(C1)C#C,0.2597
CC(CCCC=O)C#N,0.2286
CC(C)c1n[nH]c(=O)o1,0.2483
CC(C)(O)CC1CO1,0.326
OC12COC1=NCC2,0.2462
CC1CC(CO1)N1CC1,0.3216
CCOC12CC1COC2,0.3361
O=C1NC=CC2CC12,0.2107
O=C1CN2CCC12C#N,0.204
CC12CC3(O)C1C2C3=O,0.2414
OC1CC2C1N2CC#C,0.2775
CC1=CC(C)(O)C2OC12,0.2393
CC1OC=NCC2CC12,0.2637
CC12CC1CCC(=N)O2,0.2801
CC1C2CC3CC1N23,0.2954
CC(O)CC1(C)COC1,0.2976
CCc1ccnn1C=O,0.2087
CN=c1cnoc(=O)[nH]1,0.1916
CCC1=CC2CCC1O2,0.2516
Cc1c([nH]nc1OC)C,0.2419
CC12CC3CC(C1O)C23,0.3171
COC(=O)C1CCC1C,0.2765
COC12CC1C1NC21C,0.2857
CCCC(C)(CO)C#N,0.3134
O=CC12CC3C1OC23,0.2013
CN1CC2CC2C(=O)C1,0.2081
CCC(C=O)C(C)C#N,0.2234
CC(=O)C1C2N1CC2=O,0.2108
OC1CC2(CN2)C1,0.3175
CCc1c(c(c[nH]1)O)N,0.2213
N=C1OCCOC1C#C,0.2688
CCC1(C)COC1C#N,0.2784
C1CC2OC2C=CCO1,0.2353
C1C2CC11OCCCC21,0.3317
CC1(O)C2CCCCC12,0.3128
CC1=COC=C1C1CN1,0.2407
OCC#CC(CO)C#C,0.2783
COCC1CC(C)C1,0.34
CC1C2C3CC2(C=O)N13,0.1992
CC(C=O)C1CC1C#C,0.2237
CCc1c(cn(n1)C)O,0.23
CC(O)CC1CO1,0.3296
CCC(C)C1(C)OC1C,0.3344
CCC#CC(=O)CO,0.2097
CCn1cc(cc1N)C,0.235
C(COC(=N)NC=O)O,0.228
O=CC12CC1CC2=O,0.2055
CC1CC=CC(=O)C1=O,0.1471
CC12CC(O)C1NC2=O,0.2687
c1cc2n(c1)C(=O)CC2,0.1948
COCCC1CC1,0.3424
CC1C2N3CC1C23C#C,0.257
C1C2OCC3C2N13,0.3177
NC1(COCC=C1)C#N,0.2442
c1c(n[nH]n1)C(=N)N,0.2038
CCC1(CCO1)C#CC,0.277
CN1C2CCC12C(C)=O,0.2184
c1c(nc([nH]1)O)C2CC2,0.2483
CC(=O)C1CCC1O,0.2228
CC1(CC#N)CN=CO1,0.2736
CCC1CNC(=O)CO1,0.2643
CC(CC(N)=O)N1CC1,0.2745
C1C(COCO1)O,0.3149
CC1CC(N)(C#N)C1N,0.2644
OC1CC2OC12CC=O,0.2233
CCC1(C)CCCC1O,0.3291
CC1=NC2C3OC3C2O1,0.2703
CNC(=O)C1NC1(C)C,0.2614
CC1C2(O)CC1(C)OC2,0.2973
O=C1C=CC2CC=CC12,0.1823
O=CCC1OCC2NC12,0.2249
COCC1NC(C)C1=O,0.2159
c1nc(nnn1)N(=O)=O,0.1593
COC12C(O)C1N1CC21,0.2803
C1C(=NCC#N)OCO1,0.2732
O=CC12COC1C2C#N,0.2142
CC1C2OC(C)(C)C12O,0.2953
COC12CC1OC2,0.3069
CCc1[nH]ccc(=O)n1,0.2068
C1COC(O1)(CN)C#N,0.2784
ON=C1CC(O)CC=C1,0.1936
CC1C(O)C2OC=NC12,0.2611
CCc1c(nc[nH]1)C#C,0.2179
CN=C1OC(=O)C2NC12,0.2364
CC1(C#N)C(O)C1O,0.2771
CCC(OC)C(=O)CC,0.2198
CC1CC2=CNN=C2N1,0.2203
C1CC2OCCN=C2O1,0.254
O=CC12CC1CC21CN1,0.2107
CC#CC(C)C(C)=NO,0.2544
[NH2+]=CNC1=CC(=O)N[CH-]1,0.074
CCC12CC3C=CC1C23,0.2342
C#CC1CC1(C#C)C#N,0.2506
CN=C1OCC(C)C1C,0.2728
C1C2OC3COC2C1O3,0.323
OC1(CC=O)CCC=C1,0.2114
OCC1C2CC1C21CC1,0.3362
CCC12CC(C)C1O2,0.3285
CC1CCCC1(O)C#C,0.2964
C(C#N)C(CC#N)N,0.2722
CC1CC1N=C1CCO1,0.2546
CC1=CC2OCC3C2C13,0.2347
FC1=CC(F)=NOC1=N,0.1703
O=C1COCOC1C#C,0.1999
C1C2OCC11CCCC21,0.3105
C1CC23OC=NC2CC13,0.2541
CCOC(C)(C)C#N,0.301
CN1CC(C1)NCC=O,0.1922
O=C1NC=CC1C1CC1,0.213
NC(=O)C12OC3C1NC23,0.2458
COC1CN=C(O1)C=O,0.1962
O=CC#CC12CN1CC2,0.1856
CC12NC1CCC2O,0.306
CN1CC1C(C)(C)C=O,0.2032
CC12OC3CCC1C2O3,0.3057
CC1=CC2C3C=CC1C23,0.23
N=C1NC(=O)N=CO1,0.215
C#CCN=c1[nH]cn[nH]1,0.2183
OC1CN2C1=NNC2=O,0.2283
O=C1C2OCC3OC2C13,0.1955
C1C(=O)CC1(CO)O,0.2199
Cc1ncc(c(n1)N)F,0.2111
COC1CC(C)CCO1,0.3369
O=CC1(CCC#N)CO1,0.2202
O=CC1C2CC(=O)C12,0.2142
NC1=NCC2(OC12)C=O,0.1997
CCC1(CC1)CN2CC2,0.3139
C1CNC(=NC1)C#N,0.2085
CC(C)(C)C1(CO1)C=O,0.2186
CC1CC2CC12OC=O,0.2673
C#CCC(CC#C)C#N,0.2919
OC1CCC1C#C,0.2922
CC1(CN1)C1OCCO1,0.312
OCC1C2CCC12C#N,0.2857
CC1C=CC(C)C11CO1,0.2659
CC12OCC3C(CO1)C23,0.3238
OCC(C=O)C#CC#C,0.2012
CC12CC(C1)OC2,0.3193
CC(O)C1(C)CC(C)C1,0.3219
O=C1OCC1NCC#N,0.2508
CC12CN1C(=O)CNC2,0.2221
N=C1OC(=O)C=CN=C1,0.1734
CC1(CO)C2OCC12O,0.2846
C(C#N)Oc1nnon1,0.2252
CN1CC(C)(O)C1CO,0.2775
CNC1C(O)COC1=N,0.266
CC1=CC(C)=CC(=N)O1,0.1692
CC1(O)COC(C1)C=O,0.2237
C1C=C(NC1=O)C#N,0.185
CC1NC2C(NC12)C#N,0.2497
CCCC1CC(O1)=NC,0.2795
CC1OC2COC3C1C23,0.3181
CC1C(=N)OC1(C)CO,0.2861
COC1CC=CC1C,0.2635
Cc1cc(nn1C)C#N,0.2336
CCC([NH3+])C(C)C([O-])=O,0.2768
CCC1C(C)C1(O)CO,0.3017
CCC1C2OC(C=O)C12,0.2191
CCC(CO)OCC=O,0.2264
CCC(C)(O)CCO,0.3204
CC1CC2OC(C)C12,0.308
CC1C2(O)CNC12C#C,0.2328
C(=O)c1c([nH]c(n1)O)N,0.1813
CCOCCC(=O)NC,0.2774
CC1CC1(CO)CC=O,0.2239
O=C1C=CCCC2CC12,0.1922
C1CC2COCC=C2C1,0.2522
OC12CC1N=C1NCC21,0.227
CC1C2OC2(C)C11CN1,0.3071
CC(C)C(=O)C1OC1C,0.2183
CN1CC2C3N4CC13C24,0.2873
c1c(=O)cnn(n1)C=O,0.1602
c1c(c(n[nH]1)CO)O,0.2275
CC1CCC11CC(O)C1,0.3312
CC(C)(C1(CC1)O)O,0.3114
c1c(cn[nH]1)C(F)(F)F,0.2702
C1C2CC3N=COC3C12,0.2694
FC1=CN=C(F)C(=N)N1,0.166
CN1C2C3C(C#C)C2C13,0.2609
CC12OC3C1C3(O)C=C2,0.2186
CC12C3N=CN1CC23O,0.2149
CC1OCC1C#CC=O,0.1967
CC1(C#C)C(O)C1C=O,0.2135
CC1OC(=O)C2(O)CC12,0.2618
CC(O)C(O)CC#N,0.3028
C1CC1C(=N)NC(=O)N,0.2492
CCC(O)C1(C)CCC1,0.3243
ON=C1CC2OC12,0.2485
Cc1ccnc(c1)CO,0.2298
CC1(CC(C1)C#N)C,0.3333
O=C([N-]C1C[NH2+]C1)C#N,0.1956
CN1CC2C1COC2=N,0.2513
COC(C(C)=O)C(N)=O,0.2099
COc1ccnc(n1)O,0.2198
CC1(O)C2CC1COC2,0.3035
C1c2c(oc(=O)[nH]2)CO1,0.2418
Cc1cc2cn[nH]c2o1,0.2218
OC12CC3C=CC1C23,0.2275
C1C2CC1C1C=CCC21,0.2634
CC1CC(C)C1C(N)=O,0.2672
COC1C2OC2(C)C1=O,0.1945
OCC1OC2CC12,0.3119
CC12C3C4C(CC14C)N23,0.2993
O=C1CC23CNC12CO3,0.1933
Cc1nc(=O)c(co1)F,0.2077
CC1CC2COC=NC12,0.2656
CCc1cnn[nH]1,0.2525
NC(=O)C12C3CC1CN23,0.2554
CCC12CC3CC1C2O3,0.3183
Cc1c[nH]c(n1)C(=O)C,0.1829
Cc1cccnc1,0.2272
CC1C(=O)C(O)C11CO1,0.2076
CC1C2C(O)C(C#N)N12,0.2558
CCC(CC)OCC#N,0.2887
CN=COc1conn1,0.2012
O=C1C2CC3N=CN1C23,0.2283
OCC1(CN=CN1)C#N,0.2516
OC1CC23OC(C2O)C13,0.281
CC12CC3CC(C1)N23,0.2964
C1=CC2C3C=CC2C13,0.1981
C1C(CO1)(C=O)OC=O,0.2158
CC1(C)COC1C#N,0.2782
OCC12CC3CC1N2C3,0.325
OCC(C=O)C1COC1,0.2173
CC1OCC11CC1O,0.3099
NC(=O)C12CC1C(=O)C2,0.223
C1COCc2c1nn[nH]2,0.2431
CC(C)c1ccco1,0.2365
CC1CNC=CC(=O)N1,0.2037
CC(CC1CC1O)=NO,0.2553
CC1(CO)C2OC1C=C2,0.2304
COCC1C2C3CN2C13,0.3082
NC(=O)NC1CCC1O,0.2952
CCC1OC11C2CC1O2,0.3176
COC12COC1C1CC21,0.299
CCOC(=NCC#C)N,0.2775
CCOC1CC2OC2C1,0.3277
OCC(OC=N)C1CC1,0.2785
CCC#CC(=O)NC,0.2357
CC#CC1CN=CO1,0.2683
OC12CC3C4C1N4CC23,0.3082
CC1=NC(=N)N=NN1,0.1803
CC12OC3CC1C23,0.3157
CC12C3COC1CCN23,0.3179
C1C2CN=COCOC12,0.2565
C1OC2C1C1=CCCC21,0.2361
CC1CC2COC(C2)O1,0.3283
CNC1=NOC(=N)C=N1,0.1418
CC#CC1COC1C=O,0.2102
COCc1c(cc[nH]1)N,0.2188
CC(C)OC=NCC#C,0.2705
CC1C2OCC11COC21,0.3022
CC12CC3C1C2C31CC1,0.3306
CC1CC2(O)CCC=C12,0.2455
OC1C2CCC2OC1=N,0.2827
O=CC(CC#C)C1CO1,0.2207
CCCCC(=NO)CO,0.2531
CC1CC1(C)CC1CC1,0.3407
CC1C2CC(N2C)C1=O,0.208
CC1=CCC2(CO2)C1,0.2628
NC(=O)C1(CO)CCO1,0.2533
CC12CC1(C)C(C)(O)C2,0.3066
CC(O)CC1(CO1)C=O,0.2219
CC1(CC11COC1)C#N,0.2841
CCC1CC1CC,0.3568
Cc1ccc(o1)C#C,0.1915
CCOC(CO)CCO,0.3175
N=COC1COC(=O)O1,0.2878
O=CCC1C2NC(=O)C12,0.2113
N=C1NN=CC(=N)N=C1,0.1606
C(C(=O)NC(=O)C=O)O,0.16
CCC12CC=CC1(C)N2,0.2415
CC(=O)NCCC(=O)N,0.2414
CCC(CO)C#CCO,0.2844
CC1CN2CC3OCC123,0.2846
CC1CCC(O)C1C=O,0.2236
CC1(O)C2CCN2C1=O,0.2198
COC1C(C)CC1(C)C,0.3145
COC1C(C)C1(C)C#C,0.2777
CC(OC=N)C1CC1O,0.2828
CCC1CCCC(=O)C1,0.2241
CCC(OC=O)C1CO1,0.2762
OC12CC1CCN1CC21,0.2985
Cc1c([nH]nn1)C(=O)N,0.2141
OC1C2C3CC2C3C1=O,0.2147
N=C1N=CNC=C1C#N,0.171
CCC1C(C#N)C1(C)O,0.2923
NC(=O)C1CN1CC#C,0.2385
CCC1CCC1C=O,0.2233
CC1(CO)OCCC1=O,0.2171
COCC1NCC1C#N,0.2675
N#CC12OC1CC=C2,0.2398
CC12COC(OC1)C2O,0.3227
OC12CC3C1C=CC23O,0.2253
CC(O)C#CC(=O)C#C,0.1881
c1cc(n2c1CC=C2)N,0.1894
CCC1(O)CC1(C)C=O,0.2289
COc1cn[nH]c1OC,0.2403
Cc1cc(ncc1N)C,0.1957
C#CC1CC=CCC=C1,0.2503
O=CN1C2CC(C#N)C12,0.2468
O=CC1(CC1C#N)C#N,0.221
CCc1[nH]cc(n1)C#C,0.219
CCC1CC2CCC12O,0.3179
C#CC1C=CCOC=N1,0.2288
CC1CC1N(C)CC#N,0.2621
CCCN1CC(=NO)C1,0.2251
CN(C)c1cc([nH]n1)N,0.2251
CCCC#CC(C)C,0.3012
c1cc([nH]c1C2CC2)O,0.2308
C[NH2+]C(C(C)O)C([O-])=O,0.2592
c1ccnc(c(=O)c1)N,0.1547
O=CC1C2NC1C2=O,0.2156
CC12CC3C(N=CO1)C23,0.2566
C1C2OC3C4OCC12C34,0.2959
CC(C)N=COCC=O,0.2191
C1CCC=CC1,0.268
O=C1CC2(CC#N)NC12,0.2216
CC1CC(C)C(C)(O)C1,0.3203
C#Cc1cc(c(o1)N)N,0.1753
CC(C)Cc1ccc[nH]1,0.2414
Cn1ccc2c1occ2,0.2208
c1coc(cc1=O)C=O,0.1569
CC12C3C1C(C3O)C2O,0.3101
CNc1nnc(o1)NC,0.2362
CC(N)(CO)C(N)C#N,0.2661
C1C2CC1C1=NC=CN21,0.2382
CC#CC(O)C1CC1,0.2893
c1nc(no1)COC=O,0.2404
COC(C)(C)C1NC1C,0.3165
CN1CCN=C1C(C)=O,0.16
CC(C=O)C1CCCO1,0.2194
OC1CCCC2NC12,0.3122
OC1CN2C1C21COC1,0.2911
O=CC12CC1CCC=C2,0.2248
CC(=NO)CC(C)(C)C,0.2507
CCC1CC2CC2O1,0.3206
CC(=O)C1OCOC1=O,0.2165
CC1OCC(=O)C=C1N,0.1913
CC1=NC=NC(=O)C=N1,0.1627
c1c(onn1)OCC=O,0.2026
CC1C2C3CC3C12C,0.2827
CCCC1NC1C(C)=O,0.2225
N=C1OCC11CC2CC12,0.2789
CCNC(C=O)C(N)=O,0.2
CC1CNC(=O)C1(C)O,0.2742
CC1OC2(C)C(C)CC12,0.3137
C1CC11CC2CCC12,0.3386
CN1C=C(F)C(=N)C=N1,0.1723
O=COCC1C2CC1C2,0.2854
COc1cn[nH]c1O,0.2312
c1nc(on1)C#CC#N,0.1879
CCC1OC(=N)C(C)=C1,0.2191
CC1CCC(=O)NC1=O,0.2351
CC1COCOC1,0.3408
CC1C2(CC2)CC1(C)O,0.3251
OC(C=O)C1OC1C=O,0.2121
OC1CC23CCC(O2)C13,0.3227
CC1CC2CC1CC2O,0.3365
O=C1CC=CC2OC2C1,0.2205
CC1(OC1(C)C#N)C#N,0.292
NC(=O)C1COC2CC12,0.2569
CC1=CC(=NO)C2CN12,0.179
C1COCCC1C#N,0.3034
O=C1CC2CNC12C#N,0.2017
CC12CC3CC1C(O)C23,0.325
Cc1ccoc1C,0.2348
C1CC2(CC2)OCC=C1,0.2576
NC(=O)C12CN(C1)C2,0.2413
CCc1nc(=O)cno1,0.1825
CC1C2C3CC2CC1C3,0.3509
CC12CCC3C=CC1N23,0.2174
CC1OC2OC1C(C)=C2,0.2409
CC1(CC1)c2nnon2,0.2116
CNc1cc(oc1)C#N,0.1764
C1CC1COCCC#N,0.3045
C[NH+]1CCC1C([O-])=O,0.2582
O=CC(=O)N1C2CCC12,0.1712
CCCC1CC(C)(O)C1,0.3253
CC1CC=CCNC1=O,0.2407
CN=c1nccccn1,0.1498
c1cnc([nH]1)N2CC2,0.2473
CC1(OC1C(N)=O)C#C,0.2472
C#CC1CCN1CC#N,0.2507
CCC1(O)CC(C1)C#N,0.3051
CCC(CN1CC1)C#C,0.2942
CCC(C)OC(C)C#N,0.3002
c1c(ocn1)OCC#N,0.2304
C1C2C=CCC3OCC123,0.2486
c1c(c(oc1N)C#N)N,0.1885
N=C1OCC2CCC2O1,0.2935
CC(=NO)C(CO)C=O,0.2082
CN=C1NC(=O)CN1C,0.216
OC(C=O)C(=O)OC=N,0.2198
O=CC12OC1CC21CC1,0.2142
CCC1C2C3CC2C13C,0.3673
C1CC2(CCC1O)CC2,0.336
CC1CC11C2CC1C2=O,0.2524
CC1C=CC(=O)C11CN1,0.183
CNc1cocn1,0.2122
CCC1C2N1C(C)C2=O,0.216
OCC(O)C1=CNN=C1,0.254
O=CNC(C=O)C1CO1,0.215
CCOC1=NCCN1C,0.2664
CCC12OC3(C)C1NC23,0.3023
O=C1CCC2CN3C2C13,0.2152
N=C1NCC(=O)N1C=O,0.2131
CC1CN2CC12C(N)=O,0.2591
N=COCC1=NC=CN1,0.2279
c1c(cn[nH]1)NC=O,0.2256
COC1C(O)C1CC#N,0.2921
OC1C2C(=O)OC12C#C,0.2446
NC(=O)NC1CC2NC12,0.2939
CN=C1NN=CNC1=N,0.1883
CC12CC3C(CC13)CC2,0.346
CC12CC1(NC2=O)C#C,0.2346
CC#CC(=O)CN(C)C,0.1714
CN1C(=O)OC2CC12C,0.2912
CC1COC2C(O)CC12,0.3037
OC1CC2(CC12)C1CC1,0.3085
NC1=CNN=C1OC=N,0.2101
OCC(C#C)C(O)C#N,0.274
C#CCc1c(nno1)N,0.1889
C#CC1C2C3CN=C1N23,0.1904
CC12CN1C=CC2=O,0.1892
CC1CN2C=C(O)N=C12,0.227
c1cnc(cc1CO)F,0.2259
CC1C2CC3(CN3)CN12,0.2873
C1C2C3CC(CN12)O3,0.2982
Cc1c[nH]nc1N,0.2361
COC12CCC3C1OC23,0.2985
N=C1NC=NCCCO1,0.236
CC1CC(O)C1NC=O,0.2715
Cc1c2c(nc[nH]2)no1,0.1934
O=C1C2OC2C11CC1,0.2136
CCCN=c1[nH]cco1,0.2176
CC1(NC(=O)C1O)C#C,0.2564
CCCC(O)C1CCC1,0.3265
CC#CC(=NO)CCO,0.2031
CC1C(O)C1(C)C#N,0.3044
c1c(cnnc1O)N,0.2
C1CC1C(=NO)CC#N,0.2394
CC1(OCCO1)CC#C,0.2969
CC(C#N)C1CC1(C)C,0.3132
N=C1OCCCC2OC12,0.2583
OCC1CC=CC1C#C,0.261
CC(=O)C(=NC)OC=O,0.1698
CCc1cnc(o1)CC,0.2358
CC1C(COC1=N)C#N,0.2825
CC1(C#N)C(O)CC1=O,0.214
Cc1cc(nc(n1)C)C,0.2097
CC1(C)CC2CCOC12,0.3133
C1OC11C=CC2NC12,0.2385
Cn1c(=O)oc(n1)C#N,0.1901
CC(C)N1CCC(=O)C1,0.206
C1CC(C1)N=CNC=O,0.2283
CC1C2(CC2)C2OC12C,0.3316
CCC(CC#C)C(C)=O,0.2256
NC1(C#N)C2CC1C2O,0.2946
CC1C2CCOC12C,0.3104
CC1CC2C=CC1C2C,0.2559
N=COCC(=N)NC=O,0.2268
CCC1CC2(C)OCC12,0.3147
C1CC11C2OC3CC2C13,0.3271
Cc1cccc(c1)CO,0.234
CC1=CC2(CO)CC1O2,0.2359
COCC1CC1C#C,0.2926
CC12CC3OC(C13)C2=O,0.2008
COc1cc(n[nH]1)C=O,0.1883
N=C1OC=C2CCN12,0.215
c1cc(=O)[nH]ncc1=O,0.164
N#CC1C2C3CC1C23,0.2962
c1cc(=O)cncc1O,0.1514
CC1=NC(=O)NC(=N)N1,0.2145
O=CC(CC#N)C#C,0.2183
C1OC2C1C21COC1,0.3032
NC1(CC([O-])=O)C[NH2+]C1,0.1592
CN=C1OC(C)C(C)=C1,0.2073
CCCN=C(C(=O)C)N,0.1866
CC12C3CC(OC13)C2=O,0.2056
CCCCC(O)C=O,0.2358
NC1=NCC(O)CC1=O,0.17
COC(C)C1=CCOC1,0.2441
OC(C#N)C(C#C)C#N,0.282
CNc1cc([nH]c1)OC,0.2344
CCCC1(C)NC1C#N,0.2865
CC12NC1CC1OC21C,0.3047
CN1C2CNC(=O)C12,0.2512
CC1N2CC(=O)CC12C,0.2019
[O-]C(=O)C1OC2C[NH2+]C12,0.2477
COC(C)C1(CC1)C#C,0.2909
CC1OCCOCCO1,0.3227
CC1CC1(C)COC=O,0.2816
CNC1=CC(=O)ON=N1,0.1549
OC1C2C=CCC2C1=O,0.2108
O=C1C2NC3COC2C13,0.2008
OC(CC#C)CC1CC1,0.3017
OC1C2CCCC12C=O,0.2287
CC1COC(CC=O)=N1,0.2285
CCc1cnn(c1N)C,0.2379
c1c2c(cncn2)n[nH]1,0.1759
C[NH+]1C2CC1(C2)C([O-])=O,0.2292
CC(C)c1nccnn1,0.1632
C1OC2C=CC3OC3C12,0.232
OCC1(O)CC(O)C1=O,0.1954
CC1(C)C(NC1=O)C#C,0.2678
CN(C=O)C(=N)C=O,0.1674
CC(C#N)(C#N)C1CN1,0.2575
CC1C2C3OC1COC23,0.2997
CC12NC3C1C2OC3=N,0.2441
N#CC12OC1CN1CC21,0.2381
CC1NC1C(C=O)C#C,0.213
CN=C1ON=CN=C1O,0.1738
CC12CC3(O)C(C13)C2O,0.3182
COC1CC1OC=O,0.2593
CC1(CC1)C1CC(=N)O1,0.2899
CC(C)CC(O)C1CN1,0.3136
OC1C2CC2C(O)C1O,0.3168
COCCn1cccc1,0.2467
CC1OC1CCCC#C,0.3145
OC1CC23COC2CC13,0.2996
CC1OC1C(=O)NC=N,0.2312
COC1CN=CO1,0.2798
O=C1C2CC2C11CCC1,0.2224
C(C#N)OC(C=O)C=O,0.2039
CN1C(CO)C(O)C1=N,0.2571
OC1COCOC(=N)C1,0.2655
CCC1(C)C2COC12,0.3088
OC(C1CN1)C(=O)C#N,0.1538
CC1(C#N)C2C3CC2N13,0.2664
CCOC(=N)CCO,0.285
Cc1cc(n(c1O)C)C,0.2277
CCC1(O)COC2CC12,0.2907
CC12CC1OC2C#N,0.2568
CCCC1(CO1)C1CN1,0.3273
O=CC1=C2CC3C(C1)N23,0.1541
CC12CC3COCC1C23,0.3171
C1C2C3C4C3N1C24,0.2986
O=C1OCOC1C1CC1,0.2708
CC1C2NC2C1(C)CO,0.298
OCC(O)C(CO)C#N,0.2827
CC[NH2+]CC(=O)[CH-]C=O,0.1933
CCC12OCC1OC2C,0.2994
NC(=O)CC1C2CC1C2,0.2783
C1OC11CCCC=CC1,0.2574
C#CC1(C#N)C2CCC12,0.2709
c1c(c(nc(=O)[nH]1)O)O,0.172
OC1CC2CCC1C=C2,0.2617
CC(C)(C)CC1(C)CO1,0.3293
CN1CC1C1=NOC=N1,0.2044
COC1C2CCCC12,0.3126
CC(O)(COC=O)C=O,0.2258
ON=C1C2C3C1CCN23,0.2418
CC1C2OC1C2(C)C#C,0.2872
CC1CC2CC1(C)C2,0.3664
CC1C2CC3(CO3)C12C,0.335
CCOC12CC(C1)CC2,0.3279
O=CCC12CNC1CO2,0.2042
Cc1c2n(cn1)CCC2,0.2446
Cc1coc(c1C#C)C,0.2103
CCc1ccoc1OC,0.2278
OC12COC1C2C1CC1,0.2986
COC1C2CC1(C)C2O,0.3206
CC1CC(=NO)C11CO1,0.233
COC1CC=CC1C=O,0.2103
C#CC12NC1C1CCC21,0.2462
CC1C=CCC11CC1O,0.2635
COC1C(O)C2OCC12,0.2843
CCC1CC(C1)C(C)=O,0.2309
CC12CC3OC1(C#C)C23,0.2411
OC1(COC1=O)C1CO1,0.2593
OC1CC2C3CC2(C3)C1,0.3323
CC1C2C3C2C(=O)C13,0.2433
OC1C2COC2C1C#C,0.2752
C#Cc1cccc(n1)O,0.187
CC1CC(=NO)C11CN1,0.2325
Cc1c(c[nH]n1)CO,0.2606
OC1CC11CC2COC12,0.3002
CC1CN1CCNC=O,0.2599
CC1C2OC3C2CC13C,0.3218
OCC1=NC2(CC2)CN1,0.2392
O=C1CC2OCC3C2C13,0.2181
CC(C)Oc1ccno1,0.2355
CC(C)NC(=O)NC=O,0.2427
CC1N2CC11OC(=N)C21,0.2272
CC1=CCC(=O)C12CC2,0.2168
c1cc(cc(c1)N)C#N,0.1802
CCC1(C)COC(C)C1,0.3246
CC1OC(C=C1)C#N,0.2541
C1CN1C1C2C3CN3C12,0.2832
CC(N)C(=O)N(C)C=O,0.2192
COCC12CCC1CC2,0.3299
CC(C)(CCCO)OC,0.3246
CC1(CC#N)OC1C#N,0.2922
CC1CC2CC2C1C,0.3337
CC(=O)C1(CCCC1)C,0.2285
c1cnn2c(n1)ncn2,0.1815
CCC1(C)C2OC2C1C,0.3342
CC1CNC(=O)NC=C1,0.2306
[NH3+]CCC1=N[N-]C(O)=N1,0.2576
CCC1(O)C2CCC12O,0.2744
CC1CC1C1=COC=N1,0.2383
COC(C)CCCO,0.3303
C1C(=NO)C=CN1,0.1751
OCC#CC1CN1,0.2581
Cn1ccc(=O)nn1,0.1702
CC1=CC2C3CC3C2C1,0.2582
COC(C#N)C(F)(F)F,0.3027
Cc1nc(on1)OC=O,0.2389
CC1=CC(O)C(C1)C=O,0.2242
C#CCC#CCC1CN1,0.2808
CC1(C)OCC=CC1O,0.2501
C1CCC(C1)(C#N)N,0.2954
OCC12CC(O1)C1OC21,0.3177
OC1C2CC(C#N)C12O,0.2885
COCC(C#C)(C#C)O,0.278
CC12CC(O1)(C=O)C2O,0.2104
CCC1C=CC(O)C1C,0.2601
C#CC12CC(O1)C21CC1,0.2497
O=CC12C3C1C1C3CC21,0.2253
Cc1c(c([nH]n1)CO)N,0.2188
CCC#Cc1n[nH]nn1,0.2181
Cc1[nH]c2c(n1)NCC2,0.2041
C1COC(=O)CO1,0.2619
CC1OC2C1OC2=N,0.2646
C#CC#Cc1ccn[nH]1,0.1782
NC(C([NH3+])C#C)C([O-])=O,0.2425
CCC1CCOC1=O,0.2747
N=C(OC=O)C1CCO1,0.2425
CC1C2C1C1(CO)CN21,0.2878
CC#CCc1cnon1,0.2201
C1C=CC(=NCC#N)O1,0.2116
O=C1OC2C(C#N)C12,0.2685
CC1OCC2CC1C2O,0.3226
CC1(O)C(O)CC1=NO,0.2483
COCC1CCOCC1,0.3329
C#Cc1cc(on1)C#N,0.2016
ON=C1CCNC1C=O,0.2061
CC12CC(COC1)C=C2,0.2482
CC(C)OC1CC(=O)C1,0.2209
CC1(C)C2C3OC3CN12,0.2811
C1C(COCO1)NC=O,0.2724
OC1(C#N)C2CC2C1=O,0.2102
N#CCC1C2CN1CC2,0.2758
CCC1(C)CC(C)O1,0.3193
O=C1NC2=CCN3C1C23,0.19
C1C2N1CC21CCCO1,0.3018
C1OCC2COCC12,0.3137
C#CC1=CCCC1,0.2099
CCOC1(CN(C1)C)C,0.288
CC1COC2CC1(C)C2,0.3112
OC12CC(CC1)C2=O,0.2258
CC(=O)OCCCO,0.2852
CN1N=NC=C(F)C1=N,0.1676
CC(O)C12C3C4C1N4C23,0.2703
N=C1CC2=C(ON=N2)O1,0.1688
C1C(CN1CCO)C=O,0.1975
CCCCC(C)C#N,0.3499
CC(C)CCC1CCC1,0.3653
CC1C2C3OC1CC23O,0.2938
CCC1C2OC(C)(C)C12,0.3161
c1conc1O,0.2518
N=C1OC2C3CC(O3)C12,0.2843
N=C1C=NOC(=O)N=C1,0.1736
CC1CC2OC=NC2C1,0.2719
CC12CC3C(O)C1C23C,0.3149
c1c(=O)occ(n1)CO,0.1656
CC12C3OC1(C)C=CC23,0.2279
CC1NC1C#CC=O,0.2014
CC(=O)Nc1cnno1,0.2077
O=C1C2CCC1CC2,0.2223
CC(C)CC1CC(=N)O1,0.2896
CCC(O)C(N)=O,0.2781
OCC12CC1OC2C#N,0.2599
CC(=O)C(C#C)C1CN1,0.2218
CC(=O)c1ccn(n1)C,0.205
CN=C(C(=O)CCO)N,0.1901
CC1(C)CC2C3CC1C23,0.3318
CC1OC2CCC(C)=C12,0.2395
C(CCO)CNCC#N,0.2707
O=CCN1C2C3CC2C13,0.2071
CC1OC2(C)C1NC2=N,0.2557
CC(C)(C)C1CCC1=O,0.2182
CC(=NO)C(=O)N1CC1,0.2016
CC12C3C1C1=NC3C2O1,0.2203
FC(F)(F)C12CC1CN2,0.3087
CC12CC(O1)C2OC=N,0.2763
c1c2n(nc1O)CC2,0.2403
CCC1(CC2CC12)C#N,0.311
C1C2C1C1OCCCC21,0.3152
C1CC(C1)N2CC(=O)C2,0.2057
COC12CC1(NC2)C=O,0.1809
CC1(O)CC1C1(O)CC1,0.3109
C#CCCOCC=O,0.2287
COCC(CC=O)C=O,0.214
C1CN(C1)CC#CC=O,0.1726
COCC1CCC(C)=C1,0.2586
CC1=C(COC1)CO,0.2488
CC12CN3C1CC23CO,0.3146
CC1(C=O)C2C3OC3C12,0.2183
C#CCOCC(=O)N,0.2672
CCC(OC(C)=O)C#C,0.2821
O=CC1=CC(NC1)C#N,0.1727
O=C1COCCNC=C1,0.1756
OC(C#C)C1OCCO1,0.2846
O=C1NCC=C2COC12,0.2254
C#CC12CCC(C1)C=C2,0.255
CC(N)=[NH+]CC([O-])=O,0.2533
C#CC1(CN1)C1CCC1,0.276
CC1(O)C2C1C1CC2C1,0.3091
CC12CC1COCC2O,0.3101
Cc1c([nH]nn1)C(C)C,0.2432
COC(=O)C1CC(C)N1,0.2328
COC12CNC1C2C#N,0.272
O=CCCC1OCC1=O,0.2094
COC1C(NC1=N)C=O,0.2097
c1c[nH]c2c1N=COC2,0.1946
CC12OC1CC1CC2O1,0.3204
CC12C3C=C4CC(C13)C24,0.1761
C(C=O)c1c(onn1)N,0.1764
NC1C(O)C1(C#N)C#N,0.2448
CNC(=O)C(O)CC#C,0.2733
Cc1c(c(co1)C#C)N,0.1915
OC1CCC(=O)C2OC12,0.2132
c1c2c(n[nH]1)COCC2,0.2533
CC1(C#C)C2C3CC1N23,0.2929
OCC1=CC2COC2C1,0.2575
CCCC(COC)C#N,0.3056
CC1C2OC2CN1C=O,0.2683
CC12CC(C)(O)C1(C)N2,0.2913
OCCN1C2CCCC12,0.3059
CC1NC1C#CC1CN1,0.2567
Cc1ccc(c(c1)F)N,0.2028
CC#CC1(CC1)C#CC,0.2593
CC(=O)N1C2C3CC3C12,0.2364
C1C2CCCCC1O2,0.3177
CN1C(CCO)C1C#N,0.2621
CC1CC(=O)COC1=O,0.2226
N#CC1(CC2OC12)C#N,0.283
CN1CC(C#C)C1C#C,0.2502
CCC(CC=O)C1CC1,0.2274
CC(=O)Cc1cc[nH]n1,0.2226
CN1CC(=N)OC(=O)C1,0.2248
CCC1OC(=N)C1CC,0.2884
C#CC1=CC(=NO)CN1,0.1457
CC(O)C1(C)C2COC12,0.3042
CCC1(C)OC=NC1C,0.2712
CC(C)(C)[NH2+]CC([O-])=O,0.2657
CC1(CCC1=NO)C#C,0.2459
OCC(=O)C1(CO)CO1,0.2152
c1c2c(oc1N)OCC2,0.2157
O=C1CC2COC1OC2,0.2077
CC(O)C1=CNC=C1,0.2489
C#CC(C#C)(C#N)N,0.2595
O=C1CC2C3C(CN23)N1,0.2606
CC1NC1(C#N)C(N)=O,0.2651
CC1=CNC(=O)NC=C1,0.171
NC(=[NH2+])C1=C[N-]C(=N)O1,0.1413
c1ccn(c1)CC#N,0.2276
CC1=C(F)NN=NC1=N,0.1664
C1COCCC(=O)C1=O,0.1824
c1conc1NCCO,0.2217
CC12CC3NC1(C#N)C23,0.2428
CC1OC2(CNC12)C#N,0.2477
COCC1C(C#N)N1C,0.263
Cc1ccncc1NC,0.194
COC1CC(C)C1(C)C,0.3233
c1nc2n(n1)nc(o2)N,0.2389
CCC1(O)C2NC1C2O,0.2929
CC(=N)OC(=O)C(N)=N,0.2074
CCNC(=O)C(N)C#N,0.2561
C1CCOCC2(C1)CC2,0.3161
c1c(cnc(n1)F)N,0.1822
O=CC1C2CC1(C2)C#N,0.2196
C1c2c(non2)NC=N1,0.1988
Cn1c(c[nH]c1=O)CO,0.2264
C1NC23CNC12C1OC31,0.2644
CC12CCC1OC(=O)O2,0.3335
C(CCC#N)CC#N,0.3476
O=CCOC1CCC1=O,0.2032
CC12OC1CC(O)C=C2,0.2448
OC12C3NC3C3C1CC23,0.3027
c1(nc(oc(=O)n1)N)N,0.2305
CC1C=CC(=NO)C1O,0.1943
OC1(CC=O)CC1C#N,0.2217
CCOCC1C(O)C1O,0.2845
CCOC1C(C)OC1=O,0.2515
CNC(=O)C(=O)N1CC1,0.1978
OC1CC1C1NCC1=O,0.188
CN1C2COC(=N)C12C,0.2545
CC12CC3(CO3)C1(C)N2,0.2952
CC(=O)C1(CC1)CC#N,0.2329
CC12C3CC4(C)C1N4C23,0.295
Cc1c(nno1)OC,0.1968
CC#CCC(CO)C=O,0.2142
CC1C2CC=C(C=O)C12,0.1896
CC(=O)Nc1[nH]ccn1,0.2009
COC1CC1C(=O)CO,0.2398
CC(O)C1C2C(O)CN12,0.2896
N#CC1C2NC1C2=O,0.2498
CN=C1OCC2CC1O2,0.2578
CC1=CC(=N)OC(N)=C1,0.167
NC(=O)C12CC1CC=C2,0.2388
Cc1c(oc(=O)o1)OC,0.2522
COC(C)(CO)C(C)=O,0.2146
CC(C)CC1CO1,0.3512
CNC1C(=N)OC1(C)C,0.2509
c1cc2c([nH]nn2)nc1,0.2002
CC1C2C3N2C1C31CO1,0.3188
CC1(O)CC2OCOC12,0.3148
O1C2C3C2N2C4C1C4C32,0.257
Cc1cc(on1)OC,0.2407
CCC1CCOC(=N)O1,0.289
CC1(CO)C2OC(=O)C12,0.2726
C(OC1CC1)C1CCO1,0.3228
OC1C2N=C3NCC3C12,0.2325
CC1C2N=COC12C#N,0.2532
CC1C2CC3OC2CC13,0.3317
C1CC1N2CC(=O)C2,0.2086
OC1CC(CC2CO2)C1,0.3298
COC1CC2COC12,0.2898
CC1=CC2OC2CC1O,0.2352
COC12C(C)C3C1OC23,0.3002
CNC12CN=C3OC1C23,0.1693
c1nc2c(o1)C(=O)C=C2,0.1329
C#CCC1=CNC(=O)C1,0.2104
CC#CC(=O)C(=N)NC,0.1486
CC12C=C3CC4C3C1N24,0.1775
CC(C)C(O)C(C)CO,0.3236
COCC1C2CC(C)N12,0.3017
CC1C(C)C(C#N)C1O,0.295
CC(CC(N)=O)OC=N,0.2711
OCC1C(O)COC1=N,0.2663
c1cnc2c(n1)non2,0.1555
Cc1cc(=O)cco1,0.1988
N=C1C=COC=CC1=N,0.1866
O=C1C=CC2CCCN12,0.208
CCC(C)CCC(C)C,0.3743
CC12CC3CC1C3C2=O,0.2272
C#CC1NC1C1CO1,0.2783
C1COC1(C=O)C=O,0.1876
Cc1cc(co1)C(C)C,0.2353
CC#CC1COC11CC1,0.2724
CC1=CC(=NC)OCC1,0.2062
CC(O)(C#N)C(O)C=O,0.2281
Cc1cc(no1)COC,0.245
CCC1OC(C)(C)C1O,0.3012
N=C1OCC(=O)C1C=O,0.2056
C1CC2C=CC1C=C2,0.239
O=CC1(COCO1)C#C,0.2118
CC1CC(O)C(=O)O1,0.2743
CC1OC11C2C3C1CN23,0.3259
CCn1cc(cn1)C,0.2534
CC12CCC1=CC(=N)O2,0.205
CCOc1ncnnn1,0.1657
CCC12C3CC1CCC23,0.3206
COC1CN2C(C#C)C12,0.2665
Cc1ncc(=NC)[nH]n1,0.151
CC12CC3CC1C2C3O,0.3223
CCC1(CO)CC(=O)N1,0.2826
CC1OC2=CON=C2O1,0.2301
CC1(C=CCC1=O)C#C,0.2135
CCC1CC2(OC12)C#N,0.2736
OCC1=CC2OC1C=C2,0.201
C(CC#N)C#CCO,0.2765
CCC1OC2C(C)OC12,0.3114
CC1CC(CO)C2CN12,0.3022
CC12CN1CC21COC1,0.2985
Cc1c(nn[nH]1)N2CC2,0.2353
CC1C2C3CC1(O)C2O3,0.3039
C1OC2COC1C1OC21,0.3244
O=CC1C2C3CN=C1N23,0.1913
CC1C2C(O)C(O)CN12,0.2776
c1c2c(nco2)on1,0.2076
CC(O)C1C2CC(O)C12,0.2978
C#Cc1cnc(cn1)F,0.1884
COC1CC2(CC2C)C1,0.3252
CC12CC3C(C1)C23CO,0.2994
CC1=CN(CC1O)C=O,0.2082
CCC12CC1C(O)CC2,0.3282
N1C2C1C1N=CN3C2C13,0.2367
CC1OC(C#N)C1(C)C,0.2754
CC(=Nc1ccno1)N,0.1841
COC1C2C3CC3C12,0.2803
c1cn(cc1O)C(=O)N,0.1928
CCC1(C)CCC(=O)N1,0.2731
CC1C2C(O)CC12O,0.3109
COC(C)(C#N)C(C)C,0.3002
NC1(CC1(O)CO)C#N,0.2645
C1C2NC22CC1OCC2,0.3101
CC(=O)N1CC1CCO,0.2414
C1C(CO1)OCC(=O)N,0.2678
C#CC1(CC1)C#CC=O,0.1942
C1NC1C12CC(C1)CO2,0.3101
CC1=COC(F)=NC1=N,0.2138
c1[nH]c(c(n1)C#N)C=O,0.1822
N#CCC1OC2CCC12,0.2923
CC1(CC=CC1)C1CO1,0.2657
CN=C1OC(=O)C(N)=C1,0.168
N#CCC12CC3C(C1)N23,0.282
CC1C=CC(C#C)C1=O,0.2153
c1cn(cc1C#N)C=O,0.189
CC12OCC3C1CCC23,0.3112
CCn1c(nc(n1)O)O,0.2564
CC12COCC1(N2)C#N,0.2863
O=C1OC2COC12,0.2484
CC1=CC2N(CC2=O)C1,0.203
CC(C)N=C(C)OC,0.2773
CC1C2C1N1C(C)C21,0.2748
C1OCC2OC1CC=C2,0.2526
COCC1CC2C(O)C12,0.3181
C#CC12CC(C1)C1CN21,0.2766
CC1(C)CCC2C(O)C12,0.3051
OCC1C(O)CC11CC1,0.3025
CCC1CC2OCC=C12,0.2362
CC(=N)OC(C#C)C#N,0.2679
CCOc1nc(no1)N,0.2487
CC#CC12CCC1(C)N2,0.2466
OCC1C2OCC2C1=O,0.2126
OCC1=CC(=N)NC1=O,0.1922
CCc1cnco1,0.2423
O=C1CCCC(C1)C#N,0.2213
CC1OCC11CC(=O)O1,0.2669
O=COC1C2C3CC2C13,0.2855
Cc1c(c(n[nH]1)O)OC,0.2362
CCC(=O)C(C)OC=N,0.2282
OC1C2NC(=O)C1C=C2,0.2163
c1c(cn[nH]1)NCC=O,0.1735
CCC1C2OCC12C#C,0.263
CC1NC11CCC11CN1,0.2829
C1OC23CC4OC12CC34,0.2934
O=CC1C2NC2C1C=O,0.2004
CC(C)c1ccn(c1)C,0.2445
CC1CC2CC2(CO)O1,0.3137
CCC(NCC#N)C=O,0.2118
CC1=CC2C3CC1OC23,0.2399
OCC(O)CC1CC1O,0.3242
CC1C2(CC2)C2NC12C,0.2971
C1CC23OCC2CC13,0.3013
N=C1NC2CC1OC2=N,0.249
CC1=CC2(C)CC(C2)C1,0.2483
c1c(=O)oc(c(n1)O)N,0.132
CC1CN1CC1CC1O,0.2932
CCNC(=O)C(=O)CO,0.1799
CC1CC=CC11CCO1,0.2506
CN=c1ccnccn1,0.1435
Cc1coc2c1onn2,0.1903
CC1C2OC(C)C12C#C,0.2634
Cc1nc(co1)C(=N)N,0.21
OC12C3CCC1CCC23,0.3169
C1COCC=CC(=O)N1,0.2077
CC(=O)C#CCC(=O)N,0.1925
CC12C(CO)C3C1CC23,0.3359
CC1(NC1CO)C#C,0.2732
COC(=N)CC(O)CO,0.2868
CC1=NC(F)=NOC1=N,0.1639
N=C1CNC=CC(=O)O1,0.1949
OCC1CC(=O)OC1=N,0.2437
c1cn(cn1)C2CC2,0.249
CC1C2CC1(C#C)C2C,0.2982
OC12CC3C=CC1CC23,0.2417
CC1CCN=C(CO)O1,0.2755
CC1C2[NH2+]CC12C([O-])=O,0.1598
C1CN(C(=O)N1)C(=O)N,0.2641
CC(O)C1(CC#N)CN1,0.2965
C(C=O)C#CCC(=O)N,0.2069
OC12CC3C1C2C3=O,0.2435
CC#CC1C(C)C1O,0.2793
CC(C)(C(=O)C#C)O,0.2018
CCCC(C)(C)C(C)C,0.3643
CC1C2CCC12C1CO1,0.3233
CC1COC(=O)CO1,0.2611
C1C=CC(=O)N1,0.2166
OC(C=O)C#CC#C,0.1968
O=C1OC23CN4C2C1C34,0.2424
C1C2CC3OCC3OC12,0.3051
CC1OC2C=CC3C1C23,0.2254
CC1C(O)C(C)(C)C1O,0.2991
CC1=CC2(O)CC1(O)C2,0.2366
C(C=O)C#N,0.23
CC12OC3CCC1OC23,0.3068
C1CCC2(C1)CCC2=O,0.2186
CN=C1OCC11CC1O,0.2615
C(C(CN)(C#N)O)N,0.2786
N=C1CC2(O1)C1CCC21,0.2743
CC12CC(CO1)OC2=O,0.2541
CN(C)CC(=O)C1CN1,0.198
CNC(=O)NC(C)CO,0.2958
N=C1NC(=O)N=CC=N1,0.1571
c1cn[nH]c1C=O,0.2003
CC#CC(C#C)C(C)O,0.2793
c1ccnc(c1)CCO,0.2227
CCC1OC2C(C#C)C12,0.2772
C(=O)Oc1[nH]c(=O)[nH]n1,0.205
Cc1cc([nH]c1N)CO,0.2212
Cc1c(nn(n1)C)C#N,0.228
Cc1c[nH]c(=O)cn1,0.1656
CC(NC=O)C(=O)C=O,0.1465
OC1C(O)C2C1OC2=N,0.2639
[NH3+]C(C1COC1)C([O-])=O,0.2567
OC1(CC(=O)C=C1)C#N,0.1875
CC1CCC(C)(CO)O1,0.3195
CCCC1CC1C1CO1,0.3478
CC1(O)CC2OC2C=C1,0.2378
Cc1cc(nc(=O)[nH]1)O,0.1964
CC1CC2OCC2C1O,0.302
OCC1=CC(=O)ON=N1,0.1698
C1C2C1C1C=CC3C2C13,0.2338
COC1CC(C)C1CO,0.3193
OC(CC1CO1)C1CN1,0.308
NC(C#N)C1=NCCO1,0.2564
O=C1C2OC2C2CN12,0.2181
CCCCc1ncco1,0.2443
CC(CCC#N)C#N,0.3361
C1COc2c(n[nH]n2)O1,0.2225
CC(C)C1CCO1,0.3199
COC1(C)CCC(=N)O1,0.2899
CC(C)c1cnccn1,0.1982
N=C1CC(=O)CC(=O)N1,0.2197
O=CC12CCC(N1)C2=O,0.2064
CC(=N)N(C)C(=O)C,0.2392
CNc1ccc(n1C)O,0.2317
ON=C1CC2C3OC3C12,0.2454
CC1N=C(N)C(O)C1=O,0.2043
CC1(CC(=O)N(C1)C)C,0.2709
CC12CCC1(O)CC2=O,0.2172
CC1OC2(CC2)C1O,0.2958
CC12CC1(C)CC(O)C2,0.3279
CCC1CC2NC1C2=O,0.2305
OC12CC3C4CC(C14)C23,0.3179
CC1CN1C(=O)CCO,0.2563
CC1(C=O)C2CN=CN12,0.2075
CN=C1NN=CC=C1N,0.1659
COC1C=CC2OCC12,0.2437
C1CC(C1)C1C2CC1C2,0.3707
CC(O)CC(C)=O,0.2299
CC1COCC=CC1C,0.2622
Cc1coc2n1ccn2,0.2255
C1CC(C1)OC(=O)N,0.3226
Cc1cc2c([nH]1)nc[nH]2,0.2034
COC1OCC(=O)C1O,0.2066
CCC12OC(C1C)C2O,0.3015
CCC(CNC=O)C=O,0.2102
c1coc(=O)c(c1N)N,0.1667
CC1(CCC1)CCO,0.3394
Cc1c(ncnc1O)N,0.2237
CC1OCC(=N)NC1=N,0.2389
C1CC11CCC11CO1,0.3249
c1[nH]cnn1,0.2715
CC(C)C1(C)OC1C#N,0.2903
OC12CCC1C2(O)C#N,0.279
NC(C#N)C(CO)CO,0.2818
CC1CC=CCCC1O,0.2579
CC1=C(C)C2CC3C2C13,0.2328
O=CC1(CO1)C1CC1,0.2201
OC1CN2CC2C2CC12,0.2809
CC#CCC1NC1C,0.299
N=C1ON=CC=NC1=O,0.1673
CCC(C)(O)C1OC1C,0.3393
COC(=O)C12CN(C1)C2,0.2312
N=C1OC2CCC12C#C,0.2766
C1CC12CC(=O)C=CN2,0.185
CC(=O)C#CCOC,0.2092
CC1CC(N)C(=O)O1,0.2537
CC12CC1(O)COC2,0.3202
CC1C2C=CC1C2C=O,0.2004
CC1(C)CCC(C)(O)C1,0.3268
C#Cc1c(c[nH]n1)C=O,0.1996
N=C1OC2CC3CC12O3,0.2639
C1C2C3CC4C1C2N34,0.2787
OCC#CC1OC1C#N,0.2526
OC12CC3CC1C3C2=O,0.227
C1C2C3C4C3C1COC24,0.3222
C1CC11C2OC2C11CC1,0.33
CC(=O)C#CC(O)C#C,0.2063
CNc1cc(ccn1)O,0.2065
CC(C)(C)C1CN=CO1,0.2709
OC1CC11C2C3CN2C13,0.2903
CC12C3C1C1=CCN2C31,0.1568
OCC1(COC=N)CC1,0.267
CNc1cccc(=O)o1,0.1661
C#Cc1c(non1)CO,0.2138
COC1(COC1)C#N,0.2772
CC1CC(O)C1C#N,0.2986
CC12CC(C)(C1)C2C#C,0.2953
OC1C2CC1(O)C2C#N,0.2975
CC1=CC2COC(C2)C1,0.2535
OC12CC(C1)(C=C2)C#N,0.2404
CCCC1CC1CCC,0.3508
CN=C1COC(=O)N1C,0.2465
OC1CC2CN2C2CC12,0.2913
NC(CO)C(CO)C#N,0.2797
CC1(O)C2NC1C2C#C,0.2791
C1OCC1C1CC2OC12,0.317
CC12C3CC1C(O3)C2=O,0.2091
CC1=CC(=O)C2(C)CN12,0.191
OC(C#C)C12CC1CC2,0.2837
NC1(CC(O)C1O)C#N,0.2916
C1CN=C(OC1)CC=O,0.2303
O=C1CC2C3CC3CC12,0.2176
CC(CC1OC1C)C#N,0.3133
OC12CC1C=CC1OC21,0.2339
CC(O)C(=O)C=O,0.1579
O=C1C=CC2CC2C1=O,0.1459
CC1CC(C)C1C#C,0.3031
OCCC1CC11CCC1,0.3363
CC1C=C2CN3CC1C23,0.2033
CC#CC1COCO1,0.2827
CN=CNC1=NCCO1,0.2314
CC1(O)CC(=O)C2OC12,0.2141
NC1=NC2C3OC1C23,0.2261
C1NC2=NCC3OCC123,0.2459
CC1C2C(O)CC12CO,0.3147
C1CC2COCC1O2,0.3145
CCC1NC1C(=O)C=O,0.1504
CCN(C)C(C)C#N,0.2656
N=C1OC2CC2NC=C1,0.188
CCC12CC3COC1C23,0.3091
CC1(O)CC1(C)C1CC1,0.3165
O=CC1(C=O)C2CC1C2,0.1909
CN=C1NN=NC(N)=N1,0.1548
NC(=O)OC=N,0.2767
C1C2C3C4CCC3C4N12,0.318
O=C1OC2C(O1)C2C#C,0.2851
OC1CC2C(C=O)C12O,0.2191
c1c(=O)c(n[nH]c1N)O,0.1921
COC(=O)C1OC1C#C,0.2535
OC1(C=CCC1=O)C#N,0.2101
NC(=O)C12OC1C1NC21,0.2298
CCCC12CC(O1)C2O,0.3298
CN1CCC1C#CC#C,0.2056
OCC1CC(=O)CC1O,0.2232
C(#N)c1c(c(on1)N)N,0.1858
N#CC12CC=CCC1O2,0.2631
c1c(nco1)OC=O,0.2323
OC12CC3C1N(C=O)C23,0.2512
CC12OC1COCC2=O,0.2074
O=C1C2OC2C11CO1,0.2015
C1C2CC3CCCOC123,0.3157
CC1(CC1)C2CCCC2,0.3369
c1[nH]nc(n1)C2CCC2,0.2596
CC(O)C(=N)NC(N)=O,0.2481
COC1CC1C(C)CO,0.3132
CCC1C2OCC12C=O,0.221
CCC1CC1C(C)OC,0.3264
Cc1c(c(no1)N)C=O,0.1799
CC1OCC2(O)CC12C,0.307
COC(=O)C1(C)NC1C,0.2586
CC1CC2C3CC2(C)C13,0.3619
COCC1COCC1=O,0.2178
C(CNC(=N)C=O)C#N,0.1729
CC1CC1C(C)(C)C,0.3366
CC12OC1C1(CN1)C2=O,0.2017
COCC(=O)C1CC1,0.2345
CC#Cc1ccncn1,0.1964
C#CCn1ccc(n1)N,0.2274
CC1C(O)C2=CC=CN12,0.2411
CN1C2CC3COC2C13,0.296
CCC1(C)CC(C)C1,0.3543
CCCC1(CC)OC1C,0.3291
CC1(O)CC2(O)C(O)C12,0.3015
OCC12NC1C(O)C2O,0.3085
O=C1CC2CC11CCC21,0.2249
CC#CCCCOC=N,0.2698
OC12C=CCC1OC2=O,0.234
NC1(C#N)C2CNC12,0.2497
CC(C#N)(C#N)C1CO1,0.2874
CC1(O)CN2CC=CC12,0.2257
CC1C2C(=O)C=CC12C,0.184
c1c(ncnn1)C#N,0.151
CC1CCC2(C)OC2C1,0.3373
CCC1CC1C(C)C#N,0.3256
N#CC1OC11CCCC1,0.2858
CC12NC1C1(O)CC21O,0.2633
NC1=CN=CC(=N)O1,0.1546
CC1C2CC1(N)C(=O)O2,0.2594
CCC1(C)C2C3C1CN23,0.3133
CC(CO)C1NC1C#C,0.2777
CN1C=C(F)C=NC1=N,0.1476
O=C1CNC2C3CC2C13,0.2087
c1cc(cc(c1)F)CO,0.2294
OC1C2C1C1=NC=NN21,0.2426
COC1C2(O)CCC12O,0.2938
OC12CC3OCCC1C23,0.3171
C#CCC1C2CCOC12,0.3003
C#CC1(CCC1)C(=O)N,0.2627
C#CCN=c1onno1,0.1973
C1CC=CCCOC1,0.2586
CC12C=CC3OC1CC23,0.2435
CC1CC2(CC#C)NC12,0.2728
[O-]C(=O)CC1C2CC1[NH2+]2,0.2631
CC1OCC2CCCC12,0.3117
CC12OC3OC1C2C=C3,0.2351
OCC1CNC(=O)CO1,0.266
CC1C(C#C)C1(C)CO,0.2871
COC(C)C(=O)C(N)=O,0.1754
CC1C(C2CC2)C1(C)O,0.3155
C1C(CO1)CCC#N,0.2878
C1OC11COCCC=C1,0.2446
CCC1CC2OC1C2C,0.3309
CC12OC1C1OCCC21,0.3079
CCCCC#CCCO,0.3036
COC1C(O)C2CC12O,0.3193
CC12CC1N(C=O)C2=O,0.2247
CC1OC1C(O)C#N,0.2831
c1coc2c1NCC2=O,0.1737
CC1OC(C)(C)C=C1,0.2486
c1c2c([nH]cn2)no1,0.2005
OC1C2CC1(O)C1NC21,0.2921
CC1C2CC1(OC2)C#N,0.2714
C#CC(C#C)OC(=O)N,0.2714
C1COC(=O)CN1,0.2407
CCC#CC(=O)NCC,0.2337
CNC1=NCC(OC)O1,0.2802
C1C2CN=C3OCCC123,0.2668
OC12CCC1OC2C=O,0.2149
CC1C=CC2(O)CC12O,0.2415
CC1(C)OC1CN1CC1,0.3238
CC(O)(CC=O)C#N,0.222
CC12CC3CC(=CC1)C23,0.2178
OC(C#N)C12CN(C1)C2,0.2464
O=C1CN2C(CC12)C#N,0.2129
CCN(CC)C=O,0.2717
CCC1OC(=O)C2NC12,0.2519
CC(CO)C1CN1C=O,0.2518
CN(C)C=O,0.2751
CN1C(C=O)C1(C)C,0.1947
CC1OCCC2(O)CC12,0.3228
CC1CC1C(C)(C)C=O,0.2256
COC1=NC(C[NH3+])=N[N-]1,0.2522
COC(C)(C#N)C1CC1,0.2984
N=C1CNC2CCC2O1,0.2634
NC(=O)C12CC=CC1N2,0.2334
c12[nH]c(nn1nnn2)O,0.256
CC1(CO1)C(N)C#N,0.2869
C1CC(C1)(C2CC2)O,0.3184
OC1C2C3CN3C2C1=O,0.186
OC1C[NH2+][C-](C=O)C1=O,0.1947
C1C2CC1C1=C2CCC1,0.2305
CC1C2CC2(C)OC1=O,0.2755
CC#CC12CC1CCC2,0.2807
CCC1N=COC1CO,0.2638
CC12NC1C=CCC2O,0.2378
CCN=C1OC=NC=C1,0.1755
OC1C2CC3(CO3)C12,0.3336
c1ccn(c1)CCC#N,0.2318
CC12CC1(C)CCCC2,0.3305
COC1(CC1O)C(C)C,0.2972
CC12COC1C(C2)C#N,0.2853
OC1CNC2=C1C=CN2,0.2284
CC12NC1CCN1CC21,0.2894
Cc1nc2c[nH]cc2o1,0.2036
OCC1C2CCC12CO,0.3054
CC1C2C1C1(C)C(C)N21,0.2767
N=CN1CCCNC1=O,0.2521
CC#CC(C)([NH3+])C([O-])=O,0.2634
CN1N=NC(=N)N=C1F,0.175
C#CC1COC1C#N,0.2751
CCC1OC(C)C=C1,0.2475
CC12CN1CC21CO1,0.3131
Cc1c(nc[nH]1)C(C)C,0.2434
c1c(nc([nH]1)C#N)CO,0.2038
CC1(O)CC(N)=CC1=O,0.2047
CCNC12CC1OC2=N,0.2503
CNC(N)=[NH+]CC([O-])=O,0.2602
O=CC1OCC11CCC1,0.2128
OC12CC1N=COC2=O,0.2215
C1C2OC2C2=C1C=NO2,0.2253
CC12CCC(O)C1C2O,0.3022
CC1N2C3C4C3C1(O)C24,0.2844
CCNC(C#N)C1CO1,0.2774
CCCC1CCCOC1,0.3277
CC1(O)CCN2CC2C1,0.275
CC1OC1CCC#N,0.3124
CC12OCC1C2C(N)=O,0.2545
N=COC12CC1C1CC21,0.2445
CC(C)c1cn[nH]c1N,0.2405
CC1CCN2CC(=O)C12,0.2016
COC(C)CC(C)=NO,0.2529
CC1=NON=C1OC=N,0.2264
CC12CN3C4C(C13)C24O,0.2748
CC(C)C12C3C4C(C13)N24,0.2814
CN(CCO)C(=O)CO,0.2566
c1(nnon1)OC(=O)N,0.2303
O=C1C2C3C(C#N)C2C13,0.2383
CCCC(C)C1CC1O,0.3319
FC(F)(F)C1NCC1=O,0.2191
CCNc1cc(n[nH]1)O,0.2395
OC(CC#N)(C=O)C#C,0.2163
CN1Cc2c(ocn2)C1,0.2146
CC(=NO)CCC(=O)C,0.2252
CC1CN(C)C1(C)C=O,0.1819
c1c2c([nH]c(=O)[nH]2)[nH]n1,0.2177
COCC(O)(C=O)C#C,0.2097
COC(=O)CC1(C)CO1,0.2765
CC12CC1OC=NC2,0.2698
COC1CC1(O)C(C)=O,0.2288
OCC1C=CCN1C=O,0.2468
c1c2n(nn1)CCC=C2,0.1929
COCC1(CN1)C=O,0.2209
CCOCc1cc[nH]n1,0.2652
O=C1C2C3CC(N23)C1=O,0.1463
CN1C(=O)C2N3CC12C3,0.2202
CC(C)(C)CC#CC#C,0.2295
CC12CC=CC11CC2C1,0.2471
CC1(C)CC1(O)CC#C,0.2908
CC(C)Oc1cc[nH]c1,0.2366
CC1C=CC2CC1C2,0.2521
CC1CCCOCOC1,0.332
CC12COCC1CC2O,0.3207
CCc1c(cno1)NC,0.1984
O=CN1C2C3C=CC1C23,0.2162
C1NC1C12CC(CC1)O2,0.3135
CCC1CC23CC(C2)C13,0.3052
CN1CC(=O)C1(C)C#C,0.2013
CCN=C1CC(O1)(C)C,0.2771
O=C1CC(CO1)C1CC1,0.2778
C1C2C3OC4CC2N1C34,0.3078
C1C2OCC=CC1C=C2,0.2454
C1C2CC34COC23C1C4,0.2846
CC1CCOC(=O)C=C1,0.2199
CC1CC(C)C(C)C1C,0.356
C#CC1CCC11CCC1,0.2976
C1CC2C1C21CC2NC12,0.3068
CC1CC2=C(N1)C=CN2,0.2133
COCC(C)OC(C)=N,0.2873
OCCC1C2CCCN12,0.2936
CCC1(CO)CC(=N)O1,0.2859
OC1(CC11CCO1)C=O,0.1993
OCC1CC1OC=O,0.2629
COC1C2C3C1CC23O,0.3155
CCCC1OC2CC12,0.321
O=CCC1C2C3C1CN23,0.2154
CCN1CC(=O)NC1=N,0.2262
CC(C)C(=O)CO,0.2384
CC12C3CC1C3C2C#N,0.3266
CCC1(CN1)C(N)=O,0.2646
CC1OC1C1=NNN=C1,0.2403
CC1C2CCCOC12C,0.3163
OC1CCC2C3C1CN23,0.2886
CCCC12CC3C1N3C2,0.3041
CC1C2COC2C1(C)O,0.3049
CC(=NC(C=O)C=O)N,0.1948
CC12C3NC3C1OC2=N,0.2705
CC12C3CCC(N13)C2=O,0.2251
CC(C)N1C=NCC1=N,0.2162
CC12C3CC3N1C2C=O,0.1964
CC1C=CCCC=C1C,0.2479
CC(C)C(C)N(C)C=O,0.2712
c1c[nH]c2c1C=CC2,0.1926
C(C=O)C(CC=O)O,0.2172
O=CC1=CCOC1C#C,0.1895
CC1(C)C2C(O)C1C2O,0.3189
C1C2CC3C4C=C1C2N34,0.208
CC1(CC1)CO,0.3373
CC(C)(CC#C)O,0.307
COC12CC3C(C1)C3C2,0.3297
CC12NC1C(=O)CC2O,0.217
CCC#CC(N)C(N)=O,0.2571
NC(=O)C1N=CNC1=N,0.2169
CC12CC1(O)C1CCN21,0.2771
CCn1c(ccn1)N,0.2436
CN(CC([O-])=O)C(N)=[NH2+],0.2555
CC1OC2CC(=O)CC12,0.2206
c1nc(c(=O)[nH]n1)F,0.1824
CC1=C(F)C(=N)N=CO1,0.1999
CC12CC3C(N13)C21CO1,0.3209
OC1CCC2CCC12O,0.3145
CN1C(=O)NC=CC1=N,0.2007
O=C1C2NC3C2OC13,0.1986
CC(CO)COCCO,0.3316
CC(=NC)NC(=O)OC,0.2423
CC1(COC(=NC)N1)C,0.2794
CC1=NC2C3CC2C3O1,0.2617
CC1C(O)CC1(C)C#C,0.3029
C1CN2C1C1OCC21,0.2654
Cc1c[nH]nc(c1=O)N,0.1759
CC1(O)C2COCC1N2,0.294
N#CC1C2CC=CC1N2,0.2434
CC1C2CC11C=CCN21,0.2145
COCCC1OC2CC12,0.3204
COC1CC(C)=C(C)C1,0.2535
O=C1NC2C3CC12OC3,0.2402
CC(C)(COC=O)O,0.2856
OCC12CC(O)C1O2,0.3196
O=C1CC(C=C1)C1CC1,0.1922
CCCC1=CC2CC1C2,0.2358
C1CC1C(C=O)(C=O)O,0.1909
C#CC#C,0.2386
CC(O)COCC(C)O,0.3013
N#CC1C2CC2C2OC12,0.3138
OC1C(C#C)C11CCC1,0.28
c1c(ncnc1O)O,0.2378
CC1(C=O)C(O)C2CN12,0.2158
COC1CC1C1(C)CC1,0.3259
CC(=O)CC(O)C(N)=O,0.2212
CC12CC(C1)CC2=O,0.2275
CCC1C(C#N)C1C#N,0.296
OCC1NC2(CC12)C#N,0.2463
CC(O)CC1C2CC1C2,0.3309
C1CN2C(=O)CN=C2N1,0.2371
c1c(nc([nH]1)C(=O)N)N,0.1778
CCC1CCC1(O)C=O,0.2202
COC1C2CC1C2OC,0.3354
C(C=O)C(=O)NC(=N)N,0.1939
CC1(C(=O)COC=N1)C,0.2025
c1nc(c(c(n1)F)N)O,0.2054
ON=C1CCNC1C#N,0.2334
OC1C(O)C1CCC=O,0.2274
C1Cn2c1c(nn2)CO,0.2484
C1CC2OC2C2NC12,0.3081
CC1COCC(C)(O)C1,0.3096
CC#CC(=O)C(O)C#C,0.1946
CC1C(CO)C(=O)N1C,0.2785
CN1C2CC1(CC2)C=O,0.1896
NC1C(CO)C1C#N,0.2652
OCCOC12CC(C1)C2,0.349
COC(=O)c1ccno1,0.2151
c1c(cc(=O)oc1N)F,0.1815
CCC1CC1CC(N)=O,0.2736
c1cc-2cnocc2c1,0.1536
OC1CC1O,0.3011
CC(OCC=O)C(C)=O,0.2116
CC#CC1CN=C(N)O1,0.2517
CC1C2CC(O2)C1(C)C,0.323
CCCN(C)C(=O)N,0.2906
CN=C1NC(C#N)C1N,0.2521
NC(C#N)C1=CC=CO1,0.2298
CC12C3N1CC2C3=O,0.2272
COC(=O)CC(O)C#N,0.2827
COC1CC1(C)CC#C,0.2905
CC1(CN2CC2)CN1,0.315
N=C1OC(=O)C=NC=N1,0.1693
C(COC(=O)C=O)C#N,0.1819
CCC1CCC(C)OC1,0.319
CC1N=CN2CC2C1=O,0.1953
O=CCCN1C2CCC12,0.2219
CCC(C)(O)C1CC1,0.3293
Cc1cc(=O)[nH]nc1F,0.1738
CCC12C3CC1C(C)N23,0.3143
COC1C2CC(C)C12O,0.3152
c1c(oc(n1)N)N(=O)=O,0.1637
CC12NC1C1(O)CC21,0.2797
CC1CC=CC(C)C1,0.2652
CC1(O)CCC11CC1O,0.3029
Cn1c(=O)cnc(n1)O,0.1463
COC1C(C)CC11CO1,0.3116
CC12CC3CN1CC23O,0.292
CC12CN3C(C13)C(O)C2,0.2892
CN1C(CC#C)C1C#C,0.255
C1CNC(=O)CN1,0.2627
COC1CC(=O)C1C#N,0.2227
OCC1(CN=CN1)C=O,0.1931
CC1(C)NC11CCC=C1,0.2333
O=CC12CC(N1)C2C#N,0.2112
CC1COC2CC(C2)O1,0.3156
CC1CC1C1CCCC1,0.3393
CC(C#C)C(=O)NC=N,0.2353
C1NC11C2CC2C11CO1,0.3151
CCCC1CC1(C)CC,0.3388
CC1C2CC(CC12)C=O,0.2282
CCC12OC1C1CC2O1,0.3084
CNc1ccccc1N,0.2038
c1c(oc(=O)[nH]c1=O)N,0.2191
CC(C)(C)C(=O)C1CN1,0.229
CC1(CC1)C2(CC2)C#N,0.2969
CCC1C2COC=NC12,0.2531
O=C1OC2(CNC12)C#N,0.2395
C1C2C=CC3N4CC23C14,0.1795
COCC1(O)CCC=C1,0.2651
CC1CCC=C2COC12,0.2514
[NH2+]=C1C=N[N-]C(C=O)=C1,0.161
ON=C1C2NC2C1C#N,0.2365
CCC1C=C(C)NC1=O,0.214
COCc1c(ocn1)N,0.2172
C1C=C(C(=O)N1)C=O,0.1699
Cc1noc(=O)n1C,0.2494
CC1C2CC2C11CO1,0.3308
CC(=NO)C(C)(C)O,0.2558
O=C(C#C)C1CC2NC12,0.1805
CCC(O)CCC(C)=O,0.2353
CC(C)(C)CCOC=O,0.2861
COc1c(=O)nnon1,0.1591
CC1=C([O-])C(C[NH3+])=NN1,0.2205
CCC1(CC1O)OC,0.3214
OC1C2CCC(=O)C12,0.2253
CC12CC1(C)C=CCO2,0.232
OC1C(O)C2OCCC12,0.2823
CC1OC(=N)C1C1CN1,0.2654
O=C1NC2C3CC1CC23,0.2665
CC(O)CN1CCC1=O,0.2701
OC12CCC3C4C(C14)C23,0.3046
OC(C=O)C(=O)C1CO1,0.1959
O=CC1NC11COC1,0.2185
C#CC1COCCOC1,0.2962
CC1(NC(=O)C=C1)C=O,0.1972
N=C1CC2=C(O1)C=CO2,0.2057
CC1CN(C=O)C(=N)C1,0.2257
O=C1C2C3NC1C=CC23,0.1917
CC12OCC3C1N3C2=N,0.2537
CC1C2COC(=N)OC12,0.2975
c1c[nH]c(c1O)CC#N,0.2278
CCOCCC1CCC1,0.3358
OCC1(CCC1=O)C#C,0.2049
CC(O)CN1CC1(C)C,0.3097
O=CCC12CC3C1N3C2,0.2128
CCCCn1cnnc1,0.2664
OCC1OC1C1CC1O,0.3272
CCC(CC)(C(C)C)O,0.3222
CCC1C2OCC=CC12,0.2438
CC1CC2CN1CC2=O,0.2031
c1cnc(cnc1=O)N,0.1598
C1OC11C2OC2C11CO1,0.3064
CC(=O)C1CCC2CN12,0.2235
CC1(CN1)C(=O)C1CO1,0.2083
CC1COC2CC1(O)C2,0.3091
COc1coc(c1N)O,0.2222
CC(CO)OCCO,0.3244
CC#CC(=O)C#CC#N,0.1726
CC(O)C12COCC1O2,0.3276
C1NC11C=CCN2CC12,0.2376
CCC12CN3CC3C1N2,0.2803
CC(=O)C(=O)CC1CO1,0.1573
CCC12COC1(C)C2C,0.2908
COc1cnncn1,0.1815
CC#CC1(CN1)C1CO1,0.2683
C1C2CC3CC4C2C1C34,0.338
COC1(CO)CC1O,0.2963
CC(=NC1CCC1)OC,0.2681
COC=NC(CO)CO,0.2536
C1C(CO1)C(=O)CC=O,0.2083
OCC1CC(CO)O1,0.3085
c1cc(oc1CO)CO,0.2251
Cc1c2c(no1)CCC2,0.2343
CC(C[NH3+])[N-]C(=O)C#N,0.2265
CC12CCOCC1CO2,0.3147
CCC(=O)C(C)C(N)=O,0.2122
COCC(C=O)C=O,0.2071
CC1CC(C1)OCCO,0.3328
OCC12CC3OC(C1)C23,0.3008
NC(=O)C1C(O)C1C=O,0.1959
OCC1(CC=CC1)C#C,0.2657
CC1COC2CC12C#C,0.2747
CC(CO)C(CO)=NO,0.2481
CCC(C)(CO)C1CO1,0.3298
C1CC(C1)(C#N)C2CC2,0.3147
CC1=Cc2ncnn2C1,0.1937
CC(O)C(C#N)C(C)O,0.3087
CC1=CCCC2NC12,0.2489
C1CCC2(C1)C=CCO2,0.245
CC(CC=O)N1CC1,0.2155
C#CC1CNC(C1)C#N,0.2672
N#CC12CC1CN=CO2,0.2701
CC1(CCO)C(O)C1O,0.2825
CC1CC11C2C3CC2N13,0.3215
CC1(O)CC1CC(N)=O,0.2725
CC1(CC1O)C1CC1O,0.3133
Cc1c(c[nH]n1)O,0.2371
CC(C)CN=C1CCO1,0.2767
C1C(CC1=O)NC=O,0.2159
CC12CCC1C1(O)CC21,0.3116
CC1=CCN2CC(O)C12,0.2323
CC1CC(=O)C(=O)C=C1,0.1486
CCC12C3C4C3C1C24,0.3023
CN(C=O)C(=O)N,0.2498
CN(CCCO)C(=O)N,0.2892
COc1c(cco1)C=O,0.1914
NC(=O)C1(CCO1)C#N,0.2529
Cc1cn2c(n1)CC2,0.2536
CCc1ccc(n1C)N,0.2293
CC1C2CC2C(=O)C1O,0.212
CCCC12CC(C1)C2=O,0.2505
CC1=CC2(CO)NC2C1,0.2406
O=CCC1NC1C=O,0.207
C1CCCOCOCC1,0.3253
OCCC1C(O)C1CO,0.3024
CC1CC1C1COC1=N,0.2887
c1coc2c1[nH]nc2,0.2127
C12CC34CC(C3)C4(C1)C2,0.3519
CN1C(CC#N)C1C=O,0.1934
CC1(N)CN=COC1=O,0.2324
CCC1COC(=N1)C#C,0.216
[NH3+]C(CCO)CC([O-])=O,0.2766
CC(C=O)C1(C)OC1C,0.2239
CN(CC=O)CC=O,0.201
CC1=C(C)C2C3CN2C13,0.2139
COC(C)C(=O)CC=O,0.2147
c1c([nH]c(n1)O)N,0.2464
OC12CCN3C1C=CC23,0.226
CC12OC1C(=N)NC2=O,0.2282
O=C1OCC2CC3C2N13,0.2823
CC1C2OC2C1C(N)=O,0.2691
CCOCCC1(CC1)O,0.3044
CNc1c(ocn1)NC,0.2131
C1CN1C(=O)C=O,0.1709
CCCCCC(C)(C)C,0.3692
CC1(CC1)OC(=O)C#N,0.231
CC1CC2(CC2)C(C)O1,0.3295
C(C=O)n1nc(nn1)O,0.2144
CC#CC(=O)C(=N)N,0.1755
CN=COC1COC1C,0.2725
c1c(c(cnc1N)N)O,0.1837
CC12OC3C1C2(O)C3O,0.2821
CCOC(=N)C(F)(F)F,0.2816
O=CC12CC1C(N2)C#C,0.2173
CC(=N)OC1CCC1,0.2885
CC1C(C=O)C1(C)CO,0.2247
CC(C)C#CC1CCC1,0.2899
N=C1OCC2CC2C=C1,0.2021
Cc1nc(c(=O)on1)F,0.1791
COCC1COC(=N)O1,0.3073
CC(=NO)C#CCC=O,0.1931
O=C1C2CC1OCOC2,0.2004
Cc1coc(=NC)[nH]1,0.2195
CC(C)(C#N)C(=O)C#C,0.2046
CC#Cc1cnc([nH]1)C,0.2007
CCN=COCC1CC1,0.2742
C(C=O)NC(=N)C(=O)N,0.2025
CC(=O)c1c(nno1)N,0.1588
COC1CC(C)=CC1C,0.2585
C(C#N)Nc1nnon1,0.2002
OC(C=O)C(=O)NC=O,0.1965
O=C1CC23CNC12CN3,0.1889
CCC1CC11CC(O)C1,0.334
COCC(C)N1CC1,0.3243
OC1CC=CC1C#C,0.2645
c1cc(c(nc1)O)CO,0.2138
CCN(C)C(=O)C#C,0.2194
CC1(C)N2CC2C11NC1,0.3062
CC1(NC2CCC12)C#N,0.2683
CCC1C2C3OC3C12O,0.2852
COC(C)C1CNC1=O,0.2838
CCC(CO)C1(C)CC1,0.332
CC(C)C1(O)CC1C,0.3197
CCOC1CCOC1,0.3267
N#CCC1CC2CC12,0.3088
CCC1(C)C2CC1C2,0.3676
CCC12CC(C)(C1)CC2,0.3601
CC(C)C1OCC2OC12,0.3337
CC(=NO)C1(CN1)C#C,0.2257
CC1C2CC=C(C)C1O2,0.2401
CC12C(O)C1(O)CC2=O,0.2273
CC1=CNC=C1OC=N,0.2335
CC1COC2OC1C=C2,0.2479
CN1CC=CC(=O)C1=N,0.1515
OC1C2OC3(COC3)C12,0.2947
CC(OC=N)C(C)=NO,0.2517
CCc1cnoc1OC,0.2296
CC1CC1OCCC=O,0.226
N=C1ON=NC=CC1=O,0.1478
CC(C)C1(C)OC1C#C,0.2785
NC(C#CCO)C(N)=O,0.2543
CC1=C(CC2CN12)C=O,0.1835
CCC12CCC(O1)C2O,0.3288
CC1C2CC1N2C(N)=O,0.274
OC12C3CC1C(=O)NC23,0.2559
Cc1c(ncc(=O)[nH]1)F,0.1545
CC1C2CC(C=C2)C1C,0.253
CC(C)C(C)(C)CC#C,0.3093
CC12C3N=CN1C(=N)C23,0.2155
OCCC12CC=CC1N2,0.2328
CC1=CC(CO)C(O)C1,0.2585
COCC1NC1C(C)C,0.3237
c1c(non1)CCO,0.2353
C1OC1C12COCC1N2,0.3297
NC(C1CC[NH2+]1)C([O-])=O,0.2661
CCC1C(O)C1(O)CC,0.2768
C(C#N)C(CC#N)O,0.3056
CC1=NCC(OC=O)O1,0.2631
CCC1(C)OCC1=NO,0.2468
CC1(C)CC(CO)C=C1,0.2633
C1C2CC3CC(C=C3)C12,0.252
OC1CCC1C=O,0.2257
CC1(CN1C(N)=O)C#N,0.2812
CC12OC1CC1CC21O,0.3177
COC1CN(C1)C(=O)N,0.2878
CC1(O)CCCC11CN1,0.2955
OC1C=CC23CCC12N3,0.2034
O=C1CNC1CC1CC1,0.2161
CC(=O)C1(CC1)C=O,0.2226
COCC1CCC11CC1,0.3411
OC12CNC1C=CC2=O,0.1769
N=C1OC2CCC(=O)C12,0.2162
NC=[NH+]CC#CC([O-])=O,0.2028
C(CCO)CC(=O)C#N,0.1892
CC12CC3CC(C1)C23,0.3443
CCC1C(C)C1(O)C#N,0.2846
OCC1CC(C1)NC=O,0.2795
CC(O)C1(CN1)C1CC1,0.299
CC(C)C(C#C)C1CC1,0.3116
c1c(nc(=O)oc1F)N,0.2129
CCC(C)COC=NC,0.2731
Cc1ccc(cc1)NC,0.1969
CCC12CC3C(C1O)N23,0.3084
OCC1(COCO1)C#C,0.2854
CC12OC1C(=O)NC2=O,0.2236
Cc1c([nH]nc1C)C,0.2534
CN=C(C1OCCO1)N,0.2596
OC1CC1C1COCO1,0.3118
CC1CCC(C)(O)C1O,0.3137
C#Cc1cc(n[nH]1)CO,0.2121
CC1CN1CC(N)=O,0.2719
CC1C=C2COC2C1=O,0.2131
COC12CC1CNC2=O,0.2571
OCC1C(C=O)C1C#C,0.2197
CC1C(C)(C)C1(O)CO,0.2934
CC1CCC11CC1C#N,0.3048
COC1CNC(=O)C1=O,0.1592
c1c(ocn1)CC=O,0.2064
c1c(n2c(n1)OCC2)O,0.2407
N#CC1C2CN3CC3C12,0.2503
OC1(CC2(CN2)C1)C=O,0.2131
CCC(NC=O)C(C)O,0.2787
CC1OC1C1CC1(C)C,0.3359
C#CC1CC2NC2C=C1,0.2466
c1ccc(c(c1)O)O,0.2148
COCC1CCC1C,0.3327
CC(CC=O)C1CC1C,0.2272
CN=C1ON=CC=C1C,0.1628
OC1C2COC3(CC3)C12,0.3041
CN1CC2CCC(=O)C12,0.1951
Cc1cc2n(n1)CC2,0.2643
COc1ncc(nn1)N,0.1627
CCc1nc(no1)C,0.2615
CC1CN2CC2C(C)O1,0.3026
OCC12COC1C(=N)N2,0.2486
COCC1NC1(C)CO,0.3056
CN1CC1(C)C1CO1,0.3137
CC#Cc1cc(c[nH]1)C,0.1982
CC1OCC(C)=C1C,0.2485
C1OC2COC12,0.3068
CN(C(=O)C#C)C(=N)N,0.1853
CN1C=C(C)C(=N)N=N1,0.1671
CC1CC23CCCC12O3,0.3239
OC1C2COC(=O)CC12,0.2696
c1cnoc1CC#N,0.2458
c1c[nH]c(c1O)N2CC2,0.221
N#CC1CC=CC11CN1,0.2456
CC1OCC1C(C)(C)O,0.3211
CC1C(C)C(=O)N1C,0.277
OCC1(O)CCCC=C1,0.2623
CCC12OC3CC1OC23,0.3111
CN1CC2=C(C1)N=NO2,0.1612
C1CC11CC=C2CCC12,0.2452
COc1ccno1,0.237
CC(=NO)C1CC(=N)O1,0.252
CC12OC1C1C2OC1=N,0.2802
CCC(=O)NC(=NC)N,0.2196
OCC1CC2OC2C1,0.3338
CC(C)C(O)C(=O)C#C,0.1981
CCC1=CC(=N)N=NN1,0.1686
NC(=O)C1=NCCN1,0.1957
c1cc(c(=O)cnc1)O,0.1491
OC1CN(C=O)C1C#C,0.2653
CC1(C)C2OC2C2OC12,0.3154
OCC(O)C1OCC1O,0.298
O=COC1C2CC1C2,0.2864
CNc1c(cco1)N,0.2159
CC1CC2CC=CC2O1,0.2581
CC1CC2CCC1(C)C2,0.3515
O=C1NC2CC1OCC2,0.2459
OC1C2CCOCC12O,0.2889
CC12C3C1C1N=C2OC31,0.2137
NC(C#C)C1=NC=CN1,0.2432
CC12CCC1C1CC1C2,0.3379
CC1N2CC3(CN3)C12C,0.2923
C1OC2OC3C4C(C24)C13,0.3229
C1CC12CC=C(C2)C#N,0.2189
CC1CC2(CO2)CC=C1,0.2663
CC1(O)CC=CC1C=O,0.2114
CCC1C2CC(O)CN12,0.2824
CCC#Cc1c[nH]nc1,0.2224
CC1=C2C3NC3C2CC1,0.2323
N=COC(CC#C)C=O,0.2137
C1CN(C1)CC(=O)C#N,0.1566
Cc1c(cco1)CC#C,0.2299
O=CC1CC(C1)C#C,0.2256
C1CC(=NO)C(=NO)C1,0.1862
OC1(C=O)C=CNC1=N,0.1849
CCC1CC(C=C1)C#C,0.2591
O=CC12COC1CC=C2,0.2132
CN=COC12CC1CC2,0.2723
N=C1CCCO1,0.2866
OC1CCCOCC1=O,0.2222
COC1CC2C(O)C12C,0.3095
CC12CC3(C=O)C1CN23,0.2044
OC1C2OCC3CC3C12,0.2993
CN=CNC(=NC)C=O,0.1808
CCC1(C)CC(=O)C=C1,0.1911
CC1CC23CC(O2)C13,0.2979
Cc1cc(cnc1O)F,0.2003
C(C=O)c1c(nn[nH]1)N,0.1663
CCC1C2OC(CC)C12,0.3061
CC(O)C(=O)CCC=O,0.2215
CC1(CCOCO1)C=O,0.2133
O=CC12CN1C1CCC21,0.1956
CN1CC2CCN2C1=O,0.2831
COC1(C)CC1C=O,0.2272
CC12CN1C(=O)C2C#N,0.2352
CC12CC(C)(O1)C(O)C2,0.3244
OC(C1CN1)C1CN1,0.2994
CN=CN1CC(O)C1=O,0.2177
CN=C(C#N)N,0.2223
CCCC1=CC(C)OC1,0.2477
CC#CC1(CCC1)C,0.2954
O=COC1C2C=CC1O2,0.2384
CC1N(CC#C)C1(C)C,0.2692
COCC1CCOC1=N,0.2704
N#CC12CC1N1CC2C1,0.2692
Cc1c(nc(o1)O)OC,0.2239
CCC1(C)OC1C(C)C,0.339
CCC(=O)C(C#C)C#C,0.2238
CN1C2CC2NC1=O,0.2799
C#CC(C=O)(C#C)O,0.2168
CC#CCC1CC(C)C1,0.3012
C1CC1(C(=O)C#N)O,0.1955
C1CC(=O)N(C1)C(=O)N,0.238
COC1OCC2CC1C2,0.3427
Cn1c(cc(n1)N)C#N,0.1835
O=C1NC(C#C)C1C#C,0.2612
C#CC12OC1C1COC21,0.251
CC1C2COCCC12C,0.321
CCC12CC(CCC1)O2,0.3153
CCCC(C)C#N,0.3516
CC1C=C(C)C2CC12O,0.2447
CCCC1CNC1=O,0.2803
OCC1CCC1CC=O,0.2277
CCC1=CC(=O)CC1=O,0.1582
CCC1CCC(C)CC1,0.361
CCC1OC(=N)C1C#N,0.2835
COCC1CC1(C)O,0.325
C#CCOCC1CCC1,0.2883
O=CC1C2CC2C2NC12,0.2198
N=C1NC(=CO1)N1CC1,0.225
CC1CC2C(C1)C2(C)O,0.3137
CC1(CCO)CC1O,0.33
OC1=CNC(=N)N1C=O,0.175
c1c2c(co1)ocn2,0.1954
C1CCC(C1)C2COC2,0.3135
CC12CNC1C(=N)OC2,0.2574
Cc1c(coc1N)C#C,0.2108
NC(=O)C(=N)OCC=O,0.2114
COC1C(C)CCC1C,0.3131
CC(C)C1(C)CCCO1,0.3162
O=CC12C3CC1CCN23,0.2187
O=CC12CC(N1)C2C#C,0.207
c1cnn2c1OCC=C2,0.1977
C1CC1C(CO)C2CC2,0.3306
COCC12CN3C1CC23,0.3081
N=C1N=CN=C2CCN12,0.1841
c1c(c(no1)N(=O)=O)N,0.1429
CC1=CN2CC(O)C2=C1,0.2379
C1CC1(C=O)OC(=O)N,0.2328
CC12C3N1C1C3(O)C21C,0.2596
Cn1ccc(=O)nc1N,0.2069
CCC(=O)C(=N)NC=N,0.1843
C#CC1CC2CNC2=N1,0.2481
C#CCc1ccoc1N,0.2188
CC1CN1CC(O)C=O,0.2041
C#CC12CC(O1)C=CC2,0.2335
CCC12CC(O1)C2CO,0.3024
CN=C1OCC2C(C)N12,0.2723
CC(=O)NC1CCC1=O,0.2171
OCC1CCOC11CC1,0.3086
CC(C)OC1CC1(C)C,0.3208
CCOCC#CC(C)O,0.2837
O=C1NC2COCCC12,0.275
CC1(O)C2C(=O)CC12C,0.2278
OCC1=CC(=N)ON=C1,0.1676
C1CC2CC=CCC2=C1,0.2526
OCC#CC1(CO)CO1,0.2734
C1C2CNC3=C2N1C=N3,0.1737
CC1CCC(C)(C)CO1,0.3194
CC12CN3CC1(C#C)C23,0.2558
OCC1(CC2OC12)C=O,0.2166
[NH3+]CC1=COC=C1[O-],0.222
CC#CC12CC1(C)CC2,0.2602
CC(NC(C)=O)C1CO1,0.2767
C#CC1C2C3CN2C13,0.2796
C1CN2C1C1C3OC3C21,0.2576
N=C1OCC2NC=NC12,0.2475
c1cn[nH]c1N2CCC2,0.234
CCCC(=O)C(=N)OC,0.1959
CCC1(C)NC1CO,0.3135
Cc1cc(cc(=O)o1)F,0.185
O=CN1C=CCC2CC12,0.2098
CCC1(C)OC1(C)C#N,0.2957
CC1OC(C=O)C2NC12,0.2161
O=C1OCC11C2CCC12,0.2651
CC(C)C(CO)NC=O,0.2817
CCN1CC(=O)NC1=O,0.2466
C(C#CC#N)NC(=O)N,0.2208
CC1=CCC2CC2C1O,0.2592
CN1C2CC(O)(C#C)C12,0.2567
OC1C2NC(=NC12)C#N,0.1882
NC1COCCOC1=O,0.2305
NC1(COC(=O)C1)C#N,0.2733
N#CC12C3C1C1C3CC21,0.2814
OCC1=CC2(O)CC1C2,0.2363
CC12CC1C=CC(=O)C2,0.1857
Cn1cnc2c1coc2,0.1877
OC1C2OC2C=C1C#N,0.2058
O=C1NC=NC1C1CO1,0.2278
O=CC12COC1CCO2,0.2156
CC1=NC(=N)C=NO1,0.1958
OC(C#C)C1(CC1)C=O,0.233
C1CC(=NO)CC1=NO,0.2401
CN1C2C=CC3OC2C13,0.2093
COc1cocnc1=O,0.2017
C#CCCN=COC=O,0.2313
c1cn2c(c1O)CCC2,0.2284
CC1C2(C)C3OC2C13C,0.3081
COC(CC(C)C)C#C,0.2996
C1OC1C1=CCOC1,0.234
CC(CCCCO)C#N,0.3097
COC1C2CCOC12,0.2961
C(=O)C(=N)N,0.192
OC1CC=CC2OCC12,0.2476
CC12CC3(O)CC1C23C,0.3036
C#CCNCC(=O)C=O,0.1301
NC1=NC2C=CCC2O1,0.2434
CC1C(CC=O)C2CN12,0.2092
C#CC12OC3C1CC23,0.2483
C1NC1C1=CC=NO1,0.2319
CC1C2OC1C2OC=O,0.2599
O=CN1C2CC3(CN3)C12,0.2436
CCC1OC(OC)C=C1,0.2598
CC1CCC(NC1)C#N,0.2661
C#CCN1CCC(=O)C1,0.1971
CCC12C3CN1CC2O3,0.2728
CC1COCCC11CC1,0.3216
OC1(CCC11CO1)C=O,0.2187
CCC(C)C1CNC1=O,0.2803
C(C(F)(F)F)C(F)(F)F,0.462
C#CC1CC1(C#C)C#C,0.2452
COc1cnco1,0.2326
CC12CC1(C)C(=O)C=C2,0.1862
CC12CC(=O)C1CCC2,0.2182
CCc1ccnc(c1)O,0.2141
O=CCC(=O)C1CO1,0.2009
Cc1c2n(cn1)C=CC2,0.1961
CC1CC1(C)CCC#C,0.3107
OC1CCC1(C#C)C#N,0.2806
CCC1NC11CCC=C1,0.2368
OCC(O)C(O)C1CN1,0.2991
CC1CC2C3CCC1C23,0.3316
CCC1CC2NC2C1=O,0.2098
OC1CCC2=C1N=CN2,0.2448
OCC1C2CCC(=O)N12,0.2356
CCC12OC1CC2(C)C,0.3145
CC12NC1C1NC21C#N,0.2278
N#CCC1=CC2NC2C1,0.2373
O=C1CC2CC(CO1)O2,0.2656
C[NH2+]CC1=CC(=O)[CH-]N1,0.081
CC1(C)C2CC2CC1O,0.3307
COC(C)(C)CC(C)O,0.3102
O=C1CCC11C2CN1C2,0.1991
CCC1CC2(O)COC12,0.3004
CCC(C)C1(O)CCC1,0.319
O=CC1CC11CCC=C1,0.2108
OC1C2C3OC1C23C#N,0.2656
CCC1CC2CCC2C1,0.3543
CC1NC11CC2C(O)C12,0.2929
CC1(CO)C2CC=CC12,0.2444
CC1(CO)C2C3NC3C12,0.2707
O=CC1OC2C3CC2C13,0.2165
Cc1cc(on1)NC=N,0.2087
O=C1CN2C3CC1C23,0.2169
O1C2C3C=C4C=CC13C24,0.1442
NC1(CC#N)CC2OC12,0.2761
N=C1NCC(=O)OC1=N,0.1923
CC1NC11COC=NC1,0.2703
CN=C1C=CCC(=O)O1,0.2124
OC1C2OCC2(O)C1=O,0.2046
CNC1=NCC(=N)OC1,0.2465
O=C1CC2(CCC=C2)N1,0.2455
CC1N2C(CC12C)C#C,0.2699
OC1COC(C=C1)C#C,0.2579
CCC(OC(N)=O)C#N,0.3018
[O-]C(=O)C12CN1C=[NH+]C2,0.101
COC12CC(C1)NC2=O,0.2456
CCCC#CC1CC1,0.2828
OC12CN(C1)C(C2)C#C,0.2668
CN=C1OCC1N(C)C,0.2469
COC1C2CC2C11CO1,0.3274
CCC1CC(C)C=C1C,0.2579
C1C2C3C=CC4C1C2C34,0.2421
CN1CC2OC(C#N)C12,0.2298
CC1NC11COC11CC1,0.2923
Cn1cnc(=O)cc1N,0.2058
N=C1C=NNN=C1,0.181
C1CN(C=N1)C(=O)C=O,0.1609
CC12CC3=CCC1(O)C23,0.1806
CC1CC1C,0.3573
CNC1=NC2C(O)C2O1,0.265
c1c(c2n(n1)CC2)CO,0.2586
CC1CC2OC(=N)CC12,0.2824
CC(OC=O)C1OC1C,0.2807
CCC1OC1(C)CCO,0.3354
CCC(C)C#CC#C,0.2315
C(#N)c1noc(=O)o1,0.2152
CC1=CC(C)(C)OC1=N,0.22
CN1C2COC(=N)CC12,0.2541
COC1CC(C=C1)C#C,0.2532
CC12CC3(O)C1NC23,0.2945
CNC1=CC(=NO)CC1,0.1887
CC#CC(C)C(O)C#C,0.2702
CNc1cc([nH]c1)C#N,0.1792
CN=CNc1c[nH]cn1,0.2155
CC1(O)CNC1C=O,0.2081
CC(C)(CC#N)C=O,0.2303
C1C2OC3CCN1C23,0.2776
CN=C1CN=CN1C,0.2146
CCC1C2NCC12C#N,0.2516
CC1CC=CC1CC#N,0.2622
OC1CC11OC2C(O)C12,0.2737
NC(C#C)C(=N)NC=O,0.2215
Cc1cc(cn1C)C=O,0.1961
c1c2c(on1)CC=C2,0.201
OC1CC1OC1COC1,0.3085
N=C1CCC2CC2CO1,0.2726
CN1C2CC(C)(O)CC12,0.2826
NCC1[NH2+]CC1C([O-])=O,0.2673
CC1(CCC1)C(C)(C)O,0.3199
C1CCC=CCC=CC1,0.2393
OC1C2CC3CN3C12,0.2849
CC(C)C(=O)C1(CC1)C,0.2262
[N-]1[NH+]=NC=C2N=CN=C12,0.1781
N#CCOC1CN=CO1,0.2764
c12c([nH]nc1onn2)N,0.1772
C1C2C3COC4C1C4C23,0.3087
CC1=CC(O)C(C)(C)C1,0.2562
CN=c1[nH]ncn1C=O,0.175
CC12CN1CC1C(O)C21,0.2778
CC1C2CC1(CC#N)O2,0.2762
OCC1OC2CCOC12,0.3195
CC1C2OC(=N)CC12O,0.2615
CC(C)C12CC1C(=N)O2,0.2795
OCC(O)C1CCC1,0.3146
CC(O)C(O)C=O,0.2258
CC1(CO)CC(C1)C#C,0.3016
COC12CC1C1(CO1)C2,0.3341
CC(C)(C#C)NCC#N,0.2667
CC1C=CC2CC(=O)C12,0.2175
CCNC(=O)OCC=O,0.2264
c1(=O)c(noc(n1)F)F,0.201
c1c(nc[nH]1)C(=O)C#N,0.1804
C1CCNC(=O)NCC1,0.2701
CCC(C)(O)C(N)=O,0.2659
O=C1C2OC2C1CC#C,0.211
NC(=O)CN1CC2CC12,0.2603
CNC(C=O)C#CC#N,0.1816
CCC#CC1C2CC1O2,0.2766
C1OC23C=CC4C2OC134,0.2004
CC1(O)C2CC2(O)C1O,0.3071
CCN=c1[nH]c(co1)C,0.2194
O=C1CC2CC2CCO1,0.2674
CC1CCC2=CN=NN12,0.2566
CCC(O)CC(C)(C)O,0.3085
O=C1C2CC1N1CCC21,0.1955
CC12CC1(O)C=CC2=O,0.1837
CCn1c(ccn1)NC,0.2381
CCC(C)(CC)OC,0.3232
CC12C3OC4C(OC14)C23,0.3291
Cc1cnc(nc1)C#C,0.2012
OC1C2N3CC1C23C#C,0.2568
CC(=O)Oc1nnon1,0.2301
Cc1c(c(on1)N)NC,0.2257
CC1=CC2OC(=N)C2C1,0.2505
OCCC(CO)CC#C,0.2927
OC1C2C3C4C3C2C14,0.3141
CC1(CCC1)CCCO,0.3409
C1COCC(=CN1)C=O,0.1933
CC12CC(O)(C1)C2C#N,0.3041
CC(O)CC(C)CC=O,0.2289
CC1(COC2CC12)C#N,0.2853
CC1C(O)C11COCO1,0.3009
Cc1nc(nc(n1)F)F,0.2412
CC#CC1=CCCOC1,0.2092
OC1C2C3N2C1C31CC1,0.3044
O=CC1CN1CC1CN1,0.2051
CC1C2CN3C2C13C=O,0.2201
CC1(CC(N)C#N)CC1,0.2808
Cn1ccc(nc1=O)F,0.1922
Cc1c(c(on1)C)C=O,0.2062
OCC1=CNC(=O)C1O,0.2053
CC(C)Cc1n[nH]nn1,0.2594
CCC1C=CCC1O,0.263
C#CCNc1c[nH]nn1,0.2137
OC12COC1CC1OC21,0.2954
CCCC1(C)CO1,0.3464
c1c(onn1)NCC=O,0.1845
CNC1CN2CC12C#N,0.2327
CC1(CC1CO)OC=N,0.2802
Cc1c(c[nH]c1O)C#N,0.2039
CC12CC3(OCC13)C=C2,0.2311
NC1CC2CN2C1C#N,0.2552
CC12CCC1OC(=O)N2,0.3139
CC(O)(C#C)C(=O)C#C,0.1879
CC1C=CC2(CN12)C=O,0.2064
CC12CC1C(CO)=CC2,0.2473
N=C1CC(=N)NC(=O)N1,0.2406
C#CC(C1CN1)C1CO1,0.2802
CC1CC1C1CCC1,0.344
CC(=O)C(O)(C=O)C#N,0.2023
O=CC12CCC1OC2,0.2161
COC=NCC1OC1C,0.2651
CC1(C)C2OC2C1C=O,0.214
CC(CO)N1C=NN=C1,0.2678
CC1=CCOC(=O)C1O,0.2474
CC12COCC1C(=O)N2,0.2747
O=CCC12CC(O1)C=C2,0.2159
OC1CC1(O)C1CCO1,0.2743
CC(C)C(C=O)C(C)O,0.221
COC1C(NC1=O)C=O,0.2016
C1C2C3C2C2OC3C12,0.3284
CC1(C)N2C3CC2C13O,0.3068
O=CC1CC(=O)C=C1,0.1943
OC(CC(=O)C#N)C#N,0.2081
O=C1OC2COCCC12,0.2783
CC(=NC)NC(=O)C,0.232
Cc1c(cc2n1CC2)O,0.2206
CC1C2CCOC12C#N,0.2783
c1nc(c2n1CC=C2)O,0.17
CC12CC(O1)C2(O)CO,0.3241
C1CN=COCOC1,0.2576
CC1C(C#N)C1(O)CO,0.284
C1C2OC22COCOC12,0.3312
CNC(=N)c1ncco1,0.1877
OC1CC2C1CC2=O,0.2215
O=C1CC23CCC2OC13,0.1943
C1CN(C=CC=C1)C=O,0.1712
C#CC12CC3C1OC23,0.268
OCC1C2C3C1CCN23,0.308
Cc1c[nH]nc1COC,0.2568
COC(C=O)(C#C)C#N,0.2079
OC1C2C(O)C1(O)C2=O,0.2245
O=CC12CC3C1N3CC2,0.2198
CCC(C)C1=NOC=N1,0.2683
FC1=NC=NNC1=N,0.1623
CNC(=O)COCC#N,0.2528
CN1CC11CC(C1)C=O,0.215
CCc1c(cn[nH]1)O,0.2309
OC12CC3C4CC4C1C23,0.3176
CC12CC3OC1C3N2,0.3051
CCC12CC(C)(O1)C2=O,0.2415
COCc1c(cc[nH]1)O,0.2263
c1(c(oc(n1)O)O)N,0.2233
N=C1NC=NC1C1CN1,0.2214
C1OC23COC2C=CC13,0.242
c1c(c(n[nH]1)CC=O)O,0.1648
c1nc([nH]n1)CCC#N,0.2666
N#CC1CCC2COC12,0.2991
COc1c([nH]c(n1)N)N,0.2227
CC(C)(C=O)C(=O)C#N,0.173
Cc1cc([nH]c1N)C#N,0.1882
CCNc1cn[nH]c1N,0.2394
CC12C3C1C1=CC2C3C1,0.1177
CC1(C)CC2OC2C1,0.3407
OC1C2COC(=N)C1O2,0.26
Cn1cc(ccc1=O)N,0.1526
CC1(C)CC=CC11CO1,0.2516
C1C2OC3=NC1C1C2C31,0.147
CCC#CC1CC1(C)C,0.2762
CC1C(N1C)C(C)(C)C,0.3021
NC1C2C3CN2C13C#N,0.254
CC1(CN1)C1=CNN=C1,0.2508
c1cnn(n1)C=O,0.225
CC12CC(CO)(C1)CC2,0.3357
N=C1CC(CCC=O)O1,0.2296
COC1CC(=O)C1CO,0.2188
OCC(OC=N)C1CO1,0.2813
OCC1C2CC2OC1=N,0.2588
C#CCCC12CC(C1)O2,0.2935
Cc1c([nH]cc1C=O)C,0.1861
C1CC11C2OC1C=C2,0.2297
COCC1(O)C2CCC12,0.3146
COC1CC(C)C(=O)O1,0.2749
CCC1NC1C(C)O,0.315
CC1CC2OCC=C12,0.2364
OCCC1(O)CCC1O,0.3229
CC1C2C3C1C(O)C23C,0.3191
CC#Cc1ncnnn1,0.1574
NC(C#N)C1CC(O)C1,0.2849
c1cc([nH]c1)OC2CC2,0.2416
CC(C#C)C(C)C(C)=O,0.2294
CCCN(CC#N)C=O,0.2701
Cn1c2c(cn1)cno2,0.2271
C1C=CC(=O)CC(=O)O1,0.1905
CC1C2C(CO)C2C1O,0.2973
CC1=CCc2c1cno2,0.2017
CCC1NC(C)C1=NO,0.2321
CC#CC1(CC1)CC=O,0.213
CCC1CC2(CO2)C1C,0.3279
CC12C3NC1C(=O)OC23,0.2365
OC1C2NC(C1O)C2=O,0.23
c1c(c(c(cn1)O)F)O,0.2159
CC1CCCC(=O)N1C,0.2664
c1cc([nH]c1)NCC#N,0.2293
OCC1C2OC2C1C=O,0.2066
Cc1cc(c(nc1)C)O,0.2082
CCC1CN2CC12C#N,0.2569
CC12CC1C=C(CO)C2,0.2428
CC1(COC(=N)N1)C#C,0.2614
c1cnccc1F,0.2422
CC(C#C)C(O)C=O,0.2159
CC1=CC(=N)OCOC1,0.2106
CCOC1=NCC(=O)N1,0.2473
COC(C)CC(O)C#N,0.2794
CC1(CCO1)C(=O)CO,0.2202
OCC1CC1O,0.329
CC#CC(=NCC#N)N,0.2219
CCc1c(cccn1)O,0.2097
CC#CCOCCC#C,0.2829
CCCC1C2CN2C1=O,0.2324
CC(C#N)C1=NNC=N1,0.2686
CCC1C2CC(CO)N12,0.2993
c1cc([nH]c(=O)c1N)N,0.1619
CC1CC2C3NC3C=C12,0.2376
CC12CN3CC1(C)C23,0.2939
CC(O)C(=N)NC=O,0.2261
FC1=C(F)C(=N)OC=N1,0.1776
CC(=O)CN1CC(C1)O,0.2168
CC1(C)NC1(C)C1CO1,0.3125
CC(=O)C12CC1OC2,0.2233
c1c(ncc(n1)O)CO,0.1936
CC12NC1C1OC(=O)C21,0.2535
C1OC11CC2CN3C2C13,0.3078
CC1OC2=C(O1)C=NO2,0.2032
CCOC1CC2NC12C,0.299
CC1CCCC2CC2C1,0.3403
CC1C2CC3CC1C23C,0.3306
C[NH+]1C[C-]2OC(=O)C=C12,0.1636
CNC(C#N)C(C)C=O,0.2216
Cc1c(con1)C2CC2,0.2442
CC1OC2C3C=CC2C13,0.2327
CC(C)(C)C1CC(=O)O1,0.285
c1nc(=O)c(no1)F,0.1934
CCC(O)CNC=O,0.2821
OC12CCCC1N1CC21,0.2992
CC1CC2(CN12)C(C)=O,0.2156
OCCC1CC(N1)C#N,0.2664
OC12C3OC4CC1C4C23,0.2958
N=C1OCC11OC2CC12,0.2542
[O-]C(=O)C12CC1[NH2+]CC2,0.1516
CCOC(C)(C)C,0.3245
C1C2OC2C11CC2OC12,0.3331
OCC(O)C1COC1=O,0.2648
OC1(CC2NC12)C#C,0.2636
CC(C)CCNC=O,0.2836
CC#CC(O)(C=O)C#C,0.215
C1CC2OC3C4C2N4C13,0.3173
COCCN1CC1C=O,0.2102
CC(O)C12NC1CC2C,0.28
OC1CCC(OC1)C=O,0.2257
CC#CC1OC1C1CN1,0.2592
CC#CCOCC(C)O,0.2827
O=C1NC2CC2(N1)C#C,0.2669
N#CC12CC(N1)C21CO1,0.2681
C(C=O)C(=O)NC=O,0.2081
Cn1ccc(n1)C#N,0.236
CC1(OC1C#C)C(N)=O,0.2429
CCC1(CC1)CCO,0.3398
CCC(C)C1OC1CC,0.328
O=CC1OCC1C#C,0.2111
COCC1(C)C(O)C1O,0.2866
c1c2c(on1)NCC2,0.2145
O=C1C2C3CC1COC23,0.225
CC1NC11CCC1=O,0.2145
CN1C2CCCC1C2=O,0.2267
CC(C)(CO)C1(CC1)O,0.3083
CC1OC1CNC(C)=O,0.2782
C#CCCc1cc[nH]n1,0.2632
CC1(C#N)C2CC1C=C2,0.2391
OCC1CCC=CCO1,0.263
Cc1ncc2n1CCO2,0.2329
CCC(CC)(C#N)OC,0.3008
c1cnc(=O)oc1CO,0.1832
c1c(coc1N2CC2)N,0.2162
C(C(=O)COC=O)O,0.23
CC(C)C(=O)CC1CC1,0.2295
C1C2CC11OCC3C2C13,0.2918
OC(CC#N)C(O)C=O,0.2324
CC1=Cc2cccn2C1,0.1732
c1c(n[nH]n1)N(=O)=O,0.2076
CC#CC1=CCNC1=O,0.1953
COC1CC(C#C)C1C,0.2968
CC(C)CCCC(=O)C,0.2342
CC12CC1(C)OC(=O)C2,0.2755
CCC1COCCCO1,0.3247
O=C1C2NC2C2OC12,0.1909
N#CC12COC3C1CC23,0.2781
[O-]C(=O)C1CC1C1C[NH2+]1,0.2657
COc1c(=O)[nH]ncn1,0.1832
N=COCCCCC=O,0.229
CC1OC(C=O)C1C#C,0.2122
CC12CC3C4C(C14)C3C2,0.3463
c1cnc2c(n1)COC2,0.1917
C1OCC1C1COCO1,0.3235
Cc1c(nco1)N2CC2,0.2303
OC12CCCC1OC2=O,0.2619
NC(=O)C1C2OC2C1O,0.2709
CCC(C)C(O)C1CO1,0.3454
OC1C2C3C(C#C)N2C13,0.2606
COCCCOCC=O,0.2294
CC1(C)OC1(C)C(N)=O,0.2651
C1CC2CC=CCCC12,0.2618
CCC#Cc1[nH]ccn1,0.2033
OC1C=C2C3C4C3C2C14,0.1631
CCC[NH2+]CC([O-])=O,0.2692
CC1(CCO1)C1CC1,0.3265
c1nc(on1)N=C(N)N,0.2042
CC12OC(C=C1)C1CC21,0.2427
CC(O)C1CC2(C)CC12,0.3126
C1CC12COC(=N2)CO,0.2548
CC1=CCNC(=O)N1,0.2262
COC1C2C1C(O)C2O,0.2996
CC1CC2CCC12C#N,0.3016
CC1OC11CC2NC12,0.3048
OCC1CCC(=C1)C#C,0.209
CC1(CC[NH2+]1)C([O-])=O,0.2637
c1coc(c(c1=O)N)N,0.1764
NC1=COC=NC1=N,0.1824
CC1=CCC2OC1C2=O,0.2149
C1NC11C2C3COC1C23,0.3167
C#CC(C#C)C#N,0.2959
C1OC2C3CC12CCO3,0.2818
CC#CC(C)C(O)CO,0.298
c1c(nc(c(=O)[nH]1)F)O,0.1519
CC(O)C(=O)C(O)CO,0.2156
N=C1OC=CC=C1C#N,0.1515
CC(OCC#C)C1CO1,0.2821
CC1CC2(O)CN3C1C23,0.288
OC1(C=O)C2C3NC3C12,0.2006
CC(C#N)C(C#C)C#C,0.287
CC(O)C1CCC1(C)C,0.3238
CC1(C)OC=NCC1O,0.2696
c1nnc2n1cno2,0.2144
C#CC1=CCC2(CO2)C1,0.2112
C(COCCC#N)C#N,0.313
COC1C2CC3C2CC13,0.3367
O=COCCC1CO1,0.2855
ON=C1C2C3CCC1N23,0.2334
CC1NC1C(=O)C=O,0.1505
c1c[nH]cc1C=O,0.1975
CCc1cn(cn1)C,0.2484
CC1N=C2NC3(C)C1C23,0.172
c1c2cncn2ncn1,0.1621
COCC(=O)C(C)CO,0.2298
CCN1CC(=O)CC1C,0.1932
COC1C2C3C=CC1C23,0.2348
CC12CC(C1)C2CC#N,0.3432
C1CC2CC=CC2C1,0.265
CC1NC2CN=COC12,0.2606
CC1C2COCC1(C)O2,0.3139
CCc1c(n[nH]n1)NC,0.2145
OC1CC11C2CN1C2,0.2946
CC#CC1COCCN1,0.2598
CNc1cn[nH]c1OC,0.2228
CCC12CC3CC(O1)C23,0.309
CCCc1[nH]nc(n1)N,0.2333
CC1(C)CC2(CC2O)C1,0.3067
CC1C=CC2(CO)OC12,0.2464
C#CCCOCC1CO1,0.3148
CC1CCCCC(=O)N1,0.2663
Cn1cnc2c1onc2,0.2197
CC(O)C1OCC(=O)O1,0.2682
C1C2CC3N=COC1C23,0.2643
OCC12CC3(CN3)C1N2,0.3126
CC12OC(=N)C1C1OC21,0.2807
O=CC1CCC(=C1)C#N,0.1988
COc1cc(on1)CO,0.2454
O=CCC12NC1CC2=O,0.2133
CCOCC1COC1=O,0.2774
C1C=CCC1(C=O)C=O,0.2186
OCC(=O)C1CC2NC12,0.2215
N#CC12OC3C1CC23,0.2495
c1cc(cc(c1)F)N,0.2113
c1cc(oc1)CN2CC2,0.2307
CC1OCC1C1CCC1,0.3197
CC1CC11CC2CC1C2,0.3476
CC1OC2CC2C1O,0.3087
CCOC(=N)C(C)CO,0.2905
CC1=CC2CC2C1(C)O,0.245
c1c2c(nc[nH]2)ncn1,0.1999
OC1COC2(CC2)C1O,0.3101
C1OC2CC=CC=CC12,0.196
OC12CC3C4C(C1)N4C23,0.2961
C1COC2C3NC3C2C1,0.2969
N=C1CCC2(CC2)CO1,0.2764
CC1OCC(CO)=C1C,0.2396
COC(=O)C(CO)CO,0.2731
OC(C=O)C1(CO1)C=O,0.214
CNC(=O)C1CN1,0.2706
CCN(C)c1cnco1,0.213
O=C1OCC(CC#C)O1,0.3102
CC1=CC2C3CC1C23O,0.2357
CN1CC2NC2C1C#N,0.2559
CCC#CC1(C)CO1,0.2795
C#CCC1CCC2OC12,0.3121
CCC1(C)N(C)CC1=O,0.2007
C1CC1CCNC(=O)N,0.3016
CC12CCC1C1(CO1)C2,0.3265
CC12OCC1C2C#N,0.2841
CCCOC(=O)C(C)C,0.2814
CC1=CC(=O)C2OC2C1,0.1882
CC1C2CC(CN12)C=O,0.2057
C1OC11CC2COC1C2,0.3194
OCC12CC1N(C2)C=O,0.2583
O=C1C2CC3C2C13C#N,0.2422
CC1(CC(=O)O1)C=O,0.2217
Cn1ccc(c1CO)O,0.2206
CCC1(O)CCCC1=O,0.2192
CC1(OCC(=N)O1)C#N,0.2871
CC1C2CC3C2COC13,0.3254
C1Cc2c(nnn2C1)O,0.2251
CCC1(O)CC(C1)OC,0.3129
[NH3+]C1CC2NC12C([O-])=O,0.2488
CC1CC=CN1C=O,0.21
OCCC1=CC2NC2C1,0.242
N#CC#CCC1CCO1,0.2258
C1CC1CC(=O)CC=O,0.2031
CC#CC1CC(C1)C=O,0.224
C1C2C=CC11OCOC21,0.2343
CC1CC2(CCC2=O)O1,0.1959
CN=C(NC=O)OC,0.2357
CC(=O)C#CC1CCO1,0.2056
OC12CC3C1N3CC=C2,0.2475
O=C1CC(CC#C)C=C1,0.1928
C(OC1CC1)C1CN1,0.325
CC(C)C1NC(=O)C=C1,0.2136
OC12CN3C(CC13)C=C2,0.2177
CN(C=N)c1cocn1,0.2051
COC1CC2(CN2)C1,0.3175
CCC(O)(C#N)C(N)=N,0.2472
CNc1ccc(o1)OC,0.2225
C1CC(C1)(CCO)C=O,0.226
CCC12OC1CC2C=O,0.2153
NC(=O)C1CCC(=O)O1,0.2574
C1CC(NC1)(C#N)C#N,0.2569
NCC(NC(N)=O)C#N,0.2886
O=C(C#N)C1CCN1,0.1594
O=C1CCC2CC12C#N,0.227
CCC1CC(C)(C)C1C,0.3445
CC1CC(C1)C(=O)CO,0.2374
CC1(C#C)C2CC(=O)N12,0.2279
CCC1OC(=N)C(=O)O1,0.2228
CC(C)(CC#C)C(=O)N,0.2753
CCN=c1occ(o1)N,0.2324
CCC1(C)NC(=O)C1C,0.2781
OC1CC=CC1,0.267
CC1C2C3CC3N2C1=O,0.2343
CC(=O)C1C2COC12C,0.2172
c1[nH]nc(n1)CO,0.2597
CC1(C(=O)CCCN1)C,0.2096
OCC#CCC1CC1O,0.2507
OC1CC23CCC2(C1)O3,0.309
CC12CC(N1C=O)C2=O,0.2347
CC(=O)N(C)C1CCC1,0.2635
[NH3+]CC1=COC([O-])=C1O,0.11
CCOc1c(cc[nH]1)O,0.2307
NC1=NC2C(O1)C2C#C,0.2576
COc1c(cno1)CO,0.2349
CC(=O)CC1CO1,0.2343
c1c(c(no1)C(=N)N)N,0.1921
CC(CO)C1OC1CO,0.3231
Cn1cc(c(c1O)O)O,0.2172
CCC1(C)CC(O)C=C1,0.2589
C1C2NC2C2=C1NC=C2,0.2348
C(C=O)n1nnnn1,0.2276
c1coc2c1COCO2,0.2283
CC1CC1C(O)C=O,0.2278
C(C(C=O)(C=O)O)O,0.2092
O=CN1C2CCC1C=C2,0.2398
c1cnn(c1)C(=O)N,0.2363
CCC1=CC(OC1)C=O,0.2025
CCC1=CC2CC(C2)C1,0.2466
O=CC1=CCC2CN2C1,0.1735
c1c(nc([nH]1)O)N,0.2361
NC(CO)C(N)C#N,0.2674
CC1(C)NC1C1(C)CO1,0.3118
CC(O)CC(CO)=NO,0.253
C#CC1C2COCCN12,0.2543
N=C1C=CC2CC(=O)N12,0.2036
c1cc(c(nc1)N)CO,0.2034
c1c(nco1)N2CC2,0.2386
Cc1cc(c(o1)N)C#C,0.1998
C(=O)n1c(nc(n1)N)N,0.1839
CCCC1C(C)CC1C,0.3462
CC12CCC(OC1)O2,0.3271
CC#CCC(=O)N(C)C,0.2674
CC12OC34C=CC(C13)C24,0.2159
CC12CCOC1CC2O,0.302
C1CC(C1)CCC2CC2,0.3566
CC1OC2CN=COC12,0.267
CC(O)C(CO)CC#C,0.294
CC#CC1CCC(=O)C1,0.2187
CN1C(=N)COCC1=O,0.2355
CC(C)COCC1CN1,0.3225
CCC(CC#CC)C#C,0.2902
C#CCCCCC=O,0.2281
CC(=O)NC1CC1C=O,0.2245
CC1C=CCC1CCO,0.2639
C#CC(=O)NC(=N)C=O,0.1706
CC1CC2CC3C1C23O,0.311
C1CC2(C1)COC(=O)O2,0.3302
Cc1c(nc([nH]1)OC)C,0.2428
CC1N2C3C=CC1(C)C23,0.227
CCC1OC1C(C)=O,0.2225
COC(C1CC1)C(C)=O,0.2155
CCc1c[nH]ccc1=O,0.2028
C1C2C3C4COC2C1C34,0.3173
OC1C2CC(O)(C=O)C12,0.2139
OCCC1OCC1C#N,0.2797
c1c(nnc(n1)C#N)N,0.1689
OCCC#CC(O)C#N,0.27
CC1N=COC11CC1O,0.2591
CC(CC1CO1)NC=O,0.2781
N=C1OC2CC3C2NC13,0.2482
CN(C)CC(C#C)C#N,0.2383
O=CC1C2NC2C11CO1,0.2173
CC#CC12C3CC1CN23,0.2539
CC#Cc1c([nH]nn1)C,0.2195
CC1CCCCCC=C1,0.2593
c1c(c(=O)oc(n1)O)F,0.1877
CC12CC(=O)C(O)C1O2,0.2284
O=CN1CC2CC1CO2,0.2703
C1C2OC11COCC21,0.3109
C1C2C3N4CC=CC13C24,0.2165
Cc1c(c(=O)nc[nH]1)O,0.1921
Cn1cc(c(n1)O)C=O,0.1855
CC1(O)C2CC1C2,0.331
CC(O)C(C)C(=O)C#C,0.189
CC1CC1C1(CO1)C#N,0.287
C#CCCCC1(CC1)O,0.3103
CCC1C2OC2C2CN12,0.2939
OCC1CC11CC2NC12,0.3024
C#CC1CC23CN(C2)C13,0.2452
ON=C1CC(O)C=C1,0.1919
CCC1COC2(CC2)C1,0.3077
N=C1OC2(CC2)CC1=O,0.1829
CC(CCO)CNC=O,0.2826
CN=C(N)NC(=N)C#N,0.1973
O=CN1CC2OCC=C12,0.2075
CCC1(C)CC(O)C1O,0.3054
OCC(O)C12CCC1N2,0.3045
CCC1C(O)C1(O)C=O,0.2209
CNC12CN(C1)CC2=O,0.1954
CCC12CC(C1)C(O)C2,0.3386
C1C2N1CC13CCC21O3,0.305
OC1CN2CC1C2C=O,0.2057
CCC(=O)C(C)CC#N,0.2312
CC1N=C(C=O)N2CC12,0.1794
C1CC2(O1)C1CCOC21,0.2773
NC1=NCC(O1)C#C,0.2486
O=C1NC2(CC12)C1CN1,0.2483
CC1OC2C(NC=O)C12,0.2631
N=COCC1=NON=N1,0.1983
CC(CO)CCC1CO1,0.3398
CCN1CC(=O)CC1=O,0.2086
C1C2(CN1)C(=O)OC=N2,0.2021
CCC1CN2CC(=O)C12,0.2019
CC12CC3C(CC13)O2,0.3326
CN(CC#C)C(=N)C#N,0.2014
CC1=CCC2(CO2)C1O,0.2623
CC#CC(=NO)C#C,0.1787
OC1C2C3C1N2CC3=O,0.2068
CCNc1cn(cn1)C,0.2171
O=C1NC(C#C)C2CN12,0.2779
CCc1nc(no1)N,0.2303
CC12C3N1CC3(C)C2O,0.2948
OC1CC(O)(C=O)C1O,0.206
CCCCC(C#N)C#N,0.3248
OCC12C(O)C1N1CC21,0.2759
Cc1c(cncn1)F,0.2106
CC1C2C3C1C=CC23O,0.2351
O=CNC12CC(C1)CC2,0.2756
COC1(C)OCCC1O,0.3352
Cc1c(cc(n1C)N)O,0.2213
CC(C)CC1OC2CC12,0.3175
OC1C2COC1CO2,0.3041
CC(=O)CC1CCCC1,0.2335
CCC1(CO)COC1=N,0.2901
CC1(O)C2OC=NC12C,0.2468
CC(C)C(=NO)CO,0.2556
N=C1OCC=C1C1CC1,0.2115
CC1C2NC1(CO)C2=O,0.2478
CCCC#CC1CC1O,0.2792
COC=Nc1ccon1,0.2184
CC1(O)CCNCC1=O,0.2007
O=C1NCC11CC1C#C,0.2628
CCC1CC(=O)C1(C)O,0.2186
O=C1CC23NC4C2OC134,0.1866
CCC1OC2CC1CO2,0.3327
CC(CC=O)C(C)C#N,0.2281
COc1c2n(cn1)CC2,0.2268
N=C1OCC2=C1CCN2,0.1997
N=COC1(CC1)C#N,0.2803
CCC(C)C1=CCCC1,0.2593
C1OC2C3OCC2C1O3,0.3287
COCC1COC1,0.3267
O=C1CC2(CC1C2)C#N,0.2296
c1cc([nH]c1CO)O,0.2268
CC(C)C1C2CC1C2=O,0.2512
CC(C=O)N(C)C(C)=O,0.2122
C1CC(C1)OC(=O)CN,0.2606
CC1=CC2NC1(C)C2O,0.2334
OC1C2OCCC12C=O,0.2242
CC1=NC2COC(C2)O1,0.2694
COCC12COC1C2C,0.3079
CC(C=O)(C#C)C(N)=O,0.2199
CC(=O)C1(C)C2CC1C2,0.2255
OC12CCC(C1)C1NC21,0.3083
O=C1CC=CC2NC2C1,0.2234
c1c(cncn1)NC=O,0.2071
N#CC1C2CCCOC12,0.2702
OC12CCC1(OC2)C#N,0.2599
O=CC1=NCCC2CN12,0.1793
COc1c(=O)ccon1,0.1923
OCCC1=CC2CN2C1,0.229
O=CC1OC11COC1,0.2157
CCC(=O)C1(CO)CN1,0.2324
N#CC1CCC=CCN1,0.2351
CC1CC=C(C)C11CO1,0.2492
CC12CC1(CC2)OC=O,0.2621
CC#Cc1c([nH]cn1)C,0.2154
CC1CC11CN(C1)C=O,0.2653
CC(C#C)(C#N)N1CC1,0.2648
CC(C)(O)C#CC1CN1,0.2664
N=C1C=NOC(C=O)=N1,0.1729
CC1C2C(O)C2C11CN1,0.3124
OCC1C2C3OC3C12O,0.2823
CC1OC(=N)C=C1C=O,0.1681
NC(=O)C1CC(O)C1O,0.2631
OCC12C3CC1N=CN23,0.2382
CCC1CC2C3OC3C12,0.3217
C1OC2C1C1OCC=C21,0.225
OC1CC2NC1C2C#N,0.2922
CCC12CC1C1CC21,0.2877
CC1C2CCNC(=O)C12,0.2575
C1OC2C3C4CC12CC34,0.3195
OC1C2CC=C(C=O)C12,0.1879
OC12CC3C(OC13)C2=O,0.2052
N=COC1CC=CC1=O,0.1763
O=C1OC2CC12C#N,0.2722
CN1CC2(C)NC2C1=O,0.2525
CCC1(O)C2CC1C2=O,0.2549
OC1C2C1C1CC2C1O,0.3086
OCC#CC1CC2NC12,0.2679
COC(=O)NCC=O,0.2199
CC12CCN1C2CCO,0.2995
C#Cc1c(non1)N,0.1943
CCC(C)CC1COC1,0.3098
CC(C)C1(CC=O)CO1,0.2225
CC1=COC(F)=CC1=N,0.2037
COC1CC11NCC1=O,0.1999
O=C1CC23CCCC12N3,0.2211
CC1C2OCC2C11CO1,0.3099
N#CC1CCOC1,0.3052
OCC1(C#C)C2CCC12,0.2879
CN1CC1C(C=O)C#C,0.199
Cn1c(c(nc1N)O)N,0.2256
CC1CC(=O)CC11CN1,0.2184
CC1C2C3CC2C(=O)C13,0.2276
CC12CC3(CC(O)C13)O2,0.2253
OC1C2CC1C(O2)C=O,0.2071
CC12C3OC(C13)C2(C)O,0.2916
O=CC1CC2OC1C2=O,0.2214
CC1CNC2=C1OC=C2,0.2041
C1OC2C1C21CC2NC12,0.2917
COc1ccncc1O,0.216
OCC1CN1C1CCC1,0.2789
OCC1(C#N)C2CCC12,0.2937
C#Cc1c[nH]nc1,0.228
CC1=C(O)C(=N)N=CN1,0.1854
N#CC1COCC2NC12,0.2965
N=C1OCC1C1COC1,0.2702
CC1C2(O)CC1(O)C2,0.3139
C(=N)N(C(=O)N)C(=O)N,0.2563
CC1C(C=O)C2CN12,0.2086
C1C2C1N1C3COC2C13,0.3004
OCC1C(CC1=O)C=O,0.2221
OC12CN3C1CCC23,0.3132
OC12C3OC4C(NC14)C23,0.3007
CC1CNC2=C1OC=N2,0.1978
CCC1(COC1)O,0.3117
CC1C2CC3C(O)C2N13,0.3172
CCCC1C2OC1C2O,0.3012
NC(=O)CC1CC2NC12,0.2641
N=COC1C2CN2C1=O,0.2182
CC1CC(C=C1)C1CC1,0.2625
CC1(CC1)C#C,0.2972
CC#CC1CC1(C)C#C,0.258
CCC(C(C)=O)C(N)=O,0.2315
CC1=CCCC2CC12O,0.2482
CC12OCC3CC1C2O3,0.2998
CC12CC3(O)C1COC23,0.2974
CC1=CC23CC4C2C1N34,0.2143
CC1=CCC2CC1C2O,0.2488
OC1CC2OC3CCC123,0.297
N#CC1CCC2NC12,0.2954
CC1C2CC1C=CC2,0.2524
N=C1C2NCC2N1C=O,0.2129
C1CC1C2(CC2)C(=O)N,0.2694
CC1(C)C2C(CN12)C=O,0.2135
N=C1OCCC=C1C#N,0.2005
CC1C2(C)C3CC3C12O,0.2814
CC1CC(O)CC=C1,0.2656
CNc1cc(=O)cc[nH]1,0.2017
CC(O)C(C)C(=O)C=O,0.155
C(C=O)c1nnon1,0.1941
CC1(O)CC11CCC=C1,0.2469
C1OC11CC2CC3C1N23,0.3119
CC12CC(O)C1=CCO2,0.2242
CC12CC(=O)C1N2C=O,0.2163
CCC(O)C1CC2CN12,0.2976
CCOCCC(C)C#C,0.3086
C1CC23CC4(CCN24)C13,0.1833
CCC12NC(=O)C1C2O,0.2531
Cc1cc(=O)[nH]cc1O,0.1654
O=COCC1CCCO1,0.2809
c1cnc(nc1)NC=O,0.2042
CC12CC3(C#N)C1CN23,0.2563
CC1NC11CCOC1,0.3133
CC(O)C1NCC1=NO,0.2256
O=C1CNCC(O1)C#N,0.2351
CC(O)C(=O)CNC=O,0.2135
O=CC1CCCC=CC1,0.218
CC1(CO1)C1NCC1=O,0.2179
O=C1C2CCC11CCN21,0.2316
CC(CO)COC=N,0.2829
CCCCC1(C)CO1,0.3459
Cc1coc(n1)C(=O)N,0.2073
CC12CNCC(=O)C1O2,0.1935
c1c(cn(n1)C=O)C#N,0.2057
N=C1CC2CC2CO1,0.2828
COC1CC(C)(O)C1,0.3178
C#CC12CC3C4C1N4C23,0.2651
CCN=C(N)C(O)C#N,0.2444
CC1(C)CC(=O)NC1=N,0.249
c1c([nH]c(n1)CO)O,0.2303
C1OC2CC11OC1CO2,0.3214
OC1CCC11NC1C#C,0.2704
C1C(=C(CO1)N)C=O,0.1833
C1C2C3C4NC4CC1N23,0.285
N=C1CC2CN2C(=O)N1,0.2454
COC(=O)C(=N)NC=O,0.1989
CC1C2C=CC1C1OC21,0.2361
CC1C2CC1(C2)C#N,0.3285
CC1CCC(O)C(C)O1,0.3199
CC1CC(O)(CC#C)C1,0.2918
C#CC#CC12CC(C1)C2,0.2242
CCC1(O)C2CC(C)C12,0.3107
COC1CC1(C#N)C#N,0.2672
Cc1cnc(n1C)O,0.2456
c1cn2c(c1C#N)CC2,0.2276
NC(CC#CC#C)C#N,0.2265
CC12C3C(CN13)C2C=O,0.2247
O=CC12CC1N1CC21,0.2114
CC(C#N)C1NC1CO,0.2954
OC12CNC1=NCC2,0.2395
CC(C)C12NC1C1OC21,0.2752
OC1CCC(CC1)C#N,0.3143
CC(C)OCC(O)C=O,0.2237
C1C2C3CC(CCN12)O3,0.3015
CC[NH2+]CC(C)C([O-])=O,0.1507
CC(C)(C)c1cc[nH]c1,0.2507
O=C1CCC1CC#C,0.2173
OC1C2OC1C(=O)C=C2,0.1722
CC1C(C)(C)C1(O)C#N,0.2844
O=C1C2CC3C4C3N2C14,0.2097
CC1OC2C(C#N)C12O,0.2785
OC1C2CCCC12,0.314
CC(CO)C(C)(N)C#N,0.2975
CCC(C)CNC=O,0.2829
NC1=NON=C1OC=N,0.207
O=CC12CN1CCCC2,0.211
CCCC1(C)CC1C,0.3403
O=C1OCC2(CN12)C#N,0.2767
COC(CC=O)C(C)=O,0.2095
CC1CCC=CC=C1C,0.191
COc1coccc1=O,0.1956
CC1(C)C2NC2C1C#N,0.2775
N=C1ON=NOC1=O,0.2191
C1Cn2c1nc(c2O)N,0.2297
COCC(=O)OCCO,0.2774
CCc1c(cc[nH]1)N,0.2225
CC1OC2C(O)C(=O)C12,0.1962
CC1(CO1)C1=CN=NO1,0.2269
C1C2C3CC4CC2C13C4,0.3384
CC#CC1=CC(=O)CC1,0.1728
C(C(=O)N)N=C(C#N)N,0.2061
C1CC1CCCCC#N,0.3204
CC(O)C12CN1C(C)C2,0.3105
CC1CC2N(C)C12C#C,0.2684
OC1C2CCC2CC1=O,0.2246
COCCN1CC1C#C,0.2635
c1c(=O)[nH]c(c(n1)F)N,0.1511
CCC1C2C3CN3C12,0.2842
CC1CC(C)C(C)(C)C1,0.3657
CC1=C(CO)OC(=N)O1,0.2299
C1C2CC3OC2CCC13,0.3192
C1C=CCC1(CO)CO,0.2655
CC1CN1CC=O,0.2168
CC1=CC2OC2C1(C)C,0.2424
O1N=CC=C2C=NC=C12,0.11
O=CC1C=CCC11CN1,0.2091
CC1C2CC3CC1C2O3,0.325
OC1C(O)C1CCC#C,0.2815
CC1=C(C=NN1)C1CN1,0.2512
c1coc2c1NCCC2,0.2152
CC1CC(O)CNC1=O,0.2652
Cn1cc(nc1)C=O,0.2037
OC12CC1(CC2)C1CC1,0.3133
c1nc(no1)C2(CC2)O,0.2187
CC1C(=O)C2CC1(C)O2,0.2115
C1CC(O1)C1OCC=C1,0.2423
OCC1CC2CCC12O,0.3004
OC1CC2(C1)OC2C#N,0.2761
c1coc2c1oc(n2)N,0.1985
CC(OC1CC1)C=O,0.2245
Cc1coccc1=NC,0.1883
N=C1CN=CN1CC=O,0.194
C1C=Cc2n1nnc2O,0.1759
CC1CC11C2CC1CC2,0.3508
CN1C(=N)ON=NC1=O,0.1738
NC1=CC(=O)C(CO)C1,0.2075
CC1CC(O)CC1=NO,0.2506
CC(=O)C1CC2CCC12,0.2258
CC1(C)OC11CCC=C1,0.2484
CC12OC1(C)C(O)C2O,0.2878
CCOC1(COC1)C=O,0.2095
N=C1NC(=N)OCCO1,0.2553
CC1(OCC2NC12)C#C,0.284
N#CC1C2C=CCCN12,0.2324
O=C1CC2NC2CC=C1,0.1892
CC1(CO1)C#CCC=O,0.2166
C1C2C3CC1CC=CC23,0.2443
OC1C2OCC2C1C#C,0.2824
N#CC1OC1(C#N)C#N,0.2641
OC1CC1(C#C)C1CC1,0.2789
CN1C2C(C=O)C2C1=O,0.1932
CC#CC1(CN1)C#C,0.2513
CC1CC2NC2(C1)C=O,0.2179
C1=CC23C=CC4C2C1C34,0.2109
C#CCCCCCC=O,0.2285
CC1(CCC1)C1CCO1,0.3237
c1cnn(c1O)CCO,0.2532
COc1c(nc([nH]1)O)O,0.2342
CC1=CC2CC1(O2)C#N,0.2343
C(COC(=O)CO)O,0.2724
OC1C2N=COC12C=O,0.2154
O=C1OCC2(CC12)C#N,0.2615
CCC1OC(N)=NC1C,0.2778
OC1CNC1C(F)(F)F,0.3051
OCC12CC(=O)CC1O2,0.2269
c1c(c(=O)nc[nH]1)O,0.1965
N=C1NCC2OC12C#N,0.2303
C(C(=O)NC(=O)N)O,0.2481
CC1CC2(C)CC3C2N13,0.3201
C#CC12CC1OCO2,0.2563
N=C1OCC11NC1C=O,0.2174
CCC(O)CCC=O,0.2299
CCC1C2OCOC12C,0.3272
CC1C(C)C(=O)NC1=N,0.2492
CC1CC2=CC=NN12,0.2672
CC12CCCC11CC2C1,0.3352
C1CC2(COC2)OC1=O,0.2682
CC12C3NC1C3NC2=O,0.2498
CC1(C#N)C2CCC12O,0.2711
CC1=CC=C(CCC1)C,0.1835
COC1(C)CC(C)C=C1,0.2619
CC1CC2=NON=C2C1,0.2465
CC1(CC1)C(O)C#N,0.3074
CC(=N)OCC(O)CO,0.2835
C1OC2OCCC3C1C23,0.3202
Cn1nc(c(=O)nn1)F,0.174
CC(C)C(=O)C(C)C#N,0.2232
CC1=CCNC(=N)C1=O,0.1686
CCC1C=CCC11CO1,0.2644
COCC12CC(N1)C2O,0.3256
COCC12CC1(C)CC2,0.3175
c1c(c(n(n1)C=O)N)N,0.1836
COC1C(C)C1C(C)C,0.3095
CC(=O)C(O)C(O)C#C,0.2251
c1c(c(no1)C(=O)N)N,0.1754
CCC(C)(C)C#N,0.3551
CC1CC(O)(CO1)C=O,0.2173
CC1C2C(O)C1C2C#C,0.2934
CN1N=NC=C1C1CO1,0.2392
OC12C3NC1CC23C#N,0.2613
C1C2CC1C=CCO2,0.2485
CCc1nc(on1)CN,0.2337
c1c2c(oc1N)COC2,0.2183
CC12CC(=O)OC1CN2,0.2474
OC(C#C)C1CCCC1,0.2945
CNC(=O)CC1CCC1,0.2781
CC1NC2(CC12N)C#N,0.2374
OC1C(O)C(=O)OC1=N,0.2466
Cc1c(nc(o1)N)C=O,0.1796
CC1(CN1C(N)=O)C=O,0.2212
OC(CNCC=O)C=O,0.1953
CC1CCN(C)C(=O)N1,0.2844
CC1(CC1)OC(=N)C=O,0.1911
OC1C2CCC1(O2)C=O,0.2183
CC(C)(CC#C)CC#N,0.2911
CC1=CC2(CC2O)OC1,0.2286
Cc1cc(c(nc1)O)C,0.2064
CC(C1CC1)C1CN1C,0.3058
OC1CC2(CN2)C11CC1,0.313
CC1(CCCOC=N1)C,0.2614
C#CC1(CC1)CNC=O,0.2755
COC1CNC1C=O,0.2088
c1coc(n1)CCCO,0.2445
O=CC1=CC2CC3C1N23,0.164
CC1(C)CC=CC(O)C1,0.2587
c1nc2c(o1)c([nH]n2)N,0.2163
CC1OCC(O1)C(C)=O,0.2226
CC12CC1C(=O)N1CC21,0.2347
CC1=CC2CC2C2OC12,0.2373
CC#CC1C2CCC1O2,0.2845
CC(C1CC1O)C(N)=O,0.2748
COC1CC(=O)NC1C,0.2722
C1CN2C3C=CC2C3O1,0.2144
O=C1COC2CCC2O1,0.259
CC1(CCC1)C1CC1O,0.3078
C1NC1C1=NOC=N1,0.2341
N=CN1C2CCC12C#N,0.2321
OCC1CCCOC=N1,0.254
N=C1OC2CCC3C2N13,0.2767
OC1CC2NC1CC2=O,0.2213
CC1=C2COC2C2NC12,0.2295
CCC#Cc1c[nH]cn1,0.2191
CC#Cc1ccncc1,0.2006
CC1OC1C1=COC=C1,0.2377
CC12C3C1N1C3C(O)C21,0.2768
CC(C=O)N=C(N)C#N,0.1933
CC(O)C1(CC1C)C#N,0.3032
CNC(=O)CN1CC1,0.2768
c1cncnc(=O)c1O,0.1633
OC1C2C(C#C)C2C1=O,0.2093
COCC(OC)C(N)=O,0.2556
CC12COC1(CO2)C=O,0.2054
CC1OC2(C)CN(C)C12,0.2892
CC1C(C)C2C(O)CC12,0.3138
CN1CC=C(C)C1C#N,0.2298
COCC1=CCNC1=O,0.2254
O=C1CCC1OCC#C,0.2009
N=CN1C(=N)COC1=O,0.2382
OC12C3CC1C(C=O)C23,0.2214
COC1C2C1C1CC2C1,0.3297
CC12NC3C1OC23C=O,0.1951
OC1COC2C1CC2=O,0.1955
OCCCC1CCO1,0.323
CC(C)c1c[nH]c(=O)o1,0.2401
N=COC1=NOC=C1,0.2407
OC12C3C1C1C2C3C1=O,0.2177
CC1C2C3CN2C13C,0.3108
COC1OC(=N)NC1=O,0.2482
CC(C)(CO)OCC=O,0.2296
NC1=C(O)C(=N)N=NN1,0.1536
CC(O)C1=CCC(O)C1,0.2597
NC(=O)C12CC1N=CN2,0.2412
CC(=O)CC(=O)N,0.2142
C#Cc1coccc1=O,0.1959
O=C1OCCC2OC12,0.2505
C1CN1CCCC(=O)N,0.2654
OC1CC(O)CC(=O)C1,0.2208
C#CCC1(COC1)C=O,0.223
CN1CC1C1C2CCC12,0.302
O=CC1(NC1C#C)C#C,0.2125
CC(C)C1NC(=O)C1O,0.2707
CC(=O)N(C)C(=NC)N,0.2187
CC1C2(C)OC(C)C12O,0.295
OC1CCC(CC=O)=C1,0.2116
C1OC2C3C4CN(C34)C12,0.3013
CC(OC=N)C(C)=O,0.2278
COC1OCCC1CO,0.3345
c1coc2c1[nH]nc2N,0.2
ON=C1C=C2NC3C2C13,0.1355
CC#CCCC(C)C#N,0.2837
c1c(cc(nc1O)F)O,0.2321
COC1(C)COC1=NC,0.2656
CN1C2C(O)C1C2(C)O,0.2885
OC1C2CCN2C11CC1,0.267
CC12CCCC1N2C=O,0.2554
CC#CC12COC1C2O,0.2577
[O-]C(=O)C1CC2CC[NH+]12,0.1969
CC1C2C(C)C1C2=NO,0.2725
CC1=CC(=N)OC=C1F,0.1623
C1COCc2c1nno2,0.221
C#CCC1CC(C1)C#C,0.2993
CC(=O)C(CCO)C#C,0.2234
CC1CC(=O)C(N1)C#C,0.2
CC(=O)C12CC(C1)C=C2,0.2228
c1c(cnoc1=O)CO,0.1858
CC(C)C1CC1OC=O,0.2732
CCN1C(C=O)C1C#C,0.2043
CC1=NOC(=N)OC1=O,0.1902
CN1C=CCCNC1=O,0.2257
C1CC11COC2CC2C1,0.3017
CC(C=O)C(O)C1CC1,0.2218
C1CC(O1)C1=CC=CN1,0.2315
CC1=NCC(O)CCO1,0.2529
CC1C2N1C(=O)C2(C)C,0.2294
OCC1CCCC11CC1,0.3367
CC1CC(C1)OC=O,0.2864
c1cnc([nH]1)O,0.2555
CC1COC2C(O)C2C1,0.3057
CN1CC(O)(C#C)C1=O,0.2471
c1c2c(n[nH]1)NCCC2,0.218
CCN=c1onno1,0.2054
Cc1conc1C(=O)C,0.1998
CC12C3OC1C(=NO)C23,0.2432
COC12CC(OC1)C2=O,0.1966
c1c([nH]c(=O)[nH]1)CC#N,0.218
CCC1(OC1C=O)C#N,0.2126
CC12C3CC1C(CO)C23,0.3131
CC(=O)OC=NCC#N,0.2511
N=C1NC(=O)NC1C=O,0.2153
C#CCCn1cccn1,0.259
CC1=CC(O)CC1CO,0.2553
OC1CC2=CNN=C2C1,0.2508
CC1CC=C(CO)C1,0.2594
CC(C)C1CC(C1)C#C,0.3062
O=C1CC(CO1)N1CC1,0.2693
Cc1cn2c([nH]1)ncn2,0.2344
N=C1N2CCC2CC1=O,0.1685
COCC(C#N)C(C)C,0.3064
CC1=CCC2C3CC12O3,0.2347
CN(C=O)C(C#N)C#N,0.2553
OC12CCC11COC1C2,0.3079
CC(O)C1(C)C2CC1C2,0.3304
CC12CCC3CC1C23O,0.31
CC1NC(=O)OCC1=O,0.2143
N#CC1CC2CN=CN12,0.2347
CCC(=O)C(=O)NCC,0.1794
c1ccn2ccnc2c1,0.1776
OCC12CC1C(=O)NC2,0.2665
CCC(=N)NC(=O)CC,0.2346
CN1C2C3CCC2(O)C13,0.2665
CC1C=CC(C=O)C1O,0.2093
CC1(CC1)N2CCC2=O,0.2737
CC(C)C(O)C(C)=O,0.238
C#CC1CC1C1CC1,0.2879
CC1CC2(C1)OCC2O,0.3087
CCCC1OC1C#N,0.2941
CCCCC(CO)C#N,0.3088
CN=C1CC(O)C(=O)N1,0.2393
CN(C)c1[nH]c(=O)on1,0.2515
CNCC1(CCN1)C#N,0.2578
C1NC1C12NC1C1OC21,0.2679
O=C1CC2(CC#C)CC12,0.2322
CCOC1(CC1)CC#N,0.2976
CNC(C#N)C(N)=O,0.2374
OC1COC2=C1N=CO2,0.2238
CCC(=O)C1CCC1=O,0.206
Cc1cc(nc(=O)o1)F,0.1977
CCc1cnnoc1=O,0.1737
NC1=NCC(=N)NC1=O,0.1869
CC12OC3C1C(O)C23C,0.2972
Cc1cc(n(c1O)C)N,0.2263
OC1CCC2CCC=C12,0.246
CC12C3C1C1C=CC3C21,0.2484
CC1N=C2CC3N2C13C,0.1948
CNC(=NC)C(=O)N,0.2056
CCC1(O)COC1CO,0.2976
CC1(C)CN2C(C#N)C12,0.2627
C1CC11OCCC2NC12,0.3037
c1cnc(c(c1N)O)F,0.2161
Cc1nc(co1)N,0.2145
O=C1NCC2CC2C1=O,0.1841
CC12CN3C1CCC23,0.309
CN1CC(=CC1=O)N,0.2146
CCC12CC3C1N3CC2,0.3143
C1C2NC2C11COCO1,0.3084
OCC1(O)CC(O)C=C1,0.254
COC1CC1C(C)=NO,0.2344
CC1COCC=C1C=O,0.1923
Cc1c(=O)ncon1,0.1878
C#Cc1cc(no1)C=O,0.1841
C1OC11C2CN3CC1C23,0.281
CC1(OCCC=C1)C#C,0.259
c1c(=NO)cnon1,0.1697
CN=CNC(=O)C(C)O,0.233
CCCC(C)CNC=O,0.2829
OCC1C2CC(=O)NC12,0.267
CC12CC(C1)C2(C)C=O,0.2197
COC(C)(C)CC1CO1,0.3216
c1c(n[nH]c1N)C=O,0.1837
O=C1CC=C2CN3C2C13,0.1921
COCC1OC2CC12,0.3069
c1c(c(c([nH]1)O)N)N,0.2246
C1CN1c2[nH]c(=O)on2,0.2518
CCCCC(C=O)C#C,0.2202
CC1C2OC(=N)C12C=O,0.2188
CC([NH3+])C(C#C)C([O-])=O,0.2752
COC1C(=O)C2CC12O,0.2065
CN1N=NC=CC1=N,0.1622
C1CN(C1)C(=O)N2CC2,0.2739
N=C1OCC=CC11CN1,0.2373
O=C1CC2C3N2CC=C13,0.2033
OC1(CC11CCC1)C=O,0.2099
COCC1C(O)C1OC,0.2966
CC1=NC2CC2(C)O1,0.2604
O=COC1CN2CC1C2,0.246
CC(C)C1NC(C)C1=O,0.2161
CC12OC=NC1CC2O,0.2638
CC12C3CC1=CCCC23,0.2194
C1C2OCC3CCOC123,0.3074
CC1C2(O)CC(C)C12O,0.2892
COCC(=O)C1CN1C,0.2042
CC1CC2CC(C1)C2=O,0.2245
CCOC1OCC2OC12,0.3348
C1CC23COC4C2N1C34,0.3173
CC12CC3OC1(C=O)C23,0.2132
COC1C(O)C(=O)C1O,0.2048
O1C2C3C=CC=CC2C13,0.1786
OC1CC2OC1C21CC1,0.3102
CC1OC(C)C(C)C1C,0.3124
OC12CC3CC1C23,0.3205
CN=COCC(=O)C#C,0.1765
OCC1CC23CC(O2)C13,0.2974
c1[nH]c(=O)c(=O)on1,0.2027
CCC1CC1C1CC1O,0.3203
CCOC1=NCCOC1,0.262
OC12CC(C1)CCC=C2,0.2522
N=COCC=O,0.2165
CC1C(O)C11CCC1=O,0.2165
CC12CCC1C=CC2=O,0.188
OC12CC3CC1C2C=C3,0.2366
CC12CC3(O)C1N2C3=O,0.247
Cn1cc(nn1)O,0.2266
CC(C)C(O)C(=O)C#N,0.1852
Cc1cc2n(c1)C=CC2,0.195
CCOCCOCC#C,0.2728
CC1COC2C1OC2=O,0.252
CCC(CC=O)C#N,0.2258
OCC(O)(CC#N)C#C,0.2933
CNC(=O)N1C(C)C1C,0.2859
Cn1cc(ccc1=O)O,0.1566
CC(C#C)C(O)CCO,0.3053
[O-]C(=O)C1[NH2+]CCC=C1,0.2425
N=COC1C2CC2C1=O,0.2109
CC#Cc1ccccc1,0.1986
CC1C2C3C1N2C31CC1,0.3129
CC12CC3C(CC1=O)N23,0.2186
CC12CC1N1C=CN=C21,0.2246
CC1CC2CC(=O)C2C1,0.2155
O=C1NCC2CC1C=C2,0.2266
C1CN1C(=O)CC=O,0.2213
CC(=O)C1CCCC1,0.2335
C#CC12CC3CC3C1N2,0.2705
COC1COC2CC2O1,0.297
CC1CC(=N)NC(=O)C1,0.2443
CC1(O)C2OC1C2C#C,0.2786
CC([NH3+])C1=N[N-]N=N1,0.2655
OC12CCN=C1N1CC21,0.2204
CN1C(CC1=O)C#C,0.2723
ON=C1CNC(=O)C1O,0.2351
CC(CO)C(CO)C#N,0.3048
CC(C)CC(C#C)C#N,0.2972
C1OC2C1C21CCOC1,0.3099
Cc1c(nc(cn1)N)F,0.1844
CCC(C=O)(C=O)C=O,0.2019
CC1OC(C#C)C2OC12,0.2891
CCN=C1OC(C)C1C,0.2765
C1C(CO1)C#CC(=O)N,0.2317
O=CC1NCC2CC1O2,0.1991
OC1C2CC(N2)C1=O,0.2021
CC#Cc1c[nH]cn1,0.2195
CCC12CC3C(C13)C2=O,0.242
CC1C(=N)OCC1=O,0.2182
CC1CC1(O)CC#C,0.2919
N#CC12CC3C(C1)C3O2,0.2718
C1OC11CC2NC2C=C1,0.2333
N1C2C3C1C21OC=NC31,0.241
Cc1c(cc(cn1)F)N,0.1989
CN(CCCOC)C=O,0.273
CC(O)C12CCC1N2C,0.3045
CCC1=C(CC(=O)N1)C,0.208
Cc1c(nco1)C(=O)N,0.2271
OC12CC3=CC4C1N4C23,0.17
O=CC1CC2CN12,0.2122
CC1(C2CC1O2)N1CC1,0.3079
OC12C3C1C1C3CC21O,0.2886
CC1(C)COC(O1)C=O,0.2094
CC1C2N(C)C1C2=NO,0.2501
N=C1CC2C=CCC2O1,0.2624
CC1(C)CC1(C)CC#C,0.3098
CC1OCC(O)C=C1C,0.2515
O=CN1CC2CC=CC12,0.239
c1cc(ccc1O)F,0.2065
CC(C)(O)CCC1CO1,0.3258
CC12C3CC4CN(C13)C24,0.2848
N#CC1=CCC2CC1O2,0.2048
Cc1cnoc1C#C,0.201
CC1(CN1)C#CCC#C,0.2716
OCC(C#N)C(O)C=O,0.2331
CC(C)N=c1occo1,0.2316
CNC(=NC1CC1)C=O,0.1442
CC12CC(OCC1)C=C2,0.247
COC1=NC(=N)N=CN1,0.2017
CC1(CN1)C(N)CC#N,0.2896
CCNC(C)C(F)(F)F,0.3097
O=CC1(CC1C#C)C=O,0.2069
CC1C(C)C1C(O)C=O,0.2258
C1C2CC11COCOC21,0.3529
OC1CC2(COC2=N)C1,0.262
Cn1cc(nc1C=O)O,0.1604
C(=O)n1nnnn1,0.2099
CC1(CCOC=N1)C,0.2741
CC(CCC=O)C(N)=O,0.2251
CCC(C)OC(=O)CN,0.2619
C1NC11CN2CC2C=C1,0.2223
CN(C=O)C(=N)NC=O,0.2193
CC(C)C1(NC1C)C#N,0.2845
FC1=NC(=N)NC=C1,0.1701
CC1C(C#N)N1CC#C,0.2633
c1c(nno1)C(=O)C=O,0.1475
OC1(C#N)C2CCC1N2,0.2616
CC1(CCOCC1)CO,0.312
C#CC12C3C4C1N4C23,0.235
CN=C1OCC(=N)N1C,0.2355
CC1N2CC(O)(C2)C1=O,0.2043
CC1(O)C2CC1N=CO2,0.2447
CC1CC(O)C(=O)N1C,0.2724
CC1C2C3CCC1(O)C23,0.3121
CC12CC3(CC(=O)C13)O2,0.1872
OC1=NC(=N)N=CO1,0.2117
CC(C#C)N1CC1(C)C,0.2756
[NH3+]CC1=NC(=O)N=N[N-]1,0.1589
CC(=O)CC1(O)CC1O,0.214
NC(=O)C1OC1C1CN1,0.2332
CC1C(=O)CCOC1=O,0.2254
CC#CCN1CC1C#N,0.2634
Cc1c(n[nH]c1O)C#C,0.2178
CCC#CC(C)(C)CO,0.2986
CC12CCC3CC(O1)C23,0.3131
c1cc2c(nc1)CCN2,0.1867
CC(OCC=O)C#C,0.2281
COC1CC2(O)CC12,0.322
CN(C(=O)N)C(=O)OC,0.2764
Cc1c(nnn1C=O)N,0.162
CC#CC1CC(C)C1O,0.2842
C1C2C3C4CC(C2O4)N13,0.3106
OCC1CC1C(=O)CO,0.2346
COC(C#N)C(O)C#C,0.2894
CC1(N=CN2CC12)C#N,0.2414
OCC1=CCOCC1O,0.2566
C1CNC(=O)OCOC1,0.2924
O=CC12CC1CCOC2,0.2281
CCCC(=N)NC(=O)C,0.2334
CC#CC1CC(O)CO1,0.2886
CC12CC1C1N2CC1=O,0.2052
OCCCC1NC1C#C,0.2826
CC1C2(O)CC1(CO)C2,0.3248
N=C(C#N)N1CC1C=O,0.2014
CC1CC2(C)CC1(O)C2,0.3281
NC1C2OC2C1C#N,0.2684
Cc1cc(c(o1)C)NC,0.2079
CCC1N2C3CC3C12C,0.2802
CC1OCC(C=O)=C1N,0.183
O=CNC1CC2COC12,0.275
O=COC1C=CNC1=O,0.2036
Cn1cccc1OC,0.2383
C(c1c(n[nH]n1)C#N)N,0.2114
COc1ccncc1N,0.2041
CC(OC=O)C1(C)CO1,0.2743
CCC12CC1CC2(C)C,0.3275
CC1C(O)CN1C(N)=O,0.2821
CC1OC1C#CC#C,0.2149
OCC1(O)C2OCC12O,0.2647
O=CCOC1CN2CC12,0.2121
OC1C2C3CCOC2C13,0.3029
CCC12OC3CC1(O)C23,0.2876
Cn1cnc(=O)c(n1)N,0.1884
CC1=C(C)C(O)C2OC12,0.235
CC12CCOC1CCO2,0.3232
CC1(CC2CC12)NC=O,0.2752
Cc1nc(no1)O,0.2448
CC1(O)COC(C1)C#C,0.2864
CCCCC(NC)C#N,0.272
c1c(cnc(c1F)O)N,0.1823
CCC1(O)C(O)CC1=O,0.2117
CC(N)(COC=N)C#N,0.2712
CN=C1OC=C(C)C=C1,0.1617
CC1C(CN1C)NC=O,0.2502
OC1C2(O)CC2C11CN1,0.2943
C#CC12CC1NC=N2,0.2473
O=CC12CCC1(O2)C#C,0.2008
c1cnc(nc1)C=O,0.1772
OC12COC1=NCC2=O,0.1815
CCN=COCCC=O,0.2146
CC1OC=NC(C)C=C1,0.231
CCOc1ccn(n1)C,0.2391
CN1C2C3C1C2(O)C3=O,0.2122
CC1=CC(C)(O)CC1O,0.2512
N=COC1CCC11CO1,0.2756
NC1C(N)C1(C#N)C#N,0.245
CC1CC1CCNC=O,0.2819
CC1OCC2OC12C#C,0.2736
CC#CCOCC1CN1,0.2819
COC1(C)COCC=C1,0.2611
O=CC12C3C4NC1C4N23,0.2068
CC(=O)C#CC(F)(F)F,0.2023
CC12COC1CC21CC1,0.3088
CC1CCCC(C)=C1,0.2586
C#CC12CC1(OC2)C#N,0.2288
c1cc(nc(c1F)N)F,0.1966
CN1C2CC(O)(C2)C1=O,0.2627
COCC1NCCC1=O,0.2126
CC#CC1CC=CC1O,0.2625
CC12CC1(O)C(O)CO2,0.2782
N=C1COC(CO1)C#C,0.2681
c1c2c(co1)OCCO2,0.2307
OC1CCC=CCC1,0.2592
CCC(O)C1NC1C=O,0.2246
OC12CC1C(C2)C#N,0.2858
COCc1c(nco1)O,0.2187
CC1(C)NC1C=O,0.2198
O1C=NC2C=CC3C1C23,0.2331
CC12CN1C(=N)C(=O)C2,0.1683
CC1CC2(CC2CO)C1,0.3239
CNC1=CC(=O)C(C)C1,0.2074
CC1=C(COCC1=O)N,0.1909
N#CC1=NC2CC3C2N13,0.201
CC12CC3COC1C23O,0.287
CC1CN1C(C)(C)C#C,0.2712
C#Cc1cccc(c1)N,0.1837
C1C23CCCOC12CO3,0.2944
CC1(CC1)C(=O)CC=O,0.2178
C1C(=O)NC12COC2,0.2808
CCN=C1COCCO1,0.2585
O=CC1CC2OCC1O2,0.2204
OCC(CCC#N)C#C,0.3091
C#Cc1c(ocn1)C#N,0.1844
CC1(C)CCC1(N)C#N,0.2785
CCn1nnc(=O)nn1,0.149
CC1CC(C1)C(F)(F)F,0.3912
OC1CN=C2C1C1CN21,0.2411
OCC1(O)C=CCC1O,0.2652
O=CC1C2CC1C1CC21,0.2276
CCOC1(C)CNC1=O,0.2585
CN1CC1C(=O)C=O,0.1379
CC1(CCO)OC1CO,0.3321
NC=[NH+]C1=NOC(=N)[N-]1,0.0692
c1c(nnn1C=O)N,0.1653
C(=O)n1c(c(nn1)O)N,0.1664
CC1CC(C=O)C11CN1,0.225
NC(=O)C1C2OCOC12,0.2673
O=C1CC2CC12CC#N,0.2329
C#CCC1CC11CCC1,0.3097
CC1C(C2CN2)N1C=O,0.2529
O=CC12CCCC1N2,0.2225
ON=C1CC2C3OC1C23,0.2326
OC1CCC(=N)OC1=O,0.2546
CC12CC(O)C3C1CC23,0.3371
c1c(c[nH]c1N(=O)=O)N,0.1389
CC(C)C1COC1C#C,0.2748
C1OC2=NCCC3C1N23,0.2518
CC1COC(=N)C1C#C,0.2735
CC1(C)OCCC1C#N,0.2918
C1C2CC3CC4C1C2C34,0.3267
c1c([nH]nc1N)CC#N,0.2261
CC12C3C4C(CCC14)N23,0.3159
C[NH2+]C(C)CC([O-])=O,0.2771
O=C1CC2CC3C2N13,0.2384
CCOCCC1(CC1)C,0.3332
CCC1(C)COC1=NC,0.2822
COC(=O)C1CCN1,0.2374
CC12NCC1(O)CC2=O,0.196
CC(C#N)C(=O)CC#C,0.2191
CC(C)NC(=O)C(=O)N,0.2111
c1ncnc(n1)CC#N,0.2194
CCC12C3CC1CN23,0.318
NC(=O)C1(CO1)C1CN1,0.2586
CCn1cc(cc1C)O,0.2249
OC1CCC2C(C#N)C12,0.289
CC(=O)CC1(CC1)C=O,0.2181
COC1COC1,0.3167
CC12CCC1NC(=O)N2,0.302
OC1C2COC(C2)C1=O,0.2047
CCC1(C)COCC=C1,0.2653
COCC(C)(O)C#CC,0.2892
c1c(c[nH]c1C=O)C#N,0.1865
CC12COC11COC1C2,0.301
CC(C)CC1(CC1)O,0.3178
CC1C2COC1C2C#C,0.2827
c1c(noc(=O)n1)C=O,0.1492
CN(CC#C)C(=O)OC,0.282
OCC1C2NC2C2NC12,0.2881
CCC(CCO)C(C)=O,0.2307
CC1C2CC1C1OC21,0.3437
[O-]C1=COC=CC1=[NH2+],0.1364
CCC1(NCC1=O)C#N,0.2136
CN=C1OC(=O)C2OC12,0.2336
CC1CC(=NO)C1(C)O,0.2504
Cc1nc(n(n1)C=O)N,0.1992
CC(C1COC1)C(C)=O,0.2257
C1C(=O)OCOC(=O)N1,0.2553
CC1COCC11CCC1,0.3137
C1C2C1C13CC21OC=N3,0.2068
C#Cc1c(c[nH]c1O)O,0.2077
C1C2C3C4OCC3N1C24,0.3128
O=CC1CC1CC1CO1,0.2282
C(C#CC=O)C#CC#N,0.2035
CNC1C[NH2+]C1C([O-])=O,0.2419
N=C1CC2C3CC(O1)C23,0.2789
CCn1ncc(=O)nn1,0.1587
CC1C(C#C)N1CC#N,0.2616
OCC#CCC1CCO1,0.2757
CC12CCCC1CC2O,0.3112
C1C2COC3COC3C12,0.3207
CC1OCC=CC11CN1,0.2536
C1CCc2c(nno2)C1,0.2216
CC12CC3CCC1C2O3,0.2991
CC1CC1C1(O)CC1,0.3141
CC1CC1C1=NCCO1,0.259
N=C1OCCO1,0.3105
CN1C2CC1(C)C2=NO,0.2522
CC1CCC11C(O)C1O,0.2739
CC#CCc1cnc[nH]1,0.2502
CCCOC1CC2NC12,0.3075
CC1(C)C2C=CC1C2O,0.2428
CCN1CC2CC12C=O,0.1957
CN1C2C3OC2(C)C13,0.2908
OC1(C#N)C2CCC1O2,0.2821
c1cnn(c1)CCC=O,0.2126
CC12C3OC1C=CC23O,0.216
C1CC11OCC2CC1C2,0.3102
OC1C2CC1NC(=O)C2,0.2647
N=C1OCC2(CN2)CO1,0.2884
CC12CC1C=CC1NC21,0.2411
C1C2N1CC21COCO1,0.3067
CCC#CC12CC(C1)O2,0.2571
CCC(C)CCNC=O,0.2836
CC1CC2(C)N=COC12,0.2627
O=C1C=CCN2CC1C2,0.1673
CN1C(CO)C1C1CC1,0.2875
CC1CC(CO)=CC1=O,0.1934
N#CC1CCC2(CC2)N1,0.2589
OC1C2C3C4C1C2C34O,0.3013
CC1(C)CC2C3OC2C13,0.2939
OCC12CCC1CCC2,0.3348
CC(=O)C1CC2CN1C2,0.2209
N#CC1OC2CCC2=C1,0.2359
c1c(c[nH]c1O)CC=O,0.1817
c1[nH]c2nc(nn2n1)N,0.2097
C1CC=CCC=C1,0.255
CC1CC2(CC2)CC1O,0.3242
C1CCC(C1)C(F)(F)F,0.4037
NC(C#N)C#CCC#C,0.272
OC1C2C3C(=O)C1C23O,0.2413
CC12C3C4C1C2(C#C)N34,0.2323
CC1CC2(CN2)C(=N)O1,0.2705
CC1CC11CC(O)C=C1,0.2431
C1C2OCC3N4CC23C14,0.2159
N=C1NCCOC1C#N,0.2436
OC12CC1OC(=O)C2,0.27
O=CN1CCC1C#N,0.2597
COCC1(C)CCC=C1,0.2652
C#CC1CC2C3OC3C12,0.2916
CC1CC11NCC1=NO,0.2196
Cc1cc([nH]c1N)C#C,0.1869
CCC1CC(=NO)C1O,0.2449
CCOC(=NC)CO,0.2696
O=C1OCC23CC12CC3,0.253
CC1(C=O)C2CCOC12,0.2205
c1c(c(c(o1)CO)N)N,0.2149
O=CC12CC1OC2C#N,0.2237
FC1=NNC(=N)C(F)=N1,0.1518
OCCCC1COCO1,0.3313
Cc1c[nH]cc1C#N,0.2257
c1cocc1N2CC2,0.2264
COC(C)C(C)O,0.3248
O=C1COCC2CCN12,0.2556
Cc1c(c([nH]n1)N)NC,0.2397
FC(F)(F)C#CC1CO1,0.2711
CN1C2CCC1C2O,0.2692
CC1OCOC1CC#N,0.3072
CC12CC3(O)C1CCC23,0.3288
OC1CC2C3CC1CC23,0.3221
OC1C2CC11OCCC21,0.3158
OC1CC2(CO2)C1O,0.3109
CCC1(O)CCC2OC12,0.3187
CC(C)C(C)([NH3+])C([O-])=O,0.2688
c1c(ncc(n1)F)C=O,0.1743
CCOc1c(nco1)C,0.2308
c1cc2n(c1)C3(C2)CC3,0.2497
O=C1C2CC3C=CN1C23,0.2153
CN1CC(C1)(CC#C)O,0.2481
N=C1OCC2C(C#N)N12,0.2577
C1OCC23C4C5C(C24)C135,0.2931
CC([NH3+])C1=C([O-])NN=N1,0.2349
CN(C)CC#CC=O,0.1701
Cn1cccc1CC=O,0.1783
O=C1CNCC(C1)C#N,0.1956
COC1CC2OC12C,0.3246
N=C1CC=CNC(=O)O1,0.2324
C1CC1OC1CCC=C1,0.2554
NC1=[NH+]C2=C(C1)C=N[N-]2,0.1297
C1C(CN1C(=O)N)C=O,0.2078
CCCC1CN1CC=O,0.216
CC(CC#C)OC(C)=N,0.2887
CC1=CCOCC2NC12,0.2473
N=C1CC2(CO2)C(=O)O1,0.2493
CC1CC2(CCC12)C#C,0.2849
CC1C(CO)C2COC12,0.3071
CC1CC1C(=O)C#N,0.2057
CC(N)C1=C(N)N=NO1,0.1948
CNc1c([nH]cn1)C#N,0.1846
CC(O)C1OCC2OC12,0.3223
N=C1NC2COC12C#N,0.2312
CN1CC11C2CC1(C)C2,0.317
CC(=O)C#CC1(CC1)C,0.2074
CN=C1OC(C#N)C1O,0.2601
CC(C(N)=O)C1(C)CN1,0.2667
O=C1OCC11NCC=C1,0.2206
CCC12C=CC3OC1C23,0.2225
[NH3+]C1(CC([O-])=O)CCC1,0.2735
CC1C2CN2C1(C)C#C,0.2765
N=C1N=CN(C=O)N=N1,0.1686
N#CC12CC3CC1N2C3,0.2853
c1c2c(c(co2)N)[nH]n1,0.2028
C1C2CC3C4C=CC12N34,0.1935
CNc1cnc(o1)C#C,0.1736
O=CCC1C2COC12,0.2268
C1COCOCCO1,0.3382
CC1COC=NC1CO,0.2611
OC1C=CC23CC(O2)C13,0.2223
C1CC2C1C1CCC=C21,0.2399
NC(=O)C12CC1C=CC2,0.2481
CC1=CC2OC2C1C#N,0.2417
COC1C2COC12CO,0.301
O=C1CC=C2C3OC3C12,0.2196
COC1(C)COC(=N)O1,0.3088
CCNc1ncno1,0.2404
CC1C(C=O)C1C1CC1,0.2246
OC1CC=CC1N1CC1,0.2601
CC(O)C1=C(C)CCC1,0.2522
O=CC1CC2C(C#N)N12,0.2173
N1C2C3NC4C1C2OC34,0.2814
CC1(O)C2CC3CN3C12,0.2994
CCNC(=O)OC1CC1,0.3095
OC1C2C1C1CCC2C1,0.3108
Cc1cc(=NO)cc[nH]1,0.1716
OC12COCC1C=CC2,0.2612
c1c([nH]cn1)C#CC#N,0.177
COCC1CCCC1C,0.3257
Cc1[nH]c2c(n1)OCO2,0.2012
CN(C)C(=O)NC1CC1,0.2898
C(CO)C(CO)CO,0.322
CC1CC(=NO)C(=O)N1,0.1953
C#Cc1c[nH]c(c1O)O,0.191
OC1C2C=CC1C21CC1,0.2358
CCC12CCN1C(=O)C2,0.2366
N#CCC12CC3C1N3C2,0.2738
OC1C=CC=CC=C1,0.1823
CC#CC#CC(O)C=O,0.1893
O=CNC=NCC1CO1,0.2308
CC1(CCOCO1)C#N,0.2959
COC(CC=O)C#N,0.2233
OC12CC1C(=O)NC2=N,0.2261
O=C1CCCC2CC2C1,0.2231
CC(C)OC1CCC1,0.321
FC(F)(F)C1NC1C=O,0.2222
CC12CC1CC2OC=N,0.2801
CC1COCCC1C=O,0.2185
CCOC1CC1CC#N,0.3023
OCCC1OCOC1=O,0.2752
CCC1CCOC1C#C,0.2908
c1c2c(c[nH]1)NCC=C2,0.1952
COCC(F)(F)F,0.3493
CC(C)(CC(=O)C#N)O,0.1983
COC12CN3C1CC23C,0.3277
CC(C)C1(C)OC1C,0.3352
CC(O)C(=O)NC(N)=N,0.2254
CC#CC1CCC2NC12,0.2924
OCC1C2CC2(O)C1O,0.2881
CC1(CC#C)CC1C#N,0.2915
CC(CO)CC(=O)C#N,0.1946
NC1=CC(=[NH2+])O[C-]1C=O,0.1725
OC1CC2(O)CC1C2,0.3222
OCC#CC1(CO)CN1,0.2632
CC1OCC(CO1)C#C,0.2977
Cc1cc(co1)C#C,0.2118
CC12OC1CC(=C2)C#C,0.1984
C#CCOC(CO)CO,0.2817
CC12CCCC1OCC2,0.3134
COCC(C)C(=O)C#N,0.1837
CC1CNC(=O)NC1C,0.2902
CC1NC1C#CC1CO1,0.2571
CC12CC3OC3C1N2,0.3022
OCC12CN1C(=O)NC2,0.2873
c1c(c(=O)nc([nH]1)F)N,0.1896
C1OC11C=CC2OCC12,0.2402
C(CNCC#N)C#N,0.2771
C(=N)Nc1nc(on1)N,0.2268
CC1NC1(C#N)C#N,0.2667
O=CC1CC2(CN2)C1,0.2253
C#Cc1cc(n[nH]1)C#N,0.211
CCCCCC(=O)CO,0.2347
OC12CC3CC(=O)C1C23,0.2216
COC(C(C)C)C1CO1,0.3299
C1CC(=O)C2=C1NCC2,0.1944
CC1NC1C1C(C)N1C,0.2796
OC1(CCOC=N)CC1,0.2777
O=C1C=C2C=CC3C2N13,0.0714
c1[nH]c(c(n1)CO)C#N,0.2155
C1CC1C#N,0.322
CC1CC11CCC11CC1,0.3275
CC1(C)C(O)C1(C)O,0.295
OCC1(CN1)C1COC1,0.2922
CC(C#C)C1(O)CCC1,0.3019
CC1(N)C(CO)OC1=O,0.2646
CC1C(=O)C2(C)CC12C,0.2263
c1cn[nH]c(=O)c1N,0.1762
CC1CC(=O)CC1=NO,0.2179
COCCC12CCC1N2,0.3316
CC1CC2OC12C=O,0.2146
OC1C2OC2C11COC1,0.3147
CC1CC2(CO2)C(=O)N1,0.251
CC1CCC11COCO1,0.3287
CC1C2C=CC3(CO3)C12,0.2293
COC1C2NC2CC1C,0.3001
O=CC12OC3C(C13)C2=O,0.1893
CCOC1CC(O)C1,0.3268
OC1C2C3NC2C(=O)C13,0.2138
CCC1CC2OCC2O1,0.3297
C1OC23C4C5C4N(C12)C35,0.2706
c1nc(c(o1)N)CC=O,0.17
c1c(ncc(n1)O)C#N,0.1922
C1C2OC2C2=NNN=C12,0.2419
CC1(C)C2CCCOC12,0.3209
OCCC1N=CNC1=N,0.2267
OCC1NC1CC#N,0.2971
CC12OCC1C2NC=O,0.2657
C1CC2(CC2)OC1=O,0.2762
CC(CN1CC1)OC=O,0.2704
CC12CC1C1CC=CC21,0.2611
C(C(CO)NC=O)O,0.2782
OC1C=CC(=O)CC1=O,0.1774
C1CC2C3C4C1C2N34,0.3128
N=C1CC2C3CC3C2O1,0.2808
CC12CC(C)(O1)C=C2,0.2343
CC(O)CCC(N)=O,0.2802
CC1=CC(O)CC1=NO,0.1941
OC12C3NC3C1OC2=N,0.2579
OC1C2CC(C2)C1C#C,0.2947
CC1C2NC(=O)C=CC12,0.2011
CN1C2CCOC2C1=O,0.2557
N=C1ON=NN1CC#C,0.205
CC12CC1C1(C)CC2O1,0.3355
N=C1OC23CC(C2)C13,0.2717
OC(C#N)C(=N)NC=O,0.2274
O=C1C2CC3(CNC13)O2,0.2022
CC1C2NC1C2(O)CO,0.2769
CC#CC12CC1CC2O,0.2654
CC1(O)C(O)CC11CC1,0.322
C1C2(COC(=O)O1)CO2,0.3042
OCCC1CC1(O)C#C,0.2759
c1cnn2c1COC2=O,0.2339
C1CC1C12CC1C1NC21,0.2785
COCCCCN1CC1,0.3206
C(CNC(=O)N)C=O,0.2234
C#CC12NC1C1CC21,0.2329
OC1C2CNC(=O)C1N2,0.2483
c1c(n(nn1)CCO)N,0.228
CC1CN2C3COC1C23,0.3138
OCC1(O)C(O)C1C#N,0.2865
OCC1NC(C=O)C1O,0.2093
CCC1NC1C1(C)CO1,0.3167
c1(c(onc1O)N)N,0.2364
CC#CC(C=O)C#C,0.2126
CC(=O)CN1CC1(C)C,0.2221
CC1OCCC1CO,0.313
CN=COC1C(C)C1C,0.2659
CCc1ncnnn1,0.1621
CN=C1NCC1(O)CO,0.2545
CC1CC2C3COC3C12,0.302
N=COC1CCC11CC1,0.2805
CC1OCC1C1CC1O,0.3114
OCC1(O)C(O)C1C#C,0.2723
CC12COC(C=C1)C2O,0.2299
CC1CC2OC2C1C#C,0.3026
CC12CCN1C(=O)C2O,0.2267
OCC1CCCC1CO,0.3381
CC(C)CC(C)CO,0.34
CC12CNC(=O)CC1O2,0.2752
C1CC12CNCC(=O)O2,0.2401
OC1CC(O)C(O)C=C1,0.2504
O=C1NCCC(N1)C#C,0.2721
OC1(CNC1=N)C#C,0.2534
O=C1CC=CC(O1)C#N,0.2484
CCOCC1CC(C)C1,0.3385
N=COC1C2CC1C2,0.2807
c1c2c(c([nH]1)O)CCC2,0.2325
CCCC1OCC(C)O1,0.3402
O=C1NC23CC2(CC3)O1,0.2868
CC1C2COC1C(=N)O2,0.274
C#Cc1ncco1,0.2013
OCC12COC3CC1C23,0.3037
CC(C)C12CC1C1OC21,0.2913
COC1(C)CC2C1N2C,0.3089
COC1C2CC(O)CC12,0.307
CC1OCC(C=O)=C1C,0.1835
CC1(C)CC(=O)N1C=N,0.2287
CC1(C)C2C3C(O)C1N23,0.3061
O=CC1C2C3CC=C1C23,0.1712
O=C1CC23CC4C2NC134,0.1831
CCOC1=COC(=N)N1,0.2308
N=C1COCOC(=O)O1,0.2645
CCC1C2COC12,0.3111
CC1=NC2C3C2C(=O)N13,0.2103
CCC1OC1CC#N,0.3109
C(CC(CO)CO)CO,0.3264
O=CC12CC(O1)C1OC21,0.2123
OC1CCC(=O)C=C1,0.1873
CC(O)(C#C)C(O)C#C,0.2743
O=C1NC2=C(N1)OCO2,0.1955
CC1CC=CC(O)C=C1,0.2523
C1CC2CCCCC12,0.3543
CCOc1cnc([nH]1)C,0.2429
O=COC1C2CC1O2,0.2595
[NH3+]CC(O)C1=NC=N[N-]1,0.2654
CC1C2CN1C(C)C2=O,0.2044
CC1=CC2(CN2)CC1=O,0.1892
C1CN1C1C2OC=NC12,0.2575
O=C1NC2C3N=CN1C23,0.212
OCC1C2C3C1CN23,0.3074
CC1CC2N(C)C12C#N,0.2676
CC12CNC1CC(=O)O2,0.2575
CC1(C)CC2C(C#C)C12,0.2912
C(C=O)n1c(=O)onn1,0.2134
c1cnn2c1OC(=O)C2,0.2114
CC(CC#C)(C=O)C#N,0.2186
Cc1nc(on1)N,0.2521
OC12CC3CC1(C#N)C23,0.2789
C#CC12CCC=CC1N2,0.2243
c1c(c(no1)N2CC2)N,0.2157
C(C=O)OC=O,0.226
CC(C=O)C1CCO1,0.2176
CC1CC2OC2C(=N)O1,0.265
C#CCC(=N)NC(=O)N,0.2584
O=C1C=CCC11CN1,0.1927
CC12C3NC1=NCC23O,0.1763
C1OC1C1OCCO1,0.3387
O=C1OC2CC3C2OC13,0.2414
CC1=C(CO)NC(=N)O1,0.209
CC(CO)NC(=N)C=O,0.1675
CC(O)CC1(CN1)C#N,0.2978
C1OC2CC1OCCC2,0.315
ON=C1C2C3C(O)C2C13,0.262
c1cnc(nc1N)C=O,0.1801
CC#Cc1cocc1N,0.2007
CC12CC(C=C1)C2C#N,0.2363
CN1C2CC(O)(CO)C12,0.2796
OCC12CC3C4C(C13)N24,0.3059
CC1(CCOC1(C)C)C,0.3074
CCC1OC=NC1C#C,0.2691
OC12CCC11OC2C=C1,0.2161
C1OC1C12CCC1OC2,0.3108
CN1C=NC(=C1)C1CN1,0.2326
c1c(c(n[nH]1)C=O)C#N,0.1932
CCC1OC(=N)C1O,0.2828
C1CC2N=CNC2=N1,0.2286
CC1NC1(CO)CC#N,0.2844
C1C2CC11OC=NC1C2,0.2613
CC1(OCC1=O)C(N)=O,0.2045
CC(=O)CNCCC#N,0.2137
C1COC(=N1)NC(=O)N,0.2525
NC(=O)C1CN1C1CC1,0.2419
OCC1CC(C1)C1CC1,0.3385
CC1=CC(=O)[CH-]C(=[NH2+])N1,0.2017
CC1C=CC2=COC=C12,0.1993
OC1C2C3CCN2C13,0.3066
NC(=O)C12CC1NC2=O,0.2432
c1(nc(nc(n1)F)F)F,0.2647
CC12C3CC1C=CCC23,0.2552
CC1=CCCC=CC1=O,0.1807
OC12C3OC1C1(CN1)C23,0.2882
CC(C)C(C)(C)C,0.3704
CC1OC1CCC#C,0.3159
OC1C2OC(=O)C1C2=O,0.2092
O=C1NC2CC1C1NC21,0.2565
CC1(C)OC2C3NC3C12,0.2957
NC(=O)C1CC2C(O)C12,0.2436
CC(C)c1[nH]nc(n1)N,0.2333
CC1(CO1)C1CC1C=O,0.2257
CC12CC(C1)C(N2)C#N,0.2738
C1OC11C2COC1CO2,0.3251
COC12CN3C1C3(C)C2,0.2991
C#CC1OC2CC(C2)O1,0.2907
CCC(O)C(=O)NC=N,0.2318
CC1(C#C)C2CC1(O)C2,0.301
CC1=CC2CNC1C2=O,0.2119
C1CC(C1)C2(CCC2)O,0.3196
OC1CC=C(C#N)C1=O,0.181
CN=C(C=O)NC(=O)N,0.1813
C#Cc1c(nno1)C#N,0.1873
CC12CC1(C)OC(=O)N2,0.2972
CC1(O)CC2C3OC2C13,0.2912
CC1(C=CNC1=O)C,0.2162
CN1CC1C(=O)C#N,0.1624
CC(O)C(C#C)C(C)O,0.2928
CCC(C)C1OC1C#C,0.2798
c1cn(c(c1N)O)C=O,0.1664
CN1CC2(CC2)C1C=O,0.1964
CC1COC(=N)CC1=O,0.2241
CC1OC1(C)C(O)CO,0.3306
COC1CC1CCC#C,0.3062
CC1CC2CC(=O)C12C,0.2148
c1c2n(c(=O)[nH]1)CC2,0.2278
OC1C=CC2CCC12O,0.2438
C(CO)C(=O)NCC=O,0.2195
CC(O)C(C=O)C1CN1,0.2091
O=C(C#C)C1CC(=O)O1,0.2008
CNC1(C=O)C2COC12,0.2011
CN(C=O)C1CC1CO,0.2649
C1CC1C12CC(C1)OC2,0.3227
O=C1C2CNC(=O)C1N2,0.2184
N=C1OC2CC3CC3C12,0.291
CC1=NCC(=O)CO1,0.2033
C1OC2C3CC=CC23O1,0.2225
C1C2OC=NC3CN1C23,0.2392
CC1OC2=NCCOC12,0.2632
O1N=CC2=C1ON=N2,0.1545
C1CC(C1)(COC=O)O,0.2745
N#CCC12CNC1CN2,0.2618
CC1=CC2CC1O2,0.2348
CC12CC1(C)N1CC21,0.3135
CC1(CC1)CC1OC1,0.346
CC(=O)C1CCCCC1,0.2293
CC1CNC(=O)C(N)=N1,0.2009
C1C2CC1C1CCCC21,0.3743
C#CC(=N)NC(=N)C#C,0.1899
CCCOc1ccco1,0.2297
CCn1cc(nn1)N,0.2155
N=C1OC2C3CC1C2O3,0.2763
CCCC1COCO1,0.3397
OCC1CC2OC12,0.3287
CC1CC1C(C)(O)C#C,0.2977
N#CC1OC1CC1CC1,0.2823
CC(CO)C(C)(O)C#N,0.295
Cc1c(nnn1C)C#C,0.2253
C(c1[nH]c(c(n1)O)O)O,0.205
C1CC2CC=CC3C1C23,0.2472
CC(C)C12CCC1CO2,0.3097
OCC12CCC(CC1)O2,0.3296
CCc1cc(oc1)OC,0.2303
N#CC1(CNC1)C1CO1,0.2661
COC1CC2(NC12)C=O,0.2183
CC([NH+]=C(N)N)C([O-])=O,0.2597
OCC1(CC1)C1OC1,0.3302
CCC1OC1C(O)C#N,0.282
CCC1CC2CC1C2C,0.3715
OC12CC3CC(C1)C23,0.3201
OC1C2CC3C4C3C2C14,0.3106
CCOCC(CC)CO,0.324
CC12CC1OC(=O)CC2,0.2673
CC1CC2C(C1)C2C#C,0.2887
O=C1NC2(CC1C2)C#C,0.2563
O=C1CN2CC=CCC12,0.1982
C#CCN1CC(C1)C#C,0.2639
N=COC1CN2CC1C2,0.2528
CCC1OC2(C)CC12,0.3162
CC(C)(O)C(O)C#C,0.2946
CC(=O)C1CC(C1)C#N,0.2302
NC1(CC1(O)C#C)C#N,0.2457
OC12COC(C1)C1CC21,0.3087
c1c(coc1OC=O)N,0.1961
O=C1OC2C=CCCC12,0.2581
CC1OC2CC2(O)C1=O,0.2098
CC1CN2C(C#C)C12C,0.2576
CCOC=NC(C)C#N,0.271
CC1CC23CC(C12)C3=O,0.2518
N#CC1CC11CN2CC12,0.2686
CC#CC(O)C(C)O,0.281
CC1N2CC1(CC#C)C2,0.2754
CN(C)C(=O)CC1CN1,0.2625
CCOC1CCC(C)O1,0.3366
OC1C=CCC1=O,0.2227
CC#CC#CC1CC1C,0.214
OCC1N=CNCC1=O,0.2049
OCC12OC(C=C1)C=C2,0.2021
COC(C)C1=CON=N1,0.2289
CC1CC(C)C2(O)CC12,0.3242
O=C1CCC2COCC12,0.2193
CC1(CN1)C1(CO)CC1,0.3137
CNc1c[nH]nc1C=O,0.1679
N=C1CNCC2(CC2)O1,0.2441
CN1C(C#N)C11COC1,0.2607
O=CC1C2CC3CC3N12,0.2033
CC(CO)C1=NON=C1,0.2347
CC1CC(C)(C)C11CO1,0.3283
C1OC1C12CC=CC1O2,0.2475
OC1C2CCC22OCC12,0.2918
CC1C(CO)OC1=N,0.2846
COC1OCC2CC12,0.345
Cn1c2nccn2nn1,0.1965
CCC#CCC1COC1,0.2942
CC1(O)CC1C(O)C#C,0.2835
CC1(C)OC1CCO,0.3362
CC1C2CC(O2)C1=NO,0.2503
CC12C3OC1CC23O,0.2862
O=C1CC23CN(CC2)C13,0.2087
CC1=C(CCN1)C(=O)C,0.1755
OC1C2[NH2+]C(C12)C([O-])=O,0.2664
O=C1CC2CC(C2)CN1,0.2739
CC1C2C(C)N1C2C#C,0.2564
CC1CC1C=O,0.2288
OCC1(OC1C=O)C#C,0.21
Cc1c(cnn1C)C#C,0.2237
C[NH2+]C1C(C)C1C([O-])=O,0.272
CC12CC1NC(=O)O2,0.2989
O=CN1C2C=CC1C2=O,0.2356
N=C1NC(=O)CCC1=O,0.1911
NC1C(COC1=N)C#N,0.2606
CC1NCC=C(C)C1=O,0.1661
CC(=O)n1c(ccn1)N,0.1787
CC(C)C(N)C#N,0.296
c1nnnn1CC#N,0.2624
CC1(CN1)C1(CC1)C#N,0.2949
C1C2CN3C4C=CC13C24,0.2178
CC1CC11CCC1=O,0.2182
CC(C)C12CN3C1CC23,0.3013
Cc1cc(cc(c1)O)C,0.2182
O=C1CC(CCC#C)N1,0.2829
C1CC2(C1)C1CC2C1,0.3731
COCc1coc(=O)o1,0.2544
CC12CCC3(O)C1CC23,0.3294
OCC1OC11CCC1=O,0.2045
N#CC1=CC2C3C1CN23,0.1921
Cc1coc(c1C)N,0.2232
CC12CC1(C)C(C2)C=O,0.2115
C1C2C=CC3C=CC1C23,0.2324
CC12OCC1OC21CC1,0.2941
O=C1C2C3C4CN1C2C34,0.2339
OC(CCC=O)C1CC1,0.2294
CCC1COC2CC1C2,0.3175
Cn1ccc2c1nc[nH]2,0.2071
COc1c(cco1)CO,0.2294
c1c(oc(n1)N=CN)N,0.166
CC1C2C3CC1OCC23,0.3125
COC(C)(C)C1OC1C,0.3346
CC1C=CCOCC1=O,0.217
CC1C=CC2OCC12,0.2502
O=C1CCC=C1C1CO1,0.1946
CC1=CC(C#N)N2CC12,0.2349
CC1C2C3OCC3N12,0.2726
CNc1[nH]nc(n1)OC,0.2515
CCOc1cc(no1)N,0.2454
FC1=CC(=N)NC(=O)O1,0.2239
OC12C3C4C(C13)N4C2=N,0.2405
OCC(CN1CC1)C#C,0.2863
CC1(COCO1)C1CO1,0.3349
c1c(nco1)OCCO,0.2215
CN=COC1CC1(C)C,0.2703
CC12C3CC3N1CC2=O,0.2059
CC1C(CO)N1CC=O,0.1933
COC1(CC1C)C#N,0.2911
CC1C2NC1C2(O)C#N,0.2667
CCC(=O)C(=O)CC#C,0.1557
OCC1CC(O)C=C1,0.2595
c1c(c(n[nH]1)CO)CO,0.2551
CC1C2OC3COC3C12,0.3061
c1nc(c2n1CC2)C=O,0.2044
CC1OCC1(O)C=O,0.2176
OCC1C(=O)CC11CN1,0.2145
C1OC11C=CCCC=C1,0.236
CCc1nc(n(n1)C)N,0.2505
C1C2OC3CN1C1C2C31,0.3003
OC1C2OC1(C#C)C2O,0.2518
c1c([nH]nc1NC=O)N,0.2163
C#CC1(COC1)OC=O,0.263
CC1(CCO)CN2CC12,0.3059
c1c(n[nH]c1C=O)CO,0.1921
CC1CC(C)=C(C)C1,0.2534
CC1(CO)CC1OC=O,0.2707
O=C1NC2C(C#C)C12,0.2431
OC1C(=N)N2CC12C=O,0.2036
NC1CC(=O)OC1C#N,0.252
CC(C)C(OC=N)C#N,0.2833
O=C1NC2C3CCC12N3,0.2358
CC1NC2C(=N)OC12C,0.2547
c1c(noc1N=CN)N,0.1842
C(=O)c1c(nc(o1)N)O,0.1838
CC12CC3C1CCC23,0.3662
CC1OC1CC1(C)CO1,0.3474
CN=COC1CC=CC1,0.2649
CN1CC2CC(C2)C1=O,0.2678
CCC12CC1C(=O)C=C2,0.1862
OCC1(CC#N)CO1,0.3012
CC1OC1(CC=O)C#C,0.2238
[NH3+]CCN1CC1C([O-])=O,0.2532
OC12C(NC1=N)C2C#N,0.2462
OC12CCC1C1CC21,0.3026
C1OC2C1C1C3CC1C23,0.3241
OCC12CC(C1)NC2=O,0.261
CC1=CCN2CC12C#C,0.2328
OC1CCC1CNC=O,0.2797
NC1C2(O)CCC12C#N,0.2557
C#CC1CC2OC3C2C13,0.2844
CC(C)(C)C1C2COC12,0.303
O=C(C#N)C1CC1C#C,0.1805
O=CNC1CC2CC1C2,0.28
N=C1OC(C#C)C2NC12,0.2648
c1c2n(cn1)CC2,0.2569
OC1C2NC2C2CC1O2,0.2972
CC(O)C(C=O)C1CC1,0.2231
CCCC1(C)CC1C=O,0.2262
C1C=C2C=CCC22NC12,0.19
CCC1C2C3C=CC2N13,0.208
O=CC12CC(=O)C1O2,0.1946
CC1=CC2CC2NC1=O,0.2076
N=C1OCC1CNC=O,0.261
CCCOCC(=O)C#C,0.2081
CC1CC=CC1CC#C,0.2606
CN1CC1C1NC1(C)C,0.2897
CC12NC1CC=C2C=O,0.1806
N#CC12OC3CC1CC23,0.2625
CC(C)(C#N)C1CC1O,0.3151
O=C1CNCC(O1)C#C,0.2365
C1C2OCC3C4CC23N14,0.234
CC(O)CN(C=O)C=O,0.2164
CC(=O)C(CO)CC=O,0.2039
CCC1N2CC(O)C12C,0.286
C1COc2c(onn2)N1,0.186
OC1CC2CN2C1C#N,0.2634
OCCC1CC(O1)C=O,0.2127
OC1C2CC2C1CC#N,0.2995
O=C1CCC1C1CCO1,0.2127
OCC12CN3CC1C23,0.2968
CCCC1(O)C(C)C1C,0.3149
c1(=O)[nH]nnn1C(=N)N,0.2075
CCC1CC2(C)OC12,0.3339
CC1C2CC3C=CC2C13,0.247
CC1(N=CNC1=O)C#C,0.2232
CC1(CC2CN12)C#N,0.2779
OCC12CN1CC21CC1,0.3067
CC1C2CCC12O,0.3255
COC(C1CN1)C1CO1,0.308
Cn1cnc(=O)cn1,0.1819
CC12CC1C(O)CC2O,0.3184
C1CC2(C1)COC=N2,0.2645
COC(=O)N1CC2CC12,0.2839
OCC12CC(O1)C2O,0.3211
C1C(COCO1)CC=O,0.2262
CN1CC(O)C(=O)C1,0.1804
C(C(C=O)(C=O)C=O)O,0.1899
CC12CC(C=C1)N1CC21,0.2328
N=C1OCC11CN1C=O,0.2484
CC1(O)CCCC11CO1,0.3177
CC1OCCOC1=O,0.2576
CCC1(C)CC1C(C)O,0.3272
CC1CN2CC2(C1)C#N,0.2731
CC1(C)CC2(CN12)C#N,0.2597
OCC1C(=O)C=CC1=O,0.1547
CN=C1ON=CC(N)=N1,0.1554
CCC(OC)C1(C)CN1,0.3131
CCCC(=O)CCC#C,0.2311
C(C1CO1)C1OCCO1,0.3433
O=C1CN2CCC3C2C13,0.2029
CC(C)(C#N)C(N)C#N,0.2874
N=C1OC2CC=CC12,0.2577
NC1=C(N=NN1)C1CN1,0.2172
C[NH2+]CC[C-](C#N)C#N,0.0995
CC(=O)OCC(C)(C)O,0.2851
C1C2NC1C21COC=N1,0.2462
CC1C(O)C1(C#C)C#N,0.2644
c1c2c(no1)C=CCN2,0.1816
CC1=CC(N)C(=O)OC1,0.2365
COC(C)C(C)N1CC1,0.3219
Cc1cc(nn1C=O)N,0.1868
CCC12CC1C(O)C2=O,0.2127
O=CCC1=NC2CC2O1,0.2255
CC1C(C)(C)C1(C)C#C,0.2891
CCOC1OC2CC1C2,0.3463
Cc1c(cn(c1N)C)O,0.2292
N=C1OCOC11CCC1,0.2843
CC1NC(=O)N2CC12,0.2874
CCc1nc(nn1C)N,0.2267
CC(C)Cc1ncon1,0.2653
CCC1CC1([NH3+])C([O-])=O,0.2692
COc1cnc(o1)CN,0.2308
COCC1(O)CC2NC12,0.3039
CC1(O)CCC1NC=O,0.2794
CC1CC(C)(C#C)C1C,0.3075
N=C1NC=C(O1)C#C,0.1774
c1c(c(on1)C2CC2)N,0.2005
CN1CC(O)C1(C)CO,0.2825
C#CCN1C2CC1C2,0.2689
C#CC1=CC(=O)CC1,0.1711
CCC(C)C(C)(N)C#N,0.3
CC1(C)NC1(C)CCO,0.2877
C#CC12CCC1OCO2,0.2818
CCC1N(C)C11COC1,0.2963
CC(COC=N)C#N,0.2848
CCC(=O)COCC,0.2349
CC1(CC1)C1(CO1)C#C,0.2845
c1c2n(c(=O)cn1)CC2,0.1745
C#Cc1c(cccn1)N,0.1735
CCC1(C)C=CCC1O,0.263
CC12CC3C1C2(O)C3=O,0.2359
COCC(CO)OC=O,0.2746
CC(=O)C1CC(O)C=C1,0.2119
CN1C2COC(=N)C12,0.2541
FC1=NC(=O)OC(=N)O1,0.2435
COC1OC2C3OC1C23,0.2834
C#CCOC1CCCC1,0.2859
c1c(c(on1)N)NC=N,0.2027
C1CC2C=CC1C1OC21,0.2511
CCCOCC#N,0.293
CC1OC2C1OC2(C)C,0.313
O=CN1CC2CC(C1)O2,0.265
CN=C1OC=C2CCN12,0.2109
CC1C2(C)COC12C#N,0.248
OC12CC1(OC2=N)C=O,0.2016
CC1CC2C3OC2C13C,0.3049
CC1CN2C(C=O)C12,0.2032
C1CN1C(=O)C(=O)N,0.1967
Cc1nc(c(o1)N)O,0.2162
C1CC(O1)C1=CCOC1,0.2345
CC1(O)CC(C1)C=O,0.2248
O=CC12CC3C1C1C2N31,0.2101
CN=c1cc[nH]c(n1)F,0.1927
CC12C3CC1=CCC2O3,0.2108
CC(=O)N(C=O)C1CC1,0.2343
CC12CC1(C)OC(=N)C2,0.2701
C(C=O)C(=N)OCC#N,0.2318
CC1(C)NC=NC1C#C,0.2498
OC(C#C)C1=CCOC1,0.2353
CCCC(C)C1OC1C,0.3406
N#CC1C2CN3CC1C23,0.2419
OC1CC=CC(C1)C#N,0.2648
C1CC11C2C3CC1CN23,0.3295
CNC(=O)C1C2COC12,0.2643
O=CC12CC3CC1N23,0.2187
C1C2C=C3CC4C(C12)C34,0.2148
C#CCOc1cnno1,0.2185
CCC1C=CC2NC12,0.2438
OC1CN(CC#C)C1=N,0.2527
CCC(=O)CC(=O)C#C,0.1787
CN1CC2(C1)C(=O)CN2,0.1945
CC1(COC2CC2)CN1,0.3218
CCC1(C#C)C2CN1C2,0.2573
CC12CCOC1COC2,0.3182
NC(C#N)C(F)(F)F,0.2941
CC1(C)CCC1C(N)=O,0.2678
C#CC12CC3(CN3)C1N2,0.2726
CC1(O)CC1N1CC1,0.3123
CC1(CC1)OC(=O)NC,0.3131
CC1CCC(C)(O)CC1,0.3241
CC1(CO)CC2OC12,0.3187
CC1CC(C)N1C(N)=O,0.2805
CC(CC#C)C(C)=NO,0.257
NC(=O)C12CC1CCC2,0.2726
C1C2CC3=CC=CN3C12,0.2401
CC1CC2C(C#C)N2C1,0.2545
CC(OC=O)C1CCC1,0.2852
OC1C2CC1C(O2)C#N,0.2701
CC1OCCC11CC1,0.3242
OC1CC2OC1OC2=N,0.2796
CC1CC2CC=CC12,0.2595
COCCCCOC,0.3404
COC(C#C)C(C)C#N,0.2971
CCC1(O)CN(C)C1=O,0.2679
C1C2CC1C1=C2COC1,0.2286
Cn1ccc(c1)C2CC2,0.2388
CN1CC2(C1)OC2C=O,0.1848
CC1C(C)C1COC=O,0.2828
C(C(C#N)(C#N)O)O,0.2839
CCC1OC2CCC=C12,0.2435
CN=C1CC2(O1)COC2,0.2791
OC1C2CC(C2)OC1=O,0.259
CC(=O)C(C)(O)CO,0.2274
CC12C3NC3C1(O)C2O,0.2912
CCC1(O)C2CCC12C,0.3042
C1C2C3OC1CC=CC23,0.2393
CN1CC2N3CC1C23C,0.2866
OC12CC3(OC1C23)C=O,0.1903
C1C2OC3(CCC3)C12,0.3085
NC(CO)C(=O)NC=O,0.2116
C1C(=O)C(N1)(CO)CO,0.2149
COc1cnc(o1)CO,0.2175
CC1C2CC(C2)C11CO1,0.3385
C#Cc1cccn1C=O,0.1714
c1cc(ncc1F)C#N,0.2092
CN=C1OC2(C)CC12O,0.2685
OCC1(O)CC11CCO1,0.281
C1CN1c2c(onn2)N,0.1985
CC(=O)C(C=O)C1CO1,0.2024
NC1=C(F)N=NNC1=O,0.1663
C1COCC1=NO,0.2511
C1CC2CCCCC2O1,0.3259
CC12C3CC(=O)C1CN23,0.2172
CCn1ccn(c1=O)C,0.2246
CCC12CC(CC1)C2=O,0.2273
CC#CC12CC3C(O1)C23,0.2549
CC1C(O)C2C(O)CN12,0.2547
C1C2CC3OC=NC3C12,0.2723
CC1CCCCC(O)C1,0.334
N#CC1OCCC2CC12,0.2891
CCc1[nH]cc(n1)C,0.247
COC1(CC1O)C#C,0.2678
CCC#CC(C)C(C)C,0.2974
C1C2OC3C4C3N1CC24,0.2989
COC1CCC(C)C=C1,0.2568
CC1(CN(C1)C)C#N,0.2615
CC1C(C=O)N(C)C1=O,0.2042
C#CCC12CCC1N2,0.302
C1CC2CCC3C1C3C2,0.3229
CCOCc1ccno1,0.2444
CNC(=O)C(=O)CC#N,0.1794
OC1C2C3C4C(N24)C13O,0.298
NC1=NC(=N)C=NO1,0.1932
CCOC12CNC1C2O,0.291
CCCC(CC#N)C#N,0.3403
CC1CC(C)C1O,0.3103
CC1OCCCN=CO1,0.2574
OCC1(O)CC1C1CC1,0.2945
OCC(CCC=O)C#C,0.2286
COCCC1(CO)CN1,0.3137
C#CC1(CC#N)CCO1,0.2769
CC12NC1COCC2=O,0.2109
CNCC1(OC1C)C#N,0.2387
c1c(c(no1)N)OC=O,0.2297
NC1(CC11CCN1)C#N,0.2478
CC1C=CCCN1C=O,0.2496
OCC1CC(C1)OC=N,0.2818
O=CC1C2C3OC3CN12,0.2166
CC1(CC#N)OCC1O,0.2905
C1C2OC3CCC1CC23,0.3153
NC1COCC1(O)C#N,0.2515
c1c(onn1)C#CC=O,0.1726
CN=C1NC2CC2(C)O1,0.2702
CC12CC1(C=O)C=CC2,0.213
CC12C3CC1(CC23)C#N,0.2779
C#CC1=C(CCC1=O)N,0.1902
CCC1(CCC1)C#C,0.3047
CCC1OC(C)C1=NO,0.2433
OCC12CC1N1CC21,0.2862
CC(=O)CC12CC1CC2,0.2224
CC1C2CC1N2CC#C,0.2687
c1c[nH]cc1CCCO,0.2506
N#CCCC1C2CN1C2,0.2808
C1C2C3CN4C1C4C23,0.3113
CC1C2C=CC1C2C#C,0.229
CC1(C)C2N1CC21CN1,0.2904
CC1(CN1)C1=CN=CN1,0.2444
CC12C3OC1C1C3OC21,0.297
COCC#CC(=O)CO,0.2103
CC1C(CO)C1C=O,0.2215
O=C1C2OC1(C=C2)C#C,0.2345
CN=c1cc(cno1)N,0.1534
CC1[NH2+]C(C1O)C([O-])=O,0.2646
C#CC12CC(CO1)CO2,0.288
OCC(CC#N)OC=N,0.2827
C(C1CO1)C1C2CCC12,0.3407
CC1(C)CN2CC2C1=O,0.2154
CCC(C)C1OC1CO,0.3362
C#CC(=O)OCC1CC1,0.2371
COC1C2OC1C21CC1,0.3135
COC1CCC=CC=C1,0.193
COCC1=CC2CC1O2,0.235
CC1=CC2CCC2CC1,0.2559
OC12CC(C1)(NC2)C#N,0.261
CC1(CC=O)OC1CO,0.2231
COCC1CC2CN12,0.3148
CC1=NC(O)=COC1=N,0.1481
OC1(CC1)C1(CO1)C#N,0.2762
OC1COC(=N)C1C#N,0.283
OCC1C2CC3CC2N13,0.3148
O=C1OCCOC1C#N,0.256
CC1(C)CN=C2OCC12,0.2654
COC(=O)C1OCC1C,0.2535
CCC1=CCOC1=O,0.23
CC1(C)OC(=O)C1(C)O,0.2633
OCC1CC2CC(C1)O2,0.3074
OC1CC1C1COC1,0.3126
O=C1N=NOC(=N1)C#N,0.2155
C#CC#Cc1conn1,0.1846
COCC1CNC1=O,0.2808
COc1ccc(o1)CO,0.2192
CCC1C(OC1=O)C#C,0.2746
C(CC#N)COCCO,0.301
OC1COC2=CON=C12,0.2102
CNC1C2CNC12C#N,0.2273
CCC1C(=O)OC11CC1,0.2795
C(C#N)c1c(onn1)N,0.2102
OC1C2CNC1C(=O)O2,0.2446
CC12CC1C(=O)OCC2,0.2616
CCN1C(=N)NN=C1O,0.2413
O=C1CC2OC2C=C1,0.1815
OCC1C=CC2CC1O2,0.2395
O=C1NCC2CC12,0.2679
C1CC11C2CC1COC2,0.3288
CC1N2C3C4OCC13C24,0.3068
CC1=C(N=CN1)C1CO1,0.2384
C(CCO)CC(F)(F)F,0.3436
CC1OC1(C)C#CC#N,0.2278
OCC1CC11CCC1,0.3253
O=C1C2C3CC4C1N4C23,0.2179
O=C(C#N)C1NC1C#N,0.1952
C1OC2CN3CC=CC123,0.2144
CCC1(O)CC1C#CC,0.2792
OC(C#C)C1(CO1)C#N,0.2729
CCCC1OCC(=O)O1,0.2763
CC1NC11CNC(=O)C1,0.2754
C(C#N)c1nc(no1)O,0.2373
CC1=CC(=O)CC1,0.1947
c1ccc(c(c1)C=O)F,0.1877
CC1CCC2CC12CO,0.3324
N=C1OCCN1CC#C,0.2641
CC1C=CC2C(O)CN12,0.2338
NC1(CC1(N)C#N)C#C,0.2584
CCN1CC(=O)C1C#C,0.2084
CNC(=O)N1CC(=O)C1,0.2154
CN1CC2C3C1C(=O)N23,0.2071
C1C2CC3OC(C=C3)C12,0.25
CC(C)C1OC1CO,0.3364
CC#CC#CCC1CC1,0.2264
CN1C(C#N)C1C1CN1,0.2537
C#CC1CN2N=CC=C12,0.2638
CC1CC2(CC2)CO1,0.3328
N=C1CC(CC2CC2)O1,0.2888
CC1CC(C)OC(=O)C1,0.2716
C1OC1C1=NOC=N1,0.242
CC12COCC1(N2)C#C,0.2806
N=COC1CC1CC#C,0.2758
CC(C)CC(CO)C=O,0.2274
CC(OC=N)C#N,0.2832
OC1C2OC2C1C#C,0.2855
CC12CC3C1CC3(C)C2,0.3587
CCNc1c(non1)C,0.2109
CC1OC2CC2C1=O,0.2194
Cc1cc(=O)[nH]c(n1)N,0.1985
C(COC=O)OC=O,0.286
OC1CC2(CC2C#C)C1,0.2844
CC(=O)n1nnnn1,0.2127
CC1OC2C3CC3C12,0.3142
CC(C#N)C1NCC1O,0.2693
O=C1C2OC2CC11CO1,0.2012
C1CC1N2CC2,0.3114
C1CC1C1C2C3C1CN23,0.3196
CC1(CC=O)COC1=O,0.2244
CC1OCCC(O)C1O,0.3146
C#CC1CCCC2CC12,0.3144
CC12CC1N1C(C=O)C21,0.1966
CC1(C)OC2CC1C2O,0.2983
C1CC1(CCO)CC=O,0.2243
CCC1C2OC2C1C#C,0.2901
CC(=O)Nc1cc[nH]c1,0.2155
CCCC1CC1OCC,0.3308
CC1CC1C1CC1CO,0.323
C1C2C3C=CCC=C1C23,0.202
C1C2CCCOC12,0.3058
CCc1ccc[nH]c1=O,0.1783
OCC1CCC2CC2C1,0.3336
C#CC1C2CN=CN12,0.2309
CC(C)(C)C1(CCC1)O,0.3173
Cc1nc[nH]n1,0.27
O=CNC1C2C3CC2C13,0.2773
CC1C(=O)C=CC1=NO,0.1693
N=C1OCC1(C=O)C#C,0.216
CC(=O)Cc1cocn1,0.2201
C1C2C3C4C5C(C5N23)C14,0.3035
N=C1OC2CC1C=C2,0.2371
CC(C)c1c(n[nH]n1)O,0.2314
NC(=O)N1N=CNC1=N,0.2076
CCOc1nc(no1)O,0.2579
OCC1COCC=C1,0.265
CCC1C2C=CC1N2C,0.2137
CNC(C=O)C#N,0.2042
O=C1C=CCC1CC#C,0.1859
Cc1cc2c([nH]1)CC=C2,0.1881
ON=C1CCCOC1=N,0.213
OC12CC3C1CN3C2,0.2842
CC#CC(O)C(C)=O,0.2182
O=C1CC2OC1CCO2,0.2131
CC1COC2CC3C2C13,0.3189
O=C1CCCC11CO1,0.2059
CC(=NC)OCC#N,0.2793
O=C1NCC(=C1)C1CN1,0.2123
NC1(CCC1C#N)C#N,0.2753
CCC1(COC=N)CO1,0.2815
CC1=CCC(C=O)C1O,0.2273
OC1CC2C3OC3C2=C1,0.2381
OC12CNC1CNC2=O,0.2561
C1N2CCCC3OCC123,0.3051
CC1(CC1(O)C#N)C=O,0.2231
CC(O)C1=C(C)N=NO1,0.2241
CC1CCC=CC1C=O,0.209
CN=CN1C2CC2C1=O,0.2198
CC12CC1C(CC#C)C2,0.3023
O=CC1CC=C2COC12,0.2213
COCC#CC(C)CO,0.2821
OCC1CC1(CO)C=O,0.2245
CCC1OCCO1,0.3434
CC1C2COC1C(=O)C2,0.2085
C1COC1=NCCC#N,0.276
N=C1OCC2COC1C2,0.2724
O=C1CC2C=CCC2=C1,0.1939
CC1OC1(C)C=O,0.2198
CCC1COC(C1)C#C,0.2922
C1OC2C3CC1CC2O3,0.3191
CC1(C)C2CCOC12,0.3153
C#CC#CCCC1CO1,0.2311
CC1=CC(C=O)C2NC12,0.2093
CC(=O)C1(CC1O)C=O,0.2202
CC1CCC1CCCO,0.3415
CC1=C(OC=N)ON=C1,0.2185
Cc1c(onc1N)C#C,0.1984
CC1CC11CC(O)C1=O,0.2034
COC(=O)COC=O,0.2668
CCC1(C)OC1CC#N,0.309
OC1C(O)C1COC=O,0.2666
CC12CC3CC1CC23C,0.3396
O=CC12CN1C1CC1C2,0.2164
OC1COCC(O)C1O,0.2896
CC#CCOC=N,0.2803
C1OC2C3C4C=CC3C124,0.2228
CC(O)C(C)(O)C#C,0.2969
CC1(O)CC(C)(O)C1,0.3201
N#CCC12CC(C1)C=C2,0.2388
Cn1c(cnc1O)O,0.2435
CCC(C)N1CC1C=O,0.2097
C1CC1OC(=O)CN,0.2603
CC1C2CCC(C)=CC12,0.2461
CC1C2CC3(CO3)C1O2,0.3221
CN=C1C(=CCO1)C=O,0.1702
CC1C2CC(C2)NC1=O,0.2646
COc1ncon1,0.2474
CC(C#C)C(C)=NO,0.2557
CC1(CO)CC1CO,0.3297
CC1N2CC3C2C13C,0.3094
OC1CC23COC2C1N3,0.2738
COCC1(CC1C)OC,0.3213
C1CC12C=CC(=O)N2,0.2051
CC12C3C4C=C1CC4N23,0.1222
C1C2NCC3OCC12O3,0.2948
CC(COC=N)C#C,0.2836
c1c2c([nH]n1)OCCN2,0.2326
CC1(CC1)C1(C)CCO1,0.3262
Cc1c(oc(=NC)o1)O,0.24
Cc1nnc2n1nco2,0.2167
Cc1c(cn[nH]1)C(=O)C,0.2115
C#Cc1c(cc[nH]1)C=O,0.1748
CC(C)(c1ccno1)O,0.2447
CN(C)c1c(n[nH]n1)O,0.2028
C1OCC2C3NC3C12,0.2942
CN1C2C=CC1C21CO1,0.2268
C#Cc1ccc(cc1)F,0.202
OC1CC1C1COC=N1,0.2284
OC1=CNC(=N)N=C1O,0.1546
C1OC23C4C5C2C(C13)N45,0.2808
Cc1cnc(nc1N)O,0.2112
CN1CCOC(=N)C=C1,0.1898
C1CC1N1C2COCC12,0.3199
Cc1c(ccn1C=O)N,0.1649
Cc1ccn(c1)C(=O)C,0.191
NC(=O)C12NC1C1NC21,0.217
CC(CC1CO1)OC=N,0.2804
NC(C#C)(C#N)C1CO1,0.2724
OC1(C#C)C2CC1C2=O,0.238
CCCCC1CC(=O)O1,0.286
C1CC2C3NC3C3C1N23,0.2818
c1cnc(nc1C=O)F,0.1702
C(COCCO)C=O,0.2284
C1C=C(C(=O)O1)NC=O,0.2036
CC(C)c1ccc[nH]1,0.2426
CC#Cc1c(cc[nH]1)N,0.1876
CC1C2C1C1(CC1)C2O,0.3185
C1OC2C3NC1COC23,0.2697
OC1CC(=O)CC1O,0.2232
c1(noc(=O)o1)C(=O)N,0.2189
CC1(C)CC2CC(=O)N12,0.2342
Cc1c2c(c[nH]1)nco2,0.1949
CCc1c(onn1)C#N,0.2037
OC1COC=NC1C=O,0.2122
CC12C3C=CC(C1O)N23,0.21
CC1C2NC(=O)C12CO,0.2508
C#CC12C3OC4C(C14)C23,0.2553
CC1OCCC1(C)C,0.313
CC12OC1C=CC21CC1,0.2359
COc1nc(=O)onn1,0.1699
NC1C2OC1(C#N)C2O,0.2371
C#CC1C2C3CN3C12,0.2594
CC12CC(CO1)C2CO,0.3072
CC(C)C(C)CNC=O,0.2807
O=C1OC2CC11NCC21,0.239
CC#CC1(OC1C)C#C,0.2516
CC1=C(NN=C1)OC=N,0.2367
OC1C(=N)OCOC1=O,0.2556
CC#CC12CC(O)C1O2,0.259
OCC1N=COCC1=O,0.2051
CC(C)OC1CCC1C,0.3176
c1ncn2c(n1)ncn2,0.1972
CC1CC(O1)C#CC#N,0.2223
CCn1ccc(c1C)N,0.2249
C1OC2C3CC12C1NC31,0.2961
CCc1nc(c(o1)N)C,0.234
c1c2n(nc1CO)CC2,0.2597
c1c(c(co1)N)N,0.2312
CCNC(=N)C=O,0.1702
CC(C)C#CC1(CC1)C,0.2836
CNC(=O)C12CN1CC2,0.2634
CN1CCOC(=N)C1,0.2504
C1OC11CC2CCC12,0.3229
OCCC(O)CC=O,0.2229
CC#CC(=NO)C#CC,0.1789
NC1=NC2CC2(O1)C#N,0.2465
CC12C3CC1C(=O)CN23,0.2166
CCCC1OC1CC=O,0.225
C1C=CC(=O)COCO1,0.1783
N=COCC1NCC1=O,0.2098
CCCC1(COC1)C#C,0.2923
CCC(C)(CO)N1CC1,0.3085
CC1C(C)N1CC1CO1,0.2969
CN1CC(C1)OC,0.2949
OCC(COC=O)C#C,0.257
c1nc2c(o1)[nH]c(=O)[nH]2,0.1939
c1c(c[nH]c1O)N,0.2342
CC1C2OC1(C)C2O,0.3022
CC12NC1CC21CCC1,0.2953
OC1CC2(C1)C1CC2C1,0.3287
CCC1C2C3C4C3N2C14,0.2927
CC12CCN1C2C1CO1,0.3095
CC1CCC=CCO1,0.2627
C1CC1OC1CN2CC12,0.3122
c1(c(non1)N)N,0.218
OC1CC11OCC1=O,0.2116
CC1CC2(C1)C1CCC21,0.329
CN1CC2NC(C1)C2=O,0.2012
CC12C3CC4N1C4(C)C23,0.3042
C#CC12CC3C4C3N1C24,0.2606
C1OC23C=CCC2OC13,0.2304
C1NC11CCC2CN2C1,0.2945
COC1CCC(CO)=C1,0.2594
c1c(c(n[nH]1)N)N2CC2,0.2239
CCC12OC1CN=C2N,0.2476
c1cocc1CN2CC2,0.2356
C1N2C3CC4OCC13C24,0.3109
CC12CC3C(O1)C3O2,0.3237
N=CN1CCC=CC1=O,0.1953
CC1CC2(C1)CC(=N)O2,0.2873
CCC(=O)C(C)NC=O,0.2217
OC1CC2C3CC2C13O,0.3141
CC1COCC(C=O)=C1,0.1925
CN=C1CC(O1)C1CC1,0.2795
CN1C2CC(O)C(O)C12,0.2586
CCC1CC1C(O)C=O,0.2273
CC1C2N1C(C#C)C2=O,0.21
OC12CCC(NC1)C2=O,0.1986
CC1=NC(=N)C=C(F)N1,0.1951
CC#CC1NCC11CO1,0.2701
CCOC1CC(C)C1O,0.3165
Cc1c(cn[nH]1)C#N,0.2394
O=C1CC2COCOC12,0.2059
N=C(NCC#N)C1CO1,0.2551
COc1c(cncn1)O,0.2103
OC12C3CCC1C=CC23,0.2366
CC(=O)NCC(N)C#N,0.2497
CNC(=O)C1OC1C#N,0.2404
CC1CC(C)(O)CC1C,0.3265
CC(C)CN=C(C=O)N,0.1822
c1c(c(=O)ocn1)C=O,0.1608
CC(C)(C(F)(F)F)N,0.3321
CCC#CC1=CCCC1,0.206
CC1CC2CC3COC123,0.3029
C#CC1C2CC2C11CN1,0.2795
CC1C2CC(C12)C(N)=O,0.2744
OC12CCC(O)(CC1)C2,0.3194
OC1C2CC1(O)COC2,0.3117
CC1C2C3C(N13)C21CN1,0.3054
CC1=CC(=O)N2CCC12,0.2087
C1OC2CCCC=C12,0.2524
CN=COC12CC1OC2,0.2591
CCCC1=CCOC1C,0.2483
Cc1ccc([nH]c1=O)C,0.1775
CC12OC1C(O)C2(C)O,0.2994
CC(C#C)C#C,0.2962
CC1(CC([O-])=O)C[NH2+]1,0.2735
CC1(CC2(CC2)CO1)C,0.3198
OC12CC1CC1OCC21,0.3168
COC(=O)C1C(C)N1C,0.2264
CC1C2C3CN1CC2O3,0.2851
C1CC1CCCCO,0.3427
CC(C)(C)CCC#N,0.3496
C1CC12CC(=O)CO2,0.2188
C#CC12OCC3C1CC23,0.2733
CC(=NO)COC(=O)C,0.2588
CC1CC=C2CCC=C12,0.1965
c1cc([nH]c1)CCC=O,0.1794
Cc1c([nH]c(n1)C)OC,0.2389
CCN(C)c1ncno1,0.2332
C#CCC1NC1C#C,0.2777
O=CC1COC(O1)C=O,0.2064
COC(C=O)C(O)CO,0.2091
C(C=O)N(C=O)C(=O)N,0.2004
O=CC12COC1C(=O)C2,0.1947
CC12NCC1(N)C2C#N,0.2586
OC1C2CC11C=CCC21,0.2361
CC12CC(N)(C1)C(=O)O2,0.2543
CC#CC12OC1C1NC21,0.2365
C1CCOC(=O)OCC1,0.3016
CNc1coc(=O)n1C,0.2313
CC12CC(C1)C=CCC2,0.2526
OC(C#N)C1NC1C=O,0.2196
CC1OC2CC(O)C2O1,0.3181
CNC(=O)C1OC1C=O,0.2109
O=CC1C2C3CC2N13,0.2101
CC1(CC=O)CC(=O)N1,0.2199
COC1CC(C1)C=O,0.2276
C1OC11C=CCC2OC12,0.2495
CC1C2C3OC3CN12,0.2836
OC1CC(=O)NCC=C1,0.2434
N#CC1(CO1)C1CO1,0.2856
CCC1CC(C)OC1=O,0.2738
COC(=N)N1CC1C#C,0.2569
CC1(O)CC2CC1O2,0.3163
C1C=C(NC(=O)N1)CO,0.22
CC1(O)COC(C1)C#N,0.2859
COC1C(C#C)C1(C)O,0.2725
CC1(C)OC2(CC12)C#N,0.2564
CCC(C#CC)C#CC,0.2854
OCC12CNC1C2C#N,0.2635
O=C1NC2=C(N1)N=NO2,0.1363
CC1CCNC(=N)C1=O,0.1884
CC1CC2CC(C1)C=C2,0.2531
Cc1nc2c(o1)nc[nH]2,0.2032
COC(C=O)(C#N)C#N,0.2218
CC1=CC2C(O)C2C1=O,0.1848
OC1CC11CC(=O)C1,0.2216
CC1CC23COC12CO3,0.2751
CN(C)C(=O)C1(C)CO1,0.2604
CCc1cc(nn1C)N,0.2249
CC12CC3=CCN1C23C,0.1634
CC(O)(CO)C(O)C#N,0.2898
OC1CC2CC1C2=O,0.2317
COC(CC=O)C1CC1,0.2218
c1c(c(on1)CO)CO,0.2365
CC(C)C#CCCC#C,0.2906
OCC(=N)N1CCN=C1,0.2176
CC12CC3(C1)CCCC23,0.3459
C#CCOCCC(=O)N,0.2802
C1C2C1C1CCC2CC1,0.3298
CC12CC3CC3C1(C)O2,0.3382
N#CC12C3C1C1CC3N21,0.2507
CC1=C(OC=N1)C1CN1,0.2201
Cn1cnc(n1)N(=O)=O,0.2051
OCC1C2CNC(=O)C12,0.2677
CC1C=CC(O)C2NC12,0.2632
N#CC12CN3CC(N1)C23,0.2275
CC1C(O)C(C)N1C=O,0.2602
O=C1CN=C2C1C1CN21,0.205
O=COC1C2CCC1O2,0.2656
CCn1nc(c(n1)N)C,0.2188
CC1(C(=O)C(N1)(C)C)C,0.2154
COC1CC(O)C(=N)O1,0.2871
CN1C2CC(O)C12C=O,0.2097
c1cn2cc(nc2[nH]1)O,0.2144
CC1CC2(CC2O)C1O,0.3049
OC12C3C1C1=CC2C3=C1,0.0925
CCCC1C2NC(=O)C12,0.2531
C1C2CC1C1COCC21,0.3327
CC(O)C#CC(O)CO,0.2779
O=CC1C=CCN1C=O,0.1956
OCC1(O)CCC2CC12,0.3165
CC1CC2NC2C1O,0.3069
CCC1OC(=O)C2CC12,0.2722
OC12CCC3C1CCC23,0.3223
CCc1ccc([nH]1)O,0.2347
C#CC1=CCOC2CC12,0.2043
c1cc([nH]c1)CC#N,0.2386
COC(=O)CCO,0.2841
CC(=NO)C1(CCC1)O,0.2558
CC(O)C1=NC(O)=CO1,0.2198
CCCC1OC2(C)CC12,0.317
CCCC(O)CC#C,0.3037
CC1C=CC(=O)C1=O,0.1385
CCOCC#CC(=O)C,0.2092
CC1OC(=N)NC1=N,0.2527
CC(O)C1(N)COC1=O,0.247
OC12C3OC3C1C2C#N,0.2726
CC12C3C4C5C(C1N25)N34,0.2592
CCCNc1nnon1,0.1915
CCC(C#C)C#C,0.2955
COC1C2CC2(O)C1=O,0.214
OC12CC1CC(C2)C#N,0.3056
CCC1NC(=O)NC=C1,0.2256
CC(C)CCOC,0.333
C#CC(C=O)(C#C)C#N,0.2174
CN(C=N)c1ncon1,0.2092
CC(C)(CC=O)N1CC1,0.2096
CCC1(CN1)C(O)C#C,0.2757
c1c(c(nn1C=O)O)N,0.1824
CC1OC1C12CN1CC2,0.3155
CCC(C#C)C(C)(C)O,0.314
Cc1conc1CC#N,0.2441
OC1CCC=C1C1CN1,0.2299
CCN(C=O)C1CCC1,0.2637
CC(=O)C1CC11COC1,0.2252
C1CC23CC1C=CC2N3,0.2302
CC(C)C1(C)NCC1=O,0.2158
C1C2CC3OC2OCC13,0.3293
CC1OCC2NC2CO1,0.3127
CC1OC2OC1CC=C2,0.2441
C1CC12CC(C2)CC#N,0.3106
CCCC12CC1CC2C,0.3222
c1coc2c1CCCO2,0.2266
Cc1cnc(c(n1)O)N,0.1792
OCC12OC(C=C1)C2O,0.2398
CNC(=O)N1CCN=C1,0.2301
O=CC12CC1OC=NC2,0.2219
CC1NC(C#N)C1(C)O,0.2698
CC1CC(O)CCC1O,0.3198
CC1OCCOC(=N)O1,0.2959
CC1C2C3C(C=O)C2C13,0.2191
O=CC1CC(=O)C2CN12,0.2104
CC1CCC(N)(C1)C#N,0.2905
CCOCCNC(=O)N,0.3022
COC1(C)CCOC1,0.3272
C#CC12CCOCC1O2,0.2757
C1C2CC3C=CCC13O2,0.2537
CC#Cc1c(cn[nH]1)C,0.2079
CCN1CC(O)CC1=O,0.2713
CC12CC1(C)OCC2,0.3054
CCc1cnc(nn1)C,0.162
OCC12CCC1CC2,0.3289
C#CC12C3C4CN1C2C34,0.252
N=C1OCC2C(C#N)C12,0.2669
N=C1ON=NC(=N)N=C1,0.1643
C#CCn1ccc(c1)N,0.2083
OC12C3CC1OC2C3,0.3045
COC1OC(=N)C=C1N,0.2104
OCC1COC=N1,0.2628
Cc1c(c(ccn1)O)O,0.2224
CC#CCOC,0.2837
O=CN1CCC(C1)C#N,0.268
CN(C)c1ccco1,0.2152
CC#CCCC(=O)C#N,0.1701
COCCOCC(=O)N,0.2687
O=C1NC2CCC12C#C,0.2581
Cc1conc1OC,0.2518
CCN1CC(O)C(=O)C1,0.1966
OC1(C=O)C2OC1C=C2,0.1989
O=CC12NC3COC1C23,0.1926
C(#CC(=O)N)C(=O)C#N,0.17
CC1(CC(=O)NC1=O)C,0.2378
CC1=CC(=O)C2CC2N1,0.1848
NC1=C(OC=N1)C1CO1,0.202
C1C23COC12C=CC3,0.2285
OCC1C2N1CCC2=O,0.2114
CCC1CC1C1CC1,0.3325
C1CC23CC(C2)CC13,0.3504
CC[NH2+]CC(N)C([O-])=O,0.2591
COC(C1CC1)C1CO1,0.3306
CCC1(C)OCCC1C,0.3138
OC1CC2C3CCC3C12,0.3073
O=C1CC2C3CC3C2C1,0.2218
OC1C(O)C1N1CC1,0.3027
C1CC(C1)C(=NO)CO,0.251
O=CC1CC2=NC=CN12,0.1762
C1CC(C1)C2=CCOC2,0.2431
CC12OC1C1(CC21)C=O,0.2177
OCCC1OC1C1CO1,0.3296
CCC12CC1C(C)=CC2,0.2469
O=C1NC2CC2(O1)C#N,0.2711
CC(=NO)COC,0.2552
CN1C2CC3CC3(O)C12,0.2926
CC1CC2(C)OC2C1O,0.3209
CC(C#N)C(N)C1CN1,0.279
COCC1=CCC2NC12,0.248
CC12CC(CCO1)C2O,0.2929
CCC1OC1CCCO,0.3359
CN1CC1CNC=O,0.2555
CN=C1C=CNC(O)=C1,0.1781
CC12C3CC(CC13)C2O,0.3225
OC1C2CC1C(C=O)=C2,0.1877
c1c(c([nH]n1)OC=O)N,0.1988
CC1OCC11COC=N1,0.2615
CC12CC(C1)C(O)C2,0.3391
CC1N=C(CO)OC1=O,0.25
COC1C2CNC12C#N,0.2344
COC=NC12CN(C1)C2,0.2399
NC1=NC(=N)OC(F)=N1,0.2179
CC1C2C(CO)C2C1=O,0.2237
CC(C)C1(O)CC1C#C,0.2868
C1OC11CC=CC2CC12,0.2462
c1cnc2cncn2c1,0.1542
CC(CO)C1=CON=C1,0.2462
c1n[nH]c(=O)n1CC#N,0.237
CC1(C#C)C2CCC12,0.2914
CC#CC1(O)CC2NC12,0.2709
CCC12CC3OC1CC23,0.3215
CN1C2CC1C(C2)=NO,0.2352
CC1OC1C1NC1(C)C,0.3153
CN=c1ccocn1,0.2004
CNc1c(=O)ncon1,0.1832
OC1C2C3CC4C3C1C24,0.3193
OCC1CCC2OC12,0.3342
OCC1C2OC3CC3C12,0.3168
Cn1c(ncn1)N2CC2,0.256
CN(C)C1COC1=O,0.2264
OC1C=CC2(CC2)C1O,0.2398
CCC1C2C3OCC1C23,0.3073
COCC1CCCC1=O,0.2209
CC1OC1C(N)CC#N,0.2864
OC(C#N)C1CN=CO1,0.2633
C1CC23CC4(COC24)N13,0.252
COC1C2CCCOC12,0.2866
O=C1NC=NC1CC#C,0.2274
CCN1CC11C2CC1O2,0.3161
NCC1(CN=CO1)C#N,0.2557
CC12CC3C1C=CC23O,0.2261
COCC(C)COC=O,0.2737
OC12CC3=CC4C(C14)C23,0.1708
Cc1cc([nH]c1C)O,0.2364
C(=O)C(C=O)O,0.1986
C1C2CN1CCO2,0.2907
CC(C)C1OC1(C)C=O,0.2199
CCC1(O)C2CCOC12,0.2982
CC1OCC(=O)C=C1,0.1777
COCC12CN1CC2=O,0.2238
CCC(CC)C1(CC1)C,0.3426
CC1(CCC(=N)O1)C=O,0.2137
CCc1c(nco1)C#N,0.2238
Cn1ccc(n1)N2CC2,0.2321
COC1(CCC=C1)C=O,0.2129
C1C2C3C4C=CC3C4N12,0.2233
CC1(C)C2C1C(=O)C2O,0.2216
C#CCC12CC1C1CN21,0.2728
C1CC1(CN2CC2)C=O,0.2199
CN1CCCN(C1=O)C,0.2786
c1nc(c(o1)C2CC2)N,0.2012
COC12CC1CC(O)C2,0.3145
CCC1C=CC2CC12,0.2461
COC(C)(CC#N)C#N,0.2977
c1cocc(c1=NO)F,0.1769
C#CC1C2CC3CC3N12,0.2507
CC1OC2CCC1C2,0.3157
OC1C2NC(C#C)C12O,0.2506
N=C1COC(CO1)C=O,0.2207
OCC1C2CC3OC2C13,0.3073
O=COCC1CCO1,0.2736
NC(=O)C(O)C1CCC1,0.2747
CC1=C(O)N=NOC1=N,0.1518
N=C1OCC2(OC12)C#C,0.2531
c1ccnc(c1)NC=N,0.1893
C1CC1(C=O)OCCO,0.2222
OC12CC1OC2C1CC1,0.2844
N#CCOC1OCC=C1,0.2605
OC1C2CC3CC2C13O,0.3187
C1N2C3C4CCCC13C24,0.2974
CC1=NNC(=N)C(O)=N1,0.1677
CC1COC(C)O1,0.3423
C(C#N)NC(C#N)C#N,0.2604
N=C1OC2C3OC12C=C3,0.2154
CC1=NNC(=N1)C1CN1,0.2439
CCC(C)C(C)C(N)=O,0.2767
FC(F)(F)C12CCC1N2,0.3454
CCC1C(C)CC1C#N,0.3261
OC1C=CC(O)C1O,0.2502
Cc1cn(cn1)CC=O,0.1788
OC1CNC2(CC12)C#N,0.2519
CC(=O)CC(C)(C)OC,0.2282
C#CC#CC1(CO1)C#N,0.2098
CC12CCC3CC1C3O2,0.319
COC(C)(C)C1CC1O,0.3174
CC12CC(O1)C1CC2O1,0.2897
Cn1c(nc(n1)O)C=O,0.1734
CC1C2OC2C2(C)CN12,0.2969
OCC1C(O)CCC1O,0.2927
OCC1C2CN3C2CC13,0.2994
N=C1CC(O1)(C=O)C=O,0.1934
Cc1cnc(c(n1)N)C,0.1873
CC(=O)C1CC2CC1O2,0.2306
CC1OC1C1CC(=O)O1,0.283
OC12CC1COCC=C2,0.246
CC(C)C(C)OC(C)=O,0.2847
O=C(C#CC#C)C1CN1,0.1745
O=C1NC2C3OC1OC23,0.2502
CC(O)(CO)C=O,0.2233
CCn1ncc(=O)cn1,0.1788
COC1CN2CC3C1C23,0.2968
C1CC2COCC2=C1,0.2502
O=CCC1CC2OC12,0.2271
CCCC#CC1(C)CO1,0.2797
CC(NC=O)C#CCO,0.2678
O=C1OCC2COC1O2,0.2503
CC(CC(N)C#N)C#C,0.294
CC1=CCC(O)(C1)C#C,0.2623
OC1CCC2NC2C=C1,0.2458
NC12CCC1OC2=N,0.2681
C1CC=CC=C(C1)CO,0.1888
C1=C2C3C4C5C1C5C2N34,0.1746
OC1C2C3OC2(C=O)C13,0.2071
Cc1cnc(nc1N)C,0.2158
CC12CN1C(=O)C21CO1,0.2189
CCC1(C#C)C2CC1O2,0.2828
CCCC1CCOCC1,0.3316
COC1CC(O)C1(C)C,0.321
OCCCN1C2CCC12,0.3113
CN=CNc1ccon1,0.2148
OCC1OC2C=CCC12,0.2475
C1CC1(CCC#N)C=O,0.2328
CC12C3C4C3C1C4C2=O,0.2149
CC(O)C(O)C(C)C=O,0.2148
O=C1C2CNC1C=CC2,0.21
CC1(C)OC(C#C)C1O,0.2722
CC#CC1CC(C1)C#C,0.2805
c1coc(nc1=O)N,0.209
CC1CC2N=COC12C,0.2625
CCc1c(c([nH]n1)N)C,0.2401
OCC12CC(O1)C2C#N,0.2821
CC(C)Cc1ccoc1,0.2389
C#CCC(=O)CN1CC1,0.2201
CC1C2C3CN1C23,0.3138
C1C(=O)NC(=O)C(=N1)N,0.1873
COC(C)C(=O)C(C)O,0.2315
CC#CC(C)(C)CC#N,0.2831
CC1C2CC3C2N1C3=O,0.2237
CC1NC1C(C)(O)C#N,0.2929
CC(=O)CCNC=O,0.2318
CN1CC23CC12CCO3,0.284
OCC1=CC2OC3C2C13,0.2295
O=C1NC2CC(C#N)C12,0.2681
CCc1c[nH]c(n1)C,0.2452
CC1CC(=O)C=C1,0.1927
CC(O)CC1(C)CO1,0.3247
CC1=CC(=[NH2+])O[C-]1C#N,0.1866
c1cnnn2c1ncn2,0.1848
COCC1OC1C1CO1,0.3187
CC12CC(C1)C2(C)C#C,0.2982
OC12CC3OC4C(C14)C23,0.3038
COC1OC2CC1C2O,0.3052
N=C1ON=CN1CC=O,0.1871
CC12CNC1C(CO)O2,0.2894
CC(C)(C)c1conn1,0.2312
N=C1CC2=C(O1)C=NN2,0.2162
NC(C#N)C12CC1OC2,0.2605
Cc1cccc(c1C)F,0.231
N=C1NN=CC=CC1=N,0.1507
N1C2C1C1OC21,0.2785
OC1=C(F)C=NC(=O)O1,0.1835
C#CC1OCCC2CC12,0.2863
COC12CC1C1CN1C2,0.298
C(CC1CC1)CC1CO1,0.356
O=C1NC2CCC1CC2,0.2741
OC1CNC(=O)NC1=O,0.2497
COC(C)CCCC=O,0.2289
CC1CC=CC1(C)C#N,0.2618
CC1CC1(O)C(F)(F)F,0.345
N#CC1NC11CC2OC12,0.2824
COCc1ccc([nH]1)O,0.2287
CCn1cc(nc1C)N,0.2154
CC1CC2(COC12)C#N,0.2763
CC1C2CCOCC12,0.3216
OCC1(CC1)OC=N,0.2784
CC(CO)(CO)C1CN1,0.2933
Cc1cc(cc(c1)F)C,0.2297
COCC1CC(O1)C#C,0.2761
CC1CC2OCC(C)=C12,0.2351
Cc1nccc(n1)CO,0.2107
CC1(O)CCC(CO)=C1,0.2553
O=C1N2CCC2C11CC1,0.2319
COC=NC(C)CC#N,0.2704
CC1OC(=O)C2NCC12,0.2436
CC1(C)C2NC(=O)C12C,0.2493
C1C2CC11N=COCC21,0.2608
CCC(C=O)C1CN1C,0.206
OC1CCC1C#CC#N,0.2287
CCCC1CC(C)C1,0.3669
CCOC(=O)CCC#N,0.2857
CC12COC1CCC=C2,0.2602
CC12CN1C1CC(=O)C21,0.1999
CN1CC2(CC12)OC=O,0.2225
N=COCC1=CC=CO1,0.2296
OC1CN2C3C4CC13C24,0.2826
C1CC(=C2COC2)C=C1,0.1888
CC1(CCC2OC12)C#N,0.3072
C1Cn2c(c(nn2)N)N1,0.2087
CCN1C2COC(=N)C12,0.2541
CC(O)C1C2C3CC3N12,0.2778
CC1(CC(=O)C1)C1CO1,0.2248
CC12NC3C1NC2C3O,0.295
[NH3+]C1CN2CC12C([O-])=O,0.2566
CCc1cn[nH]c1NC,0.2351
CC12C3CN3C1(C)C2O,0.2904
OC12CC1CC(=C2)C#N,0.206
CCC1(CNC1=O)C#N,0.2701
OCC1C2CN1CC2=O,0.2096
CC12CC3CCC1CC23,0.3393
CC(CC(=O)C=O)C#C,0.1536
CC1CC2NC2(CO)C1,0.2912
CC12C3C4OC1CC4N23,0.3232
CC1C2CC3C(C)C1N23,0.2855
CC12CC1(O)CC2O,0.3203
NC=[NH+]C1=C(O)N=N[N-]1,0.1285
COC1CCC1(O)CO,0.2999
CC1=CCC2C1NC2=O,0.2527
CC1(C#N)C2C3OC2C13,0.2753
COCC1CC(C1)OC,0.3295
C1COc2c1onc2O,0.2137
NC(=O)N1C2CC1C=C2,0.2273
COC(CC#N)C#N,0.2959
CNC=Nc1ncco1,0.185
c1c(n[nH]n1)OC(=O)N,0.2461
CN1C(=O)NCC12CC2,0.2816
c1c(nc(o1)CN)N,0.2095
CC1(CC(O)C#N)CO1,0.288
CC1=C2CCC2OC1=O,0.2175
COC(C=O)C(C)C=O,0.2013
OC1C(O)C1CNC=O,0.279
C#CCCCCCC#N,0.3003
NCC1(CC(=O)O1)C#N,0.2527
CC1C2C(O)C1C2O,0.3167
O=CCC1CC(=O)CN1,0.204
c1c[nH]c2c1c(n[nH]2)O,0.2273
CC#CC1C2CC2C1C,0.292
OC12CC=CC1C2C#N,0.2452
CC1C2OC1(C)C=C2C,0.2354
C#CC1COC11CC1,0.2696
c1cc(oc1)NCCO,0.2182
CN1CC1C12CC(C1)C2,0.3083
OC1C=CCCC11CN1,0.248
CC(C)N=COC(=O)N,0.2642
C#CC1CC2=CC=CN12,0.2209
CCCC1COC1,0.3201
CC(=O)C(O)C1CCO1,0.2205
CCC1(CC1)N(C)C=O,0.2665
CC1C2C(N)C(C#N)N12,0.2633
CC12CN3C(C13)C2=NO,0.2456
CC1C=CC2COC12C,0.2582
NC1=CC(=N)OC=C1O,0.164
COC1CC2C(C)OC12,0.3077
CC1CCOC(=O)NC1,0.286
C(=Nc1nc(no1)N)N,0.1841
CC(=O)N(C=O)C(=N)N,0.2163
CCC1CCCCC1C,0.3603
N=C1OC2CCCCC12,0.2853
CC1(CO1)C1(O)CCC1,0.3194
CNc1c[nH]c(c1N)O,0.2225
OC(C#N)C1=NON=C1,0.2542
CCc1cc(oc1N)N,0.2188
OCC1CCC1O,0.3241
CC1=C(C)C(=O)CC1O,0.1961
CC12CC3(C)CC1C23C,0.3124
CC1C2CC3(C)CC2C13,0.3504
C1CC1NC(=O)NC=N,0.2541
C1OC2CC1C=CCC2,0.2503
c1c(cncn1)O,0.2084
OC1C2CN2CCC1=O,0.2021
CC12CCC11CC(C2)O1,0.3188
C#CC12COC1CCO2,0.2819
C1C2CC11C=CCOC21,0.252
NC12CC1COC2=O,0.2567
CC12CCC=C1COC2,0.249
N=C1OC2C3C4CC13C24,0.278
C1OC11CN2C3CC2C13,0.3211
NC(=O)C1(N)COC1=N,0.2409
CCCOCC(=O)CC,0.2348
ON=C1C2CC1C2O,0.2688
CC(=O)CC1OC1(C)C,0.2336
N#CC#CC1CC2CC12,0.2383
CN(C(=O)C#N)C(=O)N,0.2082
c1c(c(=O)onc1N)F,0.1686
CC1C(CO)C1C#C,0.288
CCCC(=O)C(=N)N,0.1973
CCCOC1(CCC1)C,0.3252
CC1=NCC2(CN12)C=O,0.2157
CC1OC2CC1(O)C2=O,0.2047
CCC1(OC)C2CC1O2,0.314
CC(CO)OC(C)C#C,0.2907
CC12N=COC1C2C#N,0.2568
N=CN1CCCOC1=O,0.252
CC12CN1C(=O)C2C=O,0.2103
CCC1CCOC1=N,0.2844
CCC12CC1(O)C(=N)O2,0.2756
CCCCCC(=O)NC,0.2793
N=C1OC2OCC3C2N13,0.2733
CC#CCC#CC1CO1,0.2704
CCC12C3CC1COC23,0.3039
C(c1c(oc(=O)[nH]1)O)O,0.2351
Cc1cc(n(n1)C)C#N,0.2179
COCC(C#C)C1CC1,0.3085
CCC1=NCC(=N)N1C,0.2208
C#CC(=O)c1conn1,0.1939
NC12C3OC1C3OC2=O,0.2354
CC(C)C(=O)CNC=O,0.2209
O=C1CN2CC2CCO1,0.2512
CC1COC1CCC#C,0.3038
CC1(COC1)OC,0.3158
CC1OCC2CN2C1C,0.2971
CC1CC2CCC(C)C12,0.3422
C1OC2CC=CCOC12,0.2556
OC12CC3C(CC1)N3C2,0.2852
C1C2C1C1=CC=CN21,0.2205
C#CC#CCC1CCO1,0.227
CCC12CN3C(C=C1)C23,0.2293
CC1C(O)C2CC(O)C12,0.2929
OCCCOC1CC1O,0.3104
CC1CCC1(C)C=O,0.2244
CC1CC2=C(C1)N=CN2,0.2389
CCOCCOC1CC1,0.3325
OC1C2OC(C#C)C12,0.245
C1C(CO1)COCC#N,0.2599
CC1(C#C)C2CC2C1O,0.2944
CNC1=CC(=O)OC1C,0.2183
CCC1(CC(C1)(C)C)C,0.3416
CC1(O)C2C3CC1OC23,0.3225
c1[nH]c2c(n1)OCCN2,0.2182
CC1C2C=CC1C=C2,0.2175
OC1C2OC3C2OCC13,0.3101
Cc1cc(c(=O)oc1)C,0.1758
COCC(OC)C#N,0.278
Cc1nc(n(n1)C)CO,0.2476
CCC(C)C(=O)C1CN1,0.23
C1C=C(CO1)COC=O,0.2406
N=C1NC=NC1C=O,0.2058
CC(CC#C)C#CC=O,0.2042
C1CC2C1C1CC2C=C1,0.2532
COC=NCC(O)C#N,0.2596
CC#CC12CC3C1CC23,0.2834
CN1C2C3C2C2(CO2)C13,0.3004
CC1(O)CNC(=N)C1=O,0.1809
C1CC2(CO1)COCO2,0.3327
O=CC1OCCCC=C1,0.2178
CC12CC3C1C1(CC1)N23,0.3246
CN1C2C=CCC12CO,0.2313
C1C=CCOC(=O)O1,0.2453
CC(C)CC(=O)C1CN1,0.2324
OC12C3CC1N1CC3C21,0.2676
CC1(C2CO2)C2CCN12,0.3101
CC1C2C=CCC12C#N,0.247
C1C=C(CO1)C(=O)C=O,0.1386
CC1=CC(F)=CC(=N)O1,0.1718
CC1=CC(O)C(O)C1=O,0.1981
C(C=O)C(=O)CO,0.2114
CC(O)(CC#C)C(N)=O,0.2679
O=CC1CC2C1NC2=O,0.208
CC(=O)C1CC2OCC12,0.2252
OCC1NC(=N)C11CO1,0.2516
CC1CCCOC11CC1,0.3194
O=CC1C2CC1(O2)C#C,0.202
OCC12CC3CC1C23,0.3275
CC1=NC2C(O)C2(C)O1,0.2525
CNC1=NC(=N)C=NO1,0.1798
[O-]C(=O)C1C[NH+]=CN1,0.2388
C1C(=O)OC(=N1)CC#N,0.2506
CC1C2C3C(N13)C2(C)C,0.3145
CC(CCC#N)CC#C,0.3045
COC(=O)C(=O)CC=O,0.1716
OC1C(O)C11CCO1,0.2549
CCC1C2C3NC3(C)C12,0.3392
CC(C=O)C1(CN1)C#C,0.2042
CC(=O)C1CC2(O)CC12,0.2216
COc1cc(=O)cno1,0.1839
CC(C([NH3+])CO)C([O-])=O,0.2769
c1c[nH]c(nc1=O)N,0.2078
CC1OC11C2C3CC1C23,0.3403
CCN=c1oc(no1)N,0.2522
CC1(O)CCC2CC1O2,0.3109
OC1C2COCC1N2,0.2885
N=C1NN=NC(=O)N=C1,0.1592
O=C1CC2C1C21COC1,0.2286
NC(=O)C1CC11CCO1,0.2575
OC12CC1(OC2=O)C#N,0.2441
CC(C)C(C)O,0.3297
C1CC1CN=COC=O,0.2385
CC1C2C(C)C(C)C12O,0.3123
C1CC2CC1C=CC=C2,0.1863
CCNc1ncco1,0.2317
O=CC1CC11CN2CC12,0.2177
O=C1CCCC2CC2O1,0.2517
CCC#CC(=O)CCO,0.2094
C(C#CC#N)O,0.2323
CC(O)C(=O)C1(C)CN1,0.2216
CCC1C(O)C1C#CC,0.2794
CCC(=O)N1CC1CO,0.2511
CCC(O)CC#N,0.3159
CC(O)C1C2C3NC3C12,0.2775
CC1COC(CO1)C#C,0.2694
CCC1CC1(CO)C#C,0.2913
CC1CCCCCC1O,0.3299
C#CC1=CCOC12CC2,0.188
OC1CC=CC(=O)C1,0.1899
OC1=CNC(=N)C(F)=C1,0.1507
CC1C(=O)C2CCC12O,0.215
CC1OCC2C1NC2=O,0.2751
CC1COC1(C)C(C)=O,0.2175
CC1CC2NC(=O)CC12,0.2755
OC1CC(O)C2(CO2)C1,0.3133
O=C1C2C3C2C2C3OC12,0.2058
C1N2C3C4C5NC5C13C24,0.2942
Cc1c(n[nH]c1O)N,0.244
CC12C3CCC1CC23O,0.3167
CCC(C)C1=CON=N1,0.2309
OCC1CC2(CO2)C1=O,0.2033
C1C2CC=C3COC3C12,0.2514
O=CC1=CCC2(CO2)C1,0.1941
C1C2C3C4C5C2C5C1C34,0.3296
O=C1NC2CC1CCC2,0.2663
NC(=O)C1CC(O1)C#N,0.2429
CC1CN2C1COC2=O,0.2877
CC1=C(C)C(CO)CC1,0.2534
OC1C2OC3C=CC1C23,0.2266
C1C2CN1C1=C2NC=C1,0.2245
OC12C=CCC1C1NC21,0.2533
CC1C2C3C4C1N2C34C,0.2993
CC1CCCC(=O)C1O,0.213
O=C1NC2C(CC#C)C12,0.2504
N=C1NC=C(C#C)C1=O,0.1353
c1(c(=O)nnon1)N,0.1594
C1N=C2NC3C=CC1C23,0.2252
CC1C(O)C2(CC2)C1O,0.3045
CC1C=CC2CC1(C)O2,0.2379
OCC1NC(=N)C2OC12,0.2483
O=CCCOCC1CN1,0.2231
COC1C=C2CN3C1C23,0.1765
CC1NC(=O)COC1C,0.2655
C#CCOc1cn[nH]n1,0.2355
CN1CC2CN2CC1=O,0.2619
C1C2C3CC4=CCC13C24,0.1679
NC(CCCCO)C#N,0.2866
CC1CC2CC2C1C=O,0.2213
OC1C23COC12COC3,0.2813
CC1CCCCC1C#N,0.3395
CC12CCC1NC2C#N,0.258
CC1(C2CC2)C2COC12,0.3088
CC12NC1COC2(C)C,0.3023
COC1C=CC2CC12C,0.2399
CC1OC2(CC2)C2NC12,0.2968
C1CC1(C(=O)NC=O)O,0.2155
CC(NC=O)C(C)=NO,0.2457
CC1CC(CC([O-])=O)[NH2+]1,0.2736
COc1[nH]c(=O)on1,0.2708
C1OC2OCC1C1NC21,0.3072
Cc1cc(cc(=O)[nH]1)N,0.1849
CC12C3C4OC(C14)C23O,0.3056
C1CC23CCC4C(C12)N34,0.3159
C1N=C2OC3C4NC13C24,0.1578
CCOC(=O)C#CC#N,0.2055
CCC#CCCCOC,0.303
CC1=CCC2NC(=O)C12,0.2425
COCCCCC#C,0.3096
CN=C(C(=O)C(=O)N)N,0.1618
CC1(CC1(O)C=O)C=O,0.1956
CCc1c(cno1)OC,0.2122
CCC1C=CCC2CC12,0.2621
CC1(CN(C1)CC#C)O,0.2637
CCOc1c(n[nH]n1)N,0.2129
CC(C#N)C1=COC=N1,0.2481
C1CC23COC4C(C24)N13,0.286
OC1C(=O)C2NC12C=O,0.1795
N=COC1CCCCO1,0.2855
CC12CC3(C=O)C1CC23,0.2173
CC1C=CCC1=NO,0.2461
CC1OC(=N)C=C1C#C,0.1827
CC1(C2COC12)N1CC1,0.2957
OC1=C(OC=N)ON=N1,0.1857
CC1OCC(O)C(=N)O1,0.2812
CC1=CC2CC2C(=O)C1,0.2124
N=C(OC=O)C1CN1,0.2324
CN=COC(=O)C(C)N,0.2224
N=C1OC2CC1N1CC21,0.2733
CC([NH3+])(C#C)C([O-])=O,0.2664
C(C=O)C#CC(=O)C#N,0.1688
Cc1cc(nc(n1)F)O,0.2311
CCn1c(cnn1)C=O,0.1977
CC12OC1C1NC21C#N,0.2427
C1CN=C(OC1=O)C=O,0.1885
COC1C2CCC12C#N,0.2723
CCC1CC2(C1)OC2C,0.3306
CC12CC1(CO)CC2O,0.3159
CC(C)(CC=O)C#C,0.2191
O=C1C=CC2C3OC2C13,0.1724
CCCC1(O)CC2OC12,0.3163
CN1C2CC(C=O)C12C,0.211
c1c(c(nc(n1)F)O)F,0.2157
Cn1cc(cc1C#C)O,0.1868
CC(OC=N)C(=O)CO,0.2316
COC12CC1C1CC21,0.2948
CCC1OCC11CC1,0.3151
CC1(CO1)C(O)CC=O,0.2237
CC1(O)CCCC1C=O,0.2267
CC1CC2C(O1)C2C=O,0.2182
CC12C3CC1=CC(O)C23,0.1787
CN(C)c1cocc1N,0.2278
C#CC#Cc1nnon1,0.1783
C#CC12C3C1C1C3CN21,0.2493
CC1(CC2C(O)C12)C#C,0.3011
O=C1OC2C3OC3C2O1,0.3276
Cc1cnc(cn1)OC,0.1925
CC1=CC2(C)CN3C1C23,0.2319
NC1CC2CC1(O2)C#N,0.2428
CC(=O)OC1OCC=C1,0.2528
CC1CC23CC(C2)C13C,0.2997
N#CCC1CC1C1CO1,0.3232
NC(CO)(CCO)C#N,0.2856
CCNC(=NC)NC=O,0.1995
CC1CC(C)(O)CC1O,0.304
C1NC11CN2C3CC1C23,0.3092
CC1CC1(CC#C)C#C,0.287
OCCC1C2C3CC3C12,0.284
COCC12CC(C1)O2,0.3066
CC1CC=C(C=O)C1C,0.1933
NC1=COC(=N1)C1CN1,0.2028
CCC(=O)C(C)COC,0.2298
CC(=O)N1N=NNC1=N,0.1885
C1CC(C1)CC(F)(F)F,0.3906
C(C=O)NC(=N)C=O,0.1637
CC12CC(OCC1)C2=O,0.2033
CCC(=O)CCC(C)O,0.2359
CC(C)CCC1CC1O,0.3331
OCC(=O)COC=N,0.2195
CCCC1COC1=O,0.2804
OC1(COC(=O)C1)C#C,0.2738
CC1CN=COC(=O)O1,0.2564
CCC1(C)OC1C(N)=O,0.2624
C1C2CC=CC3COC123,0.2444
CC1=CC2C(O)C2C1O,0.2348
CC(C#N)C1CC1(C)O,0.2974
C#CC1COC2CN1C2,0.2522
C(C=O)N=C(C(=O)N)N,0.192
CN=C(CCO)OC,0.2632
CC1(CO1)C1CC1C#N,0.3095
CCN1CC1(C#C)C#C,0.2478
CC1(CC1)CC(C)(C)O,0.3159
CCC1CCC1COC,0.3317
CC#CC1(CN1C)C=O,0.2099
CC1(C)C(OC1=N)C#N,0.276
CC1CC=CC(C)C1C,0.2644
CC1(OC1CC#N)C#C,0.2826
CC1C2OC1C2C,0.3235
CC(CO)(CC#C)C#C,0.2948
O=C1CCC2CC2O1,0.2707
COC1C(C)C1C(C)=O,0.2279
CC1C2COC2C11CO1,0.2944
CCC12CC3CN1C23,0.321
CC1C2CCC1C21CC1,0.3541
CNCc1noc(=O)o1,0.2294
CC12C3C4C3C1CC24,0.3302
N=C1CCOC(=O)O1,0.2739
CC(C=O)N1C(C)C1C,0.208
N#CC1CC1C1CN1,0.2747
CN(C)CC(=O)C#C,0.1652
OCC(O)(CC#C)C=O,0.2072
CCCC1(CC=O)CN1,0.2186
C(=N)NC(=O)C(=O)N,0.1894
C#CC1N=C2NC3C1C23,0.1699
OCCC1OC2CC12O,0.3022
C1C23CCC12OCOC3,0.3199
CC(CCO)(C=O)C=O,0.1996
O=COC1CCCOC1,0.2676
C1CC1N=C2CCO2,0.2578
CC(C)C1(CC#C)CO1,0.3026
N#CCOCC1CCO1,0.2538
CCCc1c(ocn1)N,0.2195
CCC#CC(C)(C)C#C,0.2837
CC(O)(C#C)C1(C)CC1,0.2982
CN=C1C2(CCC2)CO1,0.2724
COc1cnoc1,0.2254
CC1(CO)C2CC2C1O,0.3112
OC12C=CC3CC1C23O,0.2339
C(#N)c1nnc(o1)C#N,0.2047
CN=C1OCC2CC1N2,0.2612
CC1CC1(CCO)C=O,0.2263
CC(OC(C)C#C)C=O,0.2268
C1C=Cc2c1oc(=O)[nH]2,0.1717
O=CC1OC2C(C#C)C12,0.2154
CC(CCN1CC1)C#N,0.2815
CC([NH3+])C(O)CC([O-])=O,0.2785
COC1CC1CC(N)=O,0.2758
CC(C)(C#CCO)C#N,0.2812
CC1CNC2=C1C=NN2,0.2309
O=CC12CC3COC1C23,0.209
OCC12CC3C4C1C2N34,0.2857
C#CC(=O)CC1CC1,0.2
CC1=CCC(OC1)C#N,0.2587
FC1=CN=NNC1=N,0.17
N=COC1CC1C1CC1,0.2749
OC1(CC1)C1NC1C#C,0.2579
CC1OC(=O)C(=O)C1O,0.1704
COC1CC2C(C=O)C12,0.2205
CC(C)CC1CC(O)C1,0.3294
N=C(NC=O)C1CCO1,0.2218
CC12CC3CC1C1C3N21,0.3202
C(C=O)NCC#N,0.2233
Cc1c(cno1)OC,0.2127
OCC1COC2COC12,0.3226
CCOCCC(=O)C#N,0.1811
CC(C)(C#N)C1CCO1,0.2964
CN1CCc2c1cc[nH]2,0.2091
OC1CN2CCCN=C12,0.2439
NC(CCC1CC1)C#N,0.2855
OC1C2OCOCC12O,0.295
CCC#CCC(F)(F)F,0.3035
C(CCCO)CCCO,0.3416
OC12CC3NC1(C#N)C23,0.2408
OC1CCC1(O)C=O,0.2114
CN=C1OC(CO)C1O,0.2685
CN(C)C1(C)CNC1=O,0.2381
CC1OC=NC2CC1C2,0.2671
C1CCC(=CC1)CC=O,0.2064
CC1=CCC(O)C11CN1,0.2395
OC1C2OCC2CC1=O,0.2079
CC1(O)CC2CC1CO2,0.3097
CCNC(=O)N(C)C,0.2925
O=CC1=CNC2CC12,0.1759
CN=C1OC2C(CO)C12,0.2708
OC1C2C3COCC2C13,0.3214
C1C(=O)COC(O1)CO,0.2072
CC1=CC(=O)C(=O)N1C,0.1489
CC1CC(C#C)N1C=O,0.2628
CCC(C)(NC=O)C#N,0.2721
CCOC1CC11CCO1,0.284
Cc1coc(c1C#C)N,0.2034
O=C1CC=CCC11CN1,0.2251
CC(O)(C=O)C(O)C#N,0.2128
CC(=O)Cn1cnnn1,0.2318
CC12CN1CC(=O)C2O,0.2004
Cc1ccn[nH]1,0.2577
COCC1OC2C(O)C12,0.2919
OC1CC(=O)C(=C1)C#C,0.184
c1c(onc1N2CC2)N,0.2361
CC1CCOC1(C)C,0.3116
CC12CC(C3CN13)C2O,0.325
CC1(CN1)C#N,0.2969
O=C1CC2CC=CC2=C1,0.173
C1CC(=O)CC(=O)OC1,0.2188
CCN1C(C)CC1=O,0.2766
CC12CN3C1C2C3(C)C,0.3033
[O-]C(=O)C1CNC1=[NH2+],0.2401
CC1CC1(O)CCCO,0.324
CC1(CCCC#N)CO1,0.3069
CC1CC2=CC3NC3C12,0.2377
O=CN1C2C3C1C2C3=O,0.2239
CCCC(O)C1NC1C,0.3141
O=C1NCC2CCOC12,0.2532
CN=C(NCC=O)OC,0.2054
CN1C2C1C(=O)C2CO,0.2064
CCC#CC1C(C)C1O,0.2766
N#CC1OCC2CCC12,0.2957
N#CC12COC(CO1)C2,0.2749
CC#CC12C3C4C1N4C23,0.2338
Cc1c2c(on1)CCN2,0.2001
OCCC(O)C1CC1,0.3317
CN1CCC(=O)C1CO,0.2158
CC(C)OC(=O)NC,0.3164
Cc1cnc([nH]1)C#C,0.1987
c1c2c(nc([nH]2)N)n[nH]1,0.2165
N#CCN1CCC1C#N,0.253
CCC1=NC2C(C)C2O1,0.2545
CC1CC(N)=C(C1)C=O,0.1824
CC1=CCn2c1ccn2,0.194
CCOC12CC1OC2=O,0.2572
c1c(c[nH]c1N2CC2)O,0.2232
CN1C2C1C1OCC21,0.282
CCC1(CC1C)C=O,0.2321
O=CC1OC1CCC#N,0.2186
C1NC11CC2CCOC12,0.3052
CC(C)N=c1onno1,0.205
c1cn(nc1CO)C=O,0.2161
CC(=O)c1ncccn1,0.1736
COC1CC1(C)C(C)C,0.3072
c1c(nc(nn1)F)N,0.1846
CC12COC(OC1)C=C2,0.2442
CNc1ccnc(c1)O,0.2158
CC(C#C)C1=CNC=C1,0.25
CCOCCC1CC1O,0.3267
CC1(C)N2CCC12C#N,0.2512
CC1(CO)COCC1O,0.3061
O=C1C2NC2C1CC#C,0.2154
c1c(c(c[nH]1)N2CC2)N,0.2298
CCC(C)C#CC(N)=O,0.233
O=C1NCC(O1)C1CO1,0.314
CN=C1OCC2(C)OC12,0.2563
CN1CC1C1(CO1)C#C,0.2446
CCOC1CC1(O)CO,0.2995
CC12CC3C4CC1N2C34,0.3175
C(CC(=O)CC#N)C#N,0.2372
O=C1C2NC1C(=C2)C#N,0.1963
CC(O)C1(C)OCC=C1,0.2456
C#CCCCCC#C,0.3106
C1COC2(C1)CN=CO2,0.2782
Cc1c(cco1)N2CC2,0.2305
O=CC1C2CC1C(=O)C2,0.2021
CC12C3C=CC1(C)CN23,0.2286
Cn1cnc(c1O)N,0.2373
CC(C)C(=O)OC(C)=N,0.2654
CN1C2CC1(C2)C=O,0.1911
O=C1OC2CC1C=C2,0.2242
OCC12CCC1CC2O,0.3009
CC1NC2C3OC1OC23,0.2723
C(COC=O)C(=O)C=O,0.156
C#CC1CCC(O1)C#N,0.2858
N=C1OC2C(C=O)C12,0.2176
CC12C3CCC1C(O)C23,0.321
CC1C2CC2C(C)C1=O,0.2217
CC#CCC(C)C1CO1,0.3027
CCC#CCC(C)C=O,0.2202
CN(C)Cc1ncco1,0.2195
COCC1(CC1)C(C)O,0.317
CC1C=C(C)CNC1=O,0.2535
c1c(cnoc1=O)C=O,0.1531
C1CC2(O1)C1C3OC3C21,0.285
CCC1=CC(CO)CC1,0.257
CC12C3C1C1(C)C2N31,0.2797
COc1ccnc(n1)F,0.2273
CC1(CC(O)C1)C=O,0.2296
CCCCN(C=O)C=O,0.2155
CC1C2CCOCC1O2,0.3194
CCc1ccno1,0.2449
O=CCC12CCC1OC2,0.2185
C(C(=O)N)OC(=O)C#N,0.2088
CC1NC1CC#CC#C,0.2286
CCCc1cc(no1)N,0.2345
CC1=C([O-])C(C[NH3+])=NO1,0.2097
NC(N)=NC(C=O)C#N,0.2081
O=CCC12CC(C1)OC2,0.2186
CC12CC(C1)COC2,0.3276
CC#CC12CC1COC2,0.2809
CCOC(=N)C(C)OC,0.2882
CC1CC(=N)OCCO1,0.2817
CC12OC1COC2=N,0.2713
[O-]C(=O)C12CC1NC2=[NH2+],0.2539
CC1(CC1(O)C#C)C#N,0.2652
CCc1ncnn1CC,0.2633
c1nc(c(o1)N)OC=O,0.2089
CC1=CC2NC2(C1)C#N,0.2414
O=C1C2NC2CC2CN12,0.231
O=COCC1CC1C=O,0.2236
CCC(C)C(C)NC=O,0.2821
CC1(CC(O)C1)C#C,0.3036
O=CC12CC(C1)(O2)C=O,0.2021
O=C1CC2OCCC2O1,0.2688
CC1=CC2NC2C1=O,0.1802
O=C1OCCC1C1CN1,0.2555
NC(=O)C1(CO1)C1CC1,0.264
N=C1C=C(ON=N1)C=O,0.164
C1CC12CN=COC2=O,0.2478
COC1=COC(=N)N1,0.231
CC(C)C(O)CC#N,0.3157
CCC1OCCC(C)O1,0.3492
CC(C)(CCC#C)C#N,0.3039
CCC1C(C)C1OC=O,0.2741
C1CC1(C#N)NC=O,0.2689
CCCOCC(N)C#N,0.2851
C1C2C3C2C2C3N12,0.3013
OCC1C2C3CC1OC23,0.3052
NC(=O)C1CC2CC1C2,0.2726
CC1C(O)C1(C)C1CC1,0.3113
CCC(=O)C#CCOC,0.2101
COC1(C)C2CC(O)C12,0.3273
NC(=O)CC1CC1C#C,0.2688
C1C(CC1=O)C(=O)CO,0.2159
CC1=NNC(=N)C=C1,0.1573
OCC1CC1(C=O)C#C,0.2154
C#CCOc1nc[nH]n1,0.2491
CC12CC1C(C)(C2)C#N,0.3052
N#CC12CC(N1)C21CC1,0.2633
CC(CCC1CO1)=NO,0.2553
COc1nc(no1)CO,0.2581
CN=C1ON=NC=C1,0.1539
c1c(c(=O)cncn1)N,0.1377
CCC1(C)N=COC1=O,0.2444
CCC12OC1C1(C)NC21,0.2773
COCC(=O)CCC#N,0.2355
CC1CC2OC2C(C)=C1,0.2434
COC(C)C(C)(C)CO,0.3206
CCC12C3C4C(C13)C24O,0.2842
CC12OC3(C)C1CC23O,0.29
CC1C=CCCCC1O,0.2593
CN1C(=O)C(O)C11CC1,0.2576
C1C(CN1CC=O)C=O,0.2054
OC1CC2(CCC2)C=C1,0.2567
OC1COC1(C#C)C#C,0.2512
OCC1C2CC2C11CN1,0.2944
CN(C)C(=[NH2+])CC([O-])=O,0.236
CCC(=O)C(CO)CO,0.2257
OC12CC3NC1C23O,0.274
C#CCc1[nH]nc(n1)O,0.2458
NC(=NC1CC1O)C#N,0.2094
C1C2COC3=NCCC123,0.2653
Cn1ccc(c1N)O,0.2274
CC1(C)CCC1(C)C#N,0.3261
CC1C2C3C(CN23)C1=O,0.2173
Cc1c(nn(n1)C)C=O,0.1968
Cc1c2c([nH]n1)CC=C2,0.2008
CC1(CO)C(N)C1C#N,0.2671
CCC(C#N)C1OC1C,0.3083
CC12CC3CC(C3)C1O2,0.3425
CC1OC2(C)C(O)C12,0.3052
Cc1c[nH]c(nc1=O)O,0.2156
CCC12NC1CCC2=O,0.2133
CC(=O)NC1CCC=C1,0.2492
C#CCC1CC1CC#C,0.3071
CCCN=C(N)NC=O,0.2159
CCOc1nnon1,0.2187
CC(C)c1c(nc[nH]1)O,0.2248
CC1=NOC(=N)C=N1,0.1657
CCC1OCOC11CC1,0.3341
CCC1(OCC1C)C#C,0.275
OCC1COC(O1)C#N,0.2823
CC1CC11CCO1,0.3021
COCc1cc([nH]c1)O,0.2461
CCc1ccoc(=O)c1,0.1811
CC12CC1OCC21CN1,0.2973
CC12CNC3C(O1)C3O2,0.2733
CC1(CN1)C1=CON=C1,0.2361
CC1COCC1(C)O,0.308
O=CC1CCC=C1C#C,0.1953
CC12CCC3C1CC23O,0.3309
CCC1CCC=C(C)C1,0.2614
CN=C1OC=NC(C)=C1,0.1774
CC1C2CC2(O)C1C=O,0.208
C1CNC(=O)C(=O)NC1,0.2194
CC#CC(N)CC#N,0.277
CC1=CC(CC1O)C#N,0.2589
COC1CC2CC(C)C12,0.312
C1CCCOCCC1,0.3215
OC1CC1CC1CO1,0.3355
NC1(CC#N)CC1O,0.267
NC(=O)C12CC1OC2,0.2616
CC1C(C)C1C1CCC1,0.3309
Cc1c(cccn1)C#C,0.1982
CN1C=CC=C(F)C1=N,0.1648
CC12CCC3C1CCC23,0.3525
CC(=NO)C1COC1=N,0.25
C#CCC12OC1CC=C2,0.2484
CC1=CCc2c1nc[nH]2,0.1987
CCOC(=N)OC,0.3171
C1CC(C1)CC#CC#N,0.2438
CC12OC3C1CCOC23,0.3057
CC1OC(C)(C)C1C,0.3125
CC1C(O)C11CNC1=O,0.2755
CCCNCC(=O)OC,0.239
O=C1C2C3CC(=O)C1C23,0.2091
CC(C#N)C1CC2CC12,0.3059
NC(=N)C(=O)C1CC1O,0.1799
COCC(O)(C=O)C#N,0.2202
CC#Cc1ccn(c1)C,0.2153
Cc1cnn(n1)CC#N,0.247
OCC1C2CN2C1CO,0.2981
OC1(C=CC2NC12)C#N,0.2329
OC(C=O)C1C(O)C1O,0.2154
OCC1C(O)CC1C=O,0.2199
CC12CC3C1N3C2,0.314
FC1=C(F)C=CC(=N)O1,0.1607
C#CCC(=O)C#CCO,0.2059
CCC12COC1C2(C)O,0.2864
C1C(=CC(=O)OCO1)N,0.2018
CC(CN(C)C=O)C=O,0.2067
CC1OCC2CN3C2C13,0.3115
CC(C)C(CO)OC=O,0.2773
CCc1cccc(c1)F,0.2317
CC(=O)NC(=O)COC,0.2162
CC1(C#C)C2OCOC12,0.2758
Cn1c(nc(n1)O)O,0.2562
C(CC(=O)C(=O)N)C#N,0.1779
CC12CCOC1CC=C2,0.2603
CC#Cc1coc(=O)o1,0.2
O=CN1CC2COCC12,0.264
CC(O)C(C#N)C1CN1,0.2754
CCC1CN=C(N1)OC,0.2731
COc1cn[nH]c1C#N,0.1994
NC(=NCC[NH3+])C([O-])=O,0.1964
CCC12CC3CC1(O)C23,0.3015
O=CC(CCC#C)C#N,0.2173
CC12CN1C1(C)CC21C,0.2905
COC1(C)OCCC=C1,0.2656
OC1C2CC2CN2CC12,0.2885
CNC1=C(C)OC(=N)N1,0.2218
C1NC11C2C3C2N2C3C12,0.2901
c1cnc(c(=O)cn1)N,0.1445
CCC(O)C(C)(O)CO,0.3173
O=CC1CC=C2CCC12,0.2059
CCC1CC2(C)C(O)C12,0.3108
CCC1CCC1C#N,0.3295
OC1C2CC(=CC12)C#C,0.1935
CNC(C#N)C1(C)CN1,0.2729
CC12N=C(N)OC1C2N,0.2686
CC1CC2(O)CC2(C)O1,0.2984
CC(NC(C)C#N)C=O,0.2119
CC(=O)CC1CC(O)C1,0.2329
CC(N)(C#N)C1CC1O,0.2965
CC1CC(OCO1)C#C,0.289
CCCCCCCC#C,0.3164
CC(C)C12CN(C1)C2C,0.292
CC1(O)C2OC3(CC3)C12,0.2868
C1CC2C1C1COCC21,0.3167
CC1=CNCCNC1=O,0.197
CC12C3N=CN(C13)C2=N,0.213
CC(O)(CC#N)C=O,0.2268
COCCC1C2COC12,0.3108
CC(C)CCN1CC1,0.3142
N=C1NN=NC(=O)N1,0.1816
Cc1c(ncc(n1)N)F,0.1772
CC#Cc1cc(no1)O,0.201
O=CNCC1CCC1=O,0.2145
CC1C2C3CC2(C)C13C,0.3599
CC(C)C(C#N)(C#N)N,0.2763
N#CC12C3CC1CN2C3,0.2345
CC(O)(COC=O)C#C,0.2858
N=C1CC(O1)(C=O)C#C,0.208
CC1(C)CC(=O)C11CO1,0.2033
OCC(O)C1=NCCO1,0.2678
[O-]C(=O)C1[NH2+]CC2OC12,0.2678
O=CC1NCCN2CC12,0.1974
CC12CC1CC=C2CO,0.2487
OC(C#N)C12CC(C1)C2,0.3023
CC#CCCC(C)(C)O,0.2986
CCC(C)CCCO,0.3427
COCC(O)C(C)=NO,0.2508
CC1CC(O)C1(C)C,0.3183
c1c(c(no1)N)N(=O)=O,0.1628
CC(CC1COC1)C=O,0.226
C#CC1CCCOCO1,0.294
c1cnc[nH]1,0.2585
C#CC1CNC1C#N,0.2607
OC(C#C)C(C#C)C#C,0.2789
O=CC12CC1OCC2=O,0.214
CC(=O)C1CNC1C#N,0.2243
CC1=NC(=NO1)C1CO1,0.2419
CC12[NH2+]CC1(O)[C-]2C=O,0.177
OC1C2CC2(O)CC1=O,0.2171
C1C2CC=CC=CC12,0.1848
NC(=O)C1CC=CC1O,0.2403
CCC1CC2OC(C)C12,0.3081
NC(=O)C1CC(O)CO1,0.2425
CC1(C)C2OCC3C2N13,0.3103
CCC#CC#C,0.2313
C1CC2=CCCC2O1,0.2545
c1[nH]c(=O)n(n1)C(=N)N,0.2197
C1CC1C12N3C4C3C1C24,0.2819
CC1C2OC2C1(C)C,0.3369
CNc1ncc(nn1)F,0.1603
NC(=O)C(O)(C=O)C#N,0.2147
O=C1NC2C3CCC3C12,0.2705
CC#Cc1c(nc[nH]1)O,0.1934
CC1NC(=N)C1(O)C#N,0.2513
O=COC1COCC=C1,0.2594
O=C1OC2C=CCC12,0.2578
c1cn[nH]c1NC(=O)N,0.23
CC1(OC1CC#N)C#N,0.3006
CC1C2C3CC1CC23O,0.3185
CC1CN(C)CC(=N)O1,0.2508
C#CCC1C2C3NC3C12,0.2721
C1OC1C12CC3C(O1)C23,0.295
OC12CCC1=CCOC2,0.2527
CC12CC3CC1C3C=C2,0.2477
c1conc1NC(=O)N,0.2364
COC(=O)c1cc[nH]n1,0.2355
CC1=CCOC(=N)C1=O,0.1804
CN=COCC#CCO,0.2639
CCC(C)(C#C)N1CC1,0.2799
c1c([nH]nc1O)CCO,0.2445
CN=C1NC=NC1CO,0.2179
CC12CCC(CO1)O2,0.3306
CC1(C)C(C=O)N1C=O,0.2131
CN=COC1CN=CO1,0.2707
CCc1c[nH]nc1NC,0.227
C1CC2(C1)CN=CO2,0.2696
COc1ncc(=O)on1,0.1621
CC(C)C1CCC=C1,0.2626
CCCC1CC=CC1=O,0.1896
N=C1N=COC=C1C=O,0.1769
C#CCNC1(CC1)C=O,0.2102
O=CC1CC2CC(C1)O2,0.2181
Cc1cc(oc1)COC,0.232
CCc1c(cc[nH]1)OC,0.2238
CC12CC1(CCC2)C=O,0.2232
OCCC1CCOCO1,0.3317
OC12C3C1C1(O)C3NC21,0.2803
c1cocc1C(F)(F)F,0.2446
C(COCC=O)C#N,0.2297
Cc1c(oc(c1N)O)C,0.2151
CCN=c1[nH]c(n[nH]1)O,0.2345
N=CN1C2CC2C1=O,0.2255
OC1C2CC3C2N3C1=O,0.2344
CC1CC11NC=CC1=O,0.1865
CC1(O)C2CC2C11CO1,0.3183
OC12COC1=NCCC2,0.2525
CC(=O)NC(C#C)C#C,0.2678
CCOC1COCOC1,0.3251
c1c2c([nH]n1)NCCO2,0.225
C1CC2(CC2)OCC1=O,0.2116
CCC12CC(OC)C1N2,0.3257
CC1(C)OC(=N)C1N,0.2685
CC#CC1C2CC1O2,0.2763
Cn1c(=O)[nH]c(n1)C=O,0.1584
OC1C2CC2CC2OC12,0.3236
Cc1c(c[nH]c1OC)N,0.2293
COC1CC(=O)NC=C1,0.2123
CC(CC=O)CC#N,0.2271
COC1OCCC1=O,0.2152
O=C1ON=NC=C1,0.1692
CCN(C=O)C(=O)OC,0.2476
CCOC(=O)N(C)C=O,0.2519
OCC1C(O)C1OC=N,0.2601
CN=C1OCC1C1CC1,0.2771
CC12C3CCC1=CCC23,0.2201
COC(CCO)CC=O,0.2187
OC1C2C(O)C1(O)C2O,0.3019
CC(=O)CC#CCCO,0.229
COc1c(nn[nH]1)N,0.2245
CC1CC2CC2(O)CO1,0.311
CC(O)C12CC1N=CO2,0.2579
COC1(C=O)C2CC1C2,0.2089
O=C1OC2CC=CC2O1,0.2641
OC(C#N)C1NC1C#N,0.2927
CC1C2C1C(=O)NC2C,0.2646
Cc1nc2c(o1)CCC2,0.2267
CN(C)c1c(n[nH]n1)N,0.2073
CN1C(C#N)C1(C)C,0.26
O=CN1CC2(CC12)C=O,0.2098
C1CC(C1)NC(=N)C=O,0.1645
C1CN=C(NC=N1)C#N,0.1966
CN(C=N)c1cnon1,0.19
CN(C)c1conc1O,0.2271
CC1CC2(C)OC12CO,0.3177
C#CCCCCC1CC1,0.3158
CC1OC(=O)CC1C=O,0.2215
N=C(CC1CC1)OC=O,0.2565
C1CC2C3C4C2C(C1)N34,0.318
OCC1C2CC2C1=O,0.2251
CC1CC2OCC=C2C1,0.2423
Cc1cc(no1)C(=N)N,0.2116
CCC#Cc1conn1,0.1987
C1CC2NC2C=CCO1,0.2375
N=C1OC=NN1C=O,0.209
CC(=O)C1=NCC(=O)N1,0.176
CCC12CCC(O1)C=C2,0.2566
CC1C2CC2C1(O)C=O,0.2264
CCOC(C#C)C#C,0.276
N#CCC1OC1C1CN1,0.2881
CCC12C(C)C1OC2=O,0.2734
CC12C3CC1COC2C3,0.3159
O=C1C2CC1C(=O)CO2,0.1943
O=C1N2CC3C2C13C#N,0.2426
CC1C2CC3C4C2C1N34,0.2996
CC1CC2C1N(C)C2=O,0.2707
O=CC1CC2(CCO2)C1,0.2256
CC(C)C1=CC2CC1C2,0.2365
N=C1NC=CC(=O)N=C1,0.1587
COCc1[nH]nc(n1)O,0.247
CC1C2OC1C1OC21,0.3116
OC1CCC=CC1C#C,0.2619
CC1NC1C1=CCCC1,0.2425
CCC1(CO1)C#CCO,0.2744
Cc1cnn(c1O)C,0.2485
OC12C3C1C1C3OC21,0.3085
CC1OCCC11CCC1,0.3173
c1cc(n(c1)C2CC2)O,0.2352
CCCC(=O)C(=O)C#N,0.1487
CN1C2C3OC2C13,0.2848
ON=C(COC=N)C#C,0.2079
CC1C(O)C2COC12C,0.3039
C[NH+](C)C1=CC(=O)O[CH-]1,0.1301
OC1CCNC=CC1=O,0.1783
CC1C2CC3OCC3N12,0.2986
CCC1C2CC1C2C,0.3827
CC12CC1(CO)OC=N2,0.2576
CCC1C(C)(C)C1(C)O,0.3099
COCC(C)(O)C#N,0.3049
CCNC(=O)C1CN1C,0.2396
CC12CCCC1(O2)C=O,0.2188
c1c(c([nH]n1)N)NC=O,0.2223
c1nc(on1)CCO,0.255
c1coc2c1NC=NC2,0.2014
C(C#CCOC=O)O,0.2662
N#CC1C2C3OC1C23,0.2723
CN(C)c1coc(=O)[nH]1,0.238
CC1CCC1CNC=O,0.2828
c1cc(=O)occ1C#N,0.1752
CC1OC2CCC12O,0.3009
C#CC12CC=C3CN1C23,0.1739
OCC1CCCC=C1,0.2648
c1[nH]c2nc(nn2n1)O,0.2235
OC1C=CC(O)C1C=O,0.2113
Cc1c(c(on1)N)C#C,0.2158
CC12CC(C1)CCOC2,0.3275
CC1CC2(CC3NC23)C1,0.307
CC#CC1(C)C2CCC12,0.2864
CN1C(C#N)C1C1CC1,0.2581
O=C1CC2CCC2=CN1,0.2066
CC1COC(=N)C(O)C1,0.271
CC(CO)C1=CNC=C1,0.2506
CCc1[nH]ncn1,0.2698
C1C=CC=CC=CC1=O,0.156
CC(CO)C1CC(=N)O1,0.2889
OCCC1CC1OC=O,0.2716
CC1C2C3C(C)C2C13,0.3744
CC1C2CC3OC2C13O,0.3038
CN1CCN=C1NC=O,0.2
C1CC12CC(C2)CC=O,0.2251
CC1C2CN=C(C#C)N12,0.1995
COC12COC1C(O)C2,0.2916
CCN(CC#CC)C=O,0.2698
OC1CCC11OCC=C1,0.2384
NC1=C(N=NN1)C1CO1,0.2257
OC1C(O)C1(C=O)C=O,0.2054
CCc1c(cn[nH]1)C,0.2503
CN1N=C(C)OC1=N,0.2165
N=C1OCCC11CCO1,0.2567
CC#CC1NC1C#N,0.2602
CC1(O)COC2COC12,0.3154
CC1OC1(C#N)C1CC1,0.2929
CC(=NC)NC=O,0.2349
CC1C2CC3(CO3)C12,0.3376
OCC1CC2C1NC2=O,0.2731
CC12CCC1CCC2=O,0.2169
CC1C(C)N1CC=O,0.2091
OCC12CC3C(N13)C2=O,0.2323
CCn1cc(c(n1)C)C,0.2516
O=CC12CC(O1)C21CC1,0.2063
C1C=CC2(O1)COC2,0.2445
Cc1c(oc(=O)n1C)C,0.2337
CC12CC1(O)CC(O)C2,0.3218
c1cocc1CCCO,0.2425
CC12CC3OC=NC1C23,0.2542
OCCOC1C2CC1C2,0.34
CCc1c(noc1C)C,0.2409
C1CN1C(=O)CCC=O,0.2303
CC#Cc1cc(c[nH]1)N,0.1846
Cc1cc(on1)OC=O,0.2263
COc1cc(=O)onc1,0.1883
C#CC#CCNCC=O,0.2138
CN=C1C=NN(C)N=N1,0.1627
C1C2CC34CC(O3)C4N12,0.2924
CCCOC1CCC1C,0.3261
CCC1CNC(=O)OC1,0.3065
C(=O)Oc1c(n[nH]n1)O,0.2253
CC12NC3C1OC23,0.2954
N#CC1C2C3C2C2C3N12,0.2758
CCN1C=CC(=N)N=N1,0.1645
CC1[NH2+]C1(C)CC([O-])=O,0.2727
C1C2C3OC4C1C4C23,0.3044
C1C2C3C4OC(CN12)C34,0.2974
COC1C(CO)OC1=O,0.2506
CC(C)(CC(=O)N)C=O,0.2287
CC1C2CC2OC1C=O,0.2065
CC1CCC2CC(C2)C1,0.3566
CCOC1C2CC(O)C12,0.3187
O=C1CC23CC=CC12O3,0.2166
CC1(C)C2CC(=O)OC12,0.2756
c1coc2c1CNC=N2,0.1751
O=C1CC2COC1C2,0.209
OC12CC1OCCC2,0.3168
O=C1CCC2=CCCC12,0.2067
CC12CCC3OC1C23O,0.2852
CC1CCC2=C1OC=N2,0.2308
COC1CNC(=N)C1=O,0.1737
CC1OCC11CN1,0.31
CC(C)C12OC3C1NC23,0.2928
CC12NC1C1(CN1)C2=O,0.2038
CC12CC3(CC3)C1(C)N2,0.2868
NC(=O)N1CCC1C#N,0.2717
O=CC1OCOC1C#C,0.2206
c1c(c(nc(n1)N)O)F,0.1961
OC12CC1CCC21CN1,0.2957
O=CC#CC1(CN1)C=O,0.1946
CC1(CO)CC(O)C=C1,0.2615
CC(O)C1CC(=O)N1,0.2771
CCC1CC2=CN=CN12,0.2556
C#Cc1c[nH]cc1C#N,0.2138
C#CC12CC(O1)C21CO1,0.2585
CC#CC#CC(=O)C=O,0.1492
CNC1=NC(=N)ON=N1,0.1485
CC1=CC=C(N)C(=N)O1,0.1583
C1C2C3C4C3C1CC24,0.3529
CC(O)(C=O)C1COC1,0.2158
CNC1(COC1=N)C#N,0.2471
CC1CC1CC(O)C#C,0.2907
COCC#CC#CC#C,0.1801
O=CCNC1COC1=O,0.2232
CC1=NC(=N)ON=N1,0.1582
CCC1=CN=COC1=N,0.1805
N=C1NC=NCC1C#N,0.2239
C1C=CC=CCC1=O,0.1974
[NH3+]CC1=N[N-]C(O)=N1,0.2548
CCC12C3C(C)C1CN23,0.3171
NC1=C(F)C(=N)C=CO1,0.1837
C1C2OC3C4OC4C1C23,0.2963
COC1CC1OC=NC,0.2701
CC1N=C2CCN2C1=O,0.2284
CCC1CN1C(C)C=O,0.2156
COCC1C2OC1C=C2,0.2348
CC#C,0.3222
CC(OC(=N)C#C)C=O,0.2206
OC12CC1N1CC21C#C,0.2286
N=CN1C2CNC2C1=N,0.2191
C(#N)C(=O)C(=O)C#N,0.155
C#Cc1c(cco1)N,0.1844
NC(C#N)C1(N)CCC1,0.279
CC#Cc1cc(oc1)N,0.196
C1CN2C(=N1)C=CC2=O,0.1648
CC12C3C4CC1CC2N34,0.2999
CC1C2C(C#N)C2C1=O,0.2211
NC(=O)C12CC3CC1C23,0.2682
Cc1c2c([nH]n1)[nH]nn2,0.2264
CCOC(=O)C(C)C=O,0.2195
CC1=CCNC=CC1=O,0.1721
CC12CC(CO)(N1)C2=O,0.2444
CC12CC1C(=O)CC2O,0.2265
FC1=CC(F)=NC(=O)O1,0.1999
CCN=C1CNC(=O)N1,0.2475
c1nc(no1)CN2CC2,0.2174
C#CC12CN1CC1CC21,0.2591
O=C1NCC(O1)C#N,0.2735
O=C1CC2(CC2C#C)N1,0.2689
CC1CC1(C)CC(C)=O,0.2237
[NH3+]C(CCCO)C([O-])=O,0.2681
CC1CC(CC#N)C1,0.3364
O=COC1CC=CCO1,0.2647
N#CC12CC3C(CN1)C23,0.2604
c1ccnnc1,0.1826
CC(=O)C12CCC1O2,0.2221
CCc1c(=O)cc[nH]n1,0.1925
CC1OCCOC1C=O,0.2054
COC1(C)CC11CCC1,0.3261
CC1(CN(C1)CC#N)O,0.2618
C#CC(CN1CC1)C#N,0.2694
CCNc1cnco1,0.2189
COc1cncc(n1)N,0.185
OC(C#N)C(O)C1CO1,0.2921
CCC1CNCC(=O)C1,0.1981
Cc1nc2n(n1)C=CC2,0.2032
CCCC(C)(CC)C#C,0.3173
CC12CC3CC1C2(C)O3,0.3126
CCC1(C)OCC1(C)O,0.3049
c1cnc(c(c1O)N)O,0.229
OC1CCC11CO1,0.3135
CCc1nnn(n1)C=O,0.2086
c1c(nco1)OCC#N,0.2226
N=COC1=NNN=N1,0.2296
CC(=NC)OC=O,0.2416
OC12CC1CC(=O)C2=O,0.1513
Cc1cncnc1OC,0.227
N=C1OC(C#N)C2OC12,0.2692
OC12CC1CCC21CO1,0.3181
OC1C2C=CC1C2C=O,0.2056
CC1C2OC2C1C=O,0.2141
COCc1ccco1,0.2338
OC1C2CC11OCOC21,0.3116
CCCC1(CC1O)C#N,0.31
O=C1CCC23CC12CC3,0.2193
CC#CC(C#C)(C#C)N,0.2556
C1C2CC1C1CCC2C1,0.3572
OC12CC1C1CCOC21,0.3108
CC(C)(O)C1CC(=O)O1,0.2878
CC1C2CC1(O)C2,0.3381
NC1=NC2CC2N1C=O,0.2053
Cc1c(onn1)C2CC2,0.2139
CC(O)C(=O)C#N,0.1925
Cc1nc(nc(n1)O)C,0.2258
[O-]C(=O)C1C2[NH2+]C1C=C2,0.2088
CC#CCCC#CC#C,0.2278
N#CC12CC1NC21CC1,0.2492
CC12CC3(CO)C1OC23,0.2999
C#CCNc1ccc[nH]1,0.2313
CN(C)C1C2NC1C2=O,0.2104
CC12OC3C(C13)C2=NO,0.2479
CC12CC(C1)OC2=O,0.2748
CC(O)(CC(N)=O)C#N,0.2756
CC(C)Nc1cnno1,0.2086
NC12C3NC1C3C2C#N,0.2696
OC1CCC(=O)C11CN1,0.2106
COCc1ccc(o1)N,0.2127
CC1(CC=CC1O)C=O,0.2273
CC1NC(C1O)C(C)=O,0.2117
OC1CC11CCNC1=O,0.2713
CC1CC(C)(C)NC1=O,0.2716
Cc1ccn(c1)C(C)C,0.2477
OCC1OCC1O,0.2972
CCOC1(COC1)C#N,0.2783
O=C1CCC2C=CCC12,0.2196
O=C1CN2CC3CCC123,0.196
C1C=CN(CC1=O)C=O,0.1911
OCC12CCC1C2C=O,0.2177
CC1(C)OCC(CO)O1,0.3269
CCC1(COC=O)CO1,0.2805
CC(C)OC(=O)C#N,0.2465
CC1=CCOC(=O)NC1,0.2551
NC(=O)C12CC1CO2,0.2577
COC1CC2C3OC1C23,0.3001
CC1C2CCC12CO,0.3144
CC1(O)C2C(O)C1C2O,0.3047
O=CC1CC1(C#C)C#C,0.2107
CC12NC1C(O)C1NC21,0.2852
CC1CC2(O)CC(=O)C12,0.215
CC(C)(C(=O)C(=N)N)O,0.175
OCC1CC2OC3C2C13,0.3048
CC1COC(C#N)C1=O,0.2151
C#CC(=O)c1cnon1,0.1925
OC1CC23CC12OCC3,0.2863
c1c[nH]c(=O)c(=O)nc1,0.1746
c1coc(c1O)C2CC2,0.2105
CC1=CNC(=O)C2OC12,0.2024
OC1CC1C1=CN=CN1,0.2482
CC(=O)NC1CCC1,0.2767
CC12CN3C1C2(O)C3=N,0.2545
CC1C(=O)OC2CC12C,0.2757
C#CC1C2CC3(CO3)C12,0.2918
CC12OC1C1OC(=N)C21,0.2801
CC1OC11C2C3OC1C23,0.3009
CNc1ncnn1C=O,0.1911
CC(C)C(C)(C)C(=O)C,0.2277
COC1CCC2CN2C1,0.2964
CC1C2CC(C3CC3)C12,0.3322
C1C2CC3OC1C2O3,0.3406
Cc1[nH]c(c(n1)CO)O,0.2319
CC1=C(O)C(=N)OC=C1,0.1681
CC12C(NC1=O)C2C#N,0.2436
CC1OCC2OC(=N)C12,0.2835
Cc1cc(c2n1CC2)N,0.2165
CC12CC(O)C1(C)C2O,0.2972
CC12C(O)C1OCC2=O,0.2218
CC1=C(COC1)C2CC2,0.2393
OC1COC2COCC12,0.2981
CN1C2(C)C3OC3C12C,0.2683
CC1CCOC11CC1O,0.303
CN1C2C3OC3(C=O)C12,0.1969
CCCC(=NO)C1CO1,0.2462
OC1CCCC(C1)C#N,0.3064
CCOC12CC1CCC2,0.3311
O1CC1C12OC3C1CC23,0.3061
CC(C)Oc1cnno1,0.2187
Cc1cc(c(cn1)N)F,0.2005
NC(=O)C1CC1(O)CO,0.2534
CCCC1CC(C1)=NO,0.2495
CC1(CC=O)CC1C#N,0.2225
CCC12CN1CC2O,0.2919
C1OC23CCN=C2OC13,0.243
CCC1CCC2CC12C,0.3351
CC(C)CC(C)C(C)=O,0.2298
O=CC1C2CC1C=C2,0.2006
c1[nH]c(=NC2CC2)on1,0.2083
COC(C)(C)C(C)O,0.319
CC1(CO)N2CC1(O)C2,0.3107
OCC1NC1CO,0.319
CC(O)C1CC(C)C1,0.3282
CCC(O)C(=O)C(C)O,0.2335
CC12NC1C=C1CCC21,0.2349
OCC1OC2CCC=C12,0.2434
O=CC1C2C3CC3CN12,0.1968
N=C1CC(=O)OCO1,0.2674
CCC1OC(C)OC1=O,0.2739
N#CC12CC1CC21CC1,0.277
CC(=O)C(=O)CCO,0.1583
CNC1(C#N)C(C)C1N,0.2605
CC1OC(=O)C2C(O)C12,0.258
CC1(O)COCC11CO1,0.3229
O=CC1C2OC3CC2C13,0.2112
CC12COC1C2OC=O,0.263
C(C(=O)N)N=C(C=O)N,0.1739
CN1CC2(C)OCCC12,0.296
C#CC1CC2OCCC12,0.2906
CCC1OC11COC1=O,0.2581
CC1CC1(O)C(O)CO,0.3054
CC1CC=CC(C1)=NO,0.1945
CCC(O)C(=O)C=O,0.1573
COC1(CC1C#N)C=O,0.2147
CCC1OCC1(C)C,0.3174
CC1(O)C2CC(O2)C1O,0.3101
CC1OC2COC1C2O,0.3221
Cc1nc(on1)N=CN,0.197
CCC1(CC(=O)O1)C#N,0.2833
COC(C)C(C)(C)OC,0.33
CCC1=CCC2NC12C,0.2458
c1c(nncn1)N(=O)=O,0.1543
CC1=C(OC(=N)N1)C=O,0.1615
CC(=NO)CNCC=O,0.2155
CC1=CC2(O)CC1C=C2,0.2152
N=C1OC23CC4C2OC134,0.2306
CC1CC(=O)N2CC12C,0.2404
c1coc2c1cc(o2)N,0.2198
Cc1nc(on1)CNC,0.2196
CC1(C)OC2C3OC2C13,0.2985
O=C1C2CCN2C1C#N,0.1988
Cc1c(c(c[nH]1)N)OC,0.2272
CC1C2OC2C1(O)C#C,0.2693
CN(C)C1=CNC(=N)O1,0.2212
C(=N)Nc1[nH]nc(n1)O,0.2033
CC(C#N)C(CN)C#N,0.2733
CC12NC1CC2(C)O,0.2993
N=C1N=NNN=NC1=N,0.1623
CN1CC(O)CC1=O,0.2724
C1C2CC=C3CCCC123,0.2369
OC(C#N)C1=NCCO1,0.2632
CCC1C2N1C1CC21C,0.2884
NC1C(OC1=N)C1CC1,0.2677
CCC(C(C)O)N1CC1,0.3027
O=C1CN2C3C=CC2C13,0.1817
N=COCC1(CO1)C#C,0.273
O=C1C2OC3COC2C13,0.1967
Cc1cn(nn1)C(=O)N,0.2209
CC1CCC1COC=O,0.2862
NC(C#N)C(C#C)C#C,0.2691
CCC(C)C(O)CC#N,0.316
OC1CC11CCC2CN12,0.2977
CCC1C=CC2CC12C,0.245
CN=c1oc(=O)cno1,0.1798
CN=C(C#N)N1CCC1,0.192
OC(C=O)C#CC=O,0.1987
CC1(O)C2CC=CCC12,0.2675
CN1C=CC(=O)C1=N,0.1457
CC12CN3C1C2C3C=O,0.2095
CC1C2OC(C)(C)C12C,0.309
O=C1CC=CC(C1)C#N,0.2224
COc1cncc(=O)o1,0.1593
CCC1COC1C#CC,0.2703
CC1CC2NC2C1C#C,0.2927
CC12C3C1C1C3CC21C,0.3204
CCN1C(CO)CC1=O,0.2775
CC1(C)C2C3CC1C23O,0.3044
CN=c1cc(nco1)F,0.1747
CC12C3CC3N1C2C#C,0.2415
CC12CC(O)C1N=CO2,0.2536
CC1(C)CC2OCC12O,0.3014
CCC1(C)CCC11CC1,0.3436
FC(F)(F)C(=O)OC=N,0.2421
CC1C2CC3CC2(C)C13,0.3527
CC(=O)C12CC1NC2=O,0.2216
COC1(COC=N)CC1,0.2798
[NH3+]C1C(O)C1CC([O-])=O,0.2755
OCC(=O)C1C(O)C1O,0.2053
Cc1c(cn[nH]1)C(C)C,0.2507
CCC1(CC1C)C(C)O,0.3332
CC1CC2CC(O2)C=C1,0.2372
C1=C2C3C4C1C1C4C3C21,0.115
CC12OC3CC1C23C=O,0.2075
ON=C1C2C=CC1C2O,0.2445
O=CC1CCC11CCC1,0.2229
CCCCC#CC=O,0.2054
C1CC23OCC4C2C1C34,0.3302
CCC1(CN1)C1(O)CC1,0.3089
CC(=O)C12CC1C1CC21,0.2082
CNC1=CC(=O)C2NC12,0.1913
O=C(C#C)C1C2CC1C2,0.1985
O=C1NC2=NCCC2O1,0.2574
CC#CCC(C)CC#N,0.279
CC1C(O)C1(C=O)C#N,0.2103
CC1COC2CC12C=O,0.2189
OC1COCC1NC=O,0.2759
CN(CC1CCC1)C=O,0.2713
N=C1OC(C#C)C11CC1,0.2697
c1nc(nc(n1)O)N,0.2299
C(C=O)C(=O)CC=O,0.2079
N#CC1OCC2(CC2)O1,0.2858
CN=C(C=O)OCC#C,0.1706
C(C#N)OCC(F)(F)F,0.3007
CC1N=C2OC3C1C23N,0.1534
C#CCC12CC1OCO2,0.277
CN(C=O)C(=O)CCO,0.2269
OCCCC1CCC1O,0.3264
CC1NC(=O)OC1C=O,0.2258
CCC1(NC1C)C(C)=O,0.2247
CC1CCC1N1CC1,0.3086
Cc1cn(nc1O)C=O,0.2049
CC(C(O)CO)C1CN1,0.3151
CNc1cc[nH]n1,0.2246
N1C2C1C1NC1C1NC21,0.2804
c1c(c(noc1=O)F)N,0.1798
C[NH+](C)C1CC1C([O-])=O,0.2723
CC1(CC1)CCCO,0.3415
[NH2+]=CNC1=CC(=O)O[CH-]1,0.0709
C(=N)Nc1noc(=O)o1,0.2305
C1C2CC1O2,0.3346
CCC(=O)C1CC2CN12,0.2184
C1CC1C12CC(CC1)O2,0.326
CN1C2C(O)C1C2=NO,0.2477
c1cnnn2c1cnn2,0.1628
COC1(CC1O)C#N,0.2735
C#CCc1[nH]c(=O)[nH]n1,0.2346
CCN1CCOCC1=O,0.2625
CC12CCC1N1CC1C2,0.3022
COC(CO)C1(C)CO1,0.3171
CC(O)CC1CCC1C,0.3257
C1C=CC2C3NC(=N1)C23,0.1888
CC(=O)C1(CC1)C(=O)N,0.224
ON=C1C2CC2C2CC12,0.2351
CC(C)(C)C1=CCCC1,0.26
C(c1c([nH]c(=O)[nH]1)N)O,0.2118
CC(C)C1OCC1=NO,0.2439
c1cn[nH]c(=O)n1,0.1721
C1OC2CCC=CC=C12,0.1891
OC1(CC1)C1CCO1,0.3088
ON=C1C2NC1C1NC21,0.2588
CC1(C)CC(=O)C2CN12,0.2183
CC1(C)CCCC2OC12,0.3341
c1coc(=NCCO)[nH]1,0.2204
CC1C2CC3CC3C1O2,0.3144
OCC1CC2OCC2=C1,0.2429
CC12CC1C1OC2C=C1,0.2411
CC1C=CC2CC(O)C12,0.2499
C1OC11C=CC2CCC12,0.249
CC1NC11C(C)OC1C,0.3091
NC(=O)C1OCC=C1,0.2335
O=CC1CC=CC1C=O,0.2046
CC1C=CC2(CO2)C1=O,0.2043
CCC(C)N1C=CC=C1,0.2495
C1CC(=O)C(C1=O)CO,0.1978
C1Oc2c(noc2O1)N,0.2185
NC(=O)C1OCC2OC12,0.2754
N=C1NN=NNC1=N,0.2019
CCC1(COCO1)C=O,0.2177
CCC1C=CCCC1=O,0.2219
C1C2C3C4CC=CC24N13,0.2274
COC1C2OC(=N)OC12,0.2944
N=C1OC2CC3(CC3)C12,0.2842
N#CC12CCC(O1)C=C2,0.2576
OC1COC1(C#N)C#N,0.2584
COC(C)C(=O)C#C,0.187
CC(C#C)C1CCC1=O,0.2172
N=C1OC2C3CC12CC3,0.2843
CCN1CC(C#N)C1=O,0.2714
CC1OCC2(CN2)C=C1,0.2515
COCC1COC1=O,0.2719
CC(CNC=O)C(C)=O,0.2286
CC1C2CC(CC#N)N12,0.2717
CC12OCCOC1C2O,0.2824
O=C1COC(CN1)C#N,0.2541
OCC1(CN1)C1(O)CC1,0.3041
CC1CC1N1C=NN=C1,0.2625
OCC(O)(CC#C)C#C,0.273
OC12CC1(O)CCCC2,0.2938
Cc1cccc(n1)C=O,0.1832
O=C1OC2C3COC1C23,0.2468
OC1CC(C=C1)C1CC1,0.2583
N=C1OCC23CC(C2)C13,0.2811
CC1(CC1N1CC1)C#C,0.2874
COC1(CN=CO1)C#N,0.2778
CC1CC1OCC(C)=O,0.2202
Cn1cc2c(c1)OCC2,0.2244
CC(OC(N)=O)C#C,0.2966
CCC(O)C1=NCCO1,0.2738
OCC12CCC1(CO)O2,0.3235
CNC(CN)(CO)C#N,0.2651
CC1(C(=O)NC(=O)N1)C,0.2552
CC1CC2(C)NC1C2=O,0.2277
CC1=CC2(C)CCC1C2,0.2526
CNc1nc[nH]n1,0.2251
O=C[CH-]C(=O)C1CC[NH2+]1,0.1905
OC1C2CC(OC12)C#C,0.2681
Cc1cn[nH]c1O,0.2514
N=C1OCC2(CC2)O1,0.3042
CC1CC(O)CN=CO1,0.257
C1CC2C1C1CCC2C1,0.3458
CC1(C)C2OC(=O)C12N,0.2455
OC12CC1N=CNC2=N,0.2131
O=C1CC2C(C#N)N2C1,0.2133
COC=NC1CC2CC12,0.2635
CC12OC1C=CC2(C)O,0.2389
CC(=N)OC1CC=CC1,0.267
N#CC1C2CC3CN3C12,0.2595
Cc1cc2c([nH]1)nco2,0.1969
CC(=O)CC(O)C#N,0.2349
C1OC2CC=CC(C2)O1,0.2541
c1cnc(c(n1)C#N)F,0.1947
N#CC12CC(COC1)N2,0.2636
CC12CC3CN1C2(C)C3,0.3157
CC#CC1C2C3CN2C13,0.2825
CC(C)C#CC1CC1O,0.2796
COCC(=O)CO,0.2343
CCC12NC1COC2C,0.3057
CC1C(O)C2C=CCN12,0.2176
C1CCNC=C(C1)C=O,0.1923
Cc1ccn(c1O)C,0.2337
CC1CC11CCC1C=O,0.222
O=C1CN2C3CC(O1)C23,0.2533
CCOc1c(cn[nH]1)O,0.2342
CC1CC2=C(C)C=NN12,0.2565
CC1=CC2NC2(CO)C1,0.239
CC12C3CC1C1C3CC21,0.3532
[N-]1[NH+]=CN=C2N=CN=C12,0.1738
CC1=CC2(CC1O2)C#N,0.233
Cn1cc(c(c1O)O)N,0.2226
CC1C(CC1(C)O)C#N,0.3065
CN=COC1CC1,0.2714
OCC1CC2COC2=N1,0.2608
O=C1CCC1CC1CO1,0.2206
Cc1ncc(o1)C=O,0.1934
c1cnc-2cnc[nH]c12,0.1619
O=CC12CC1COC2=O,0.2215
CC1OCC11C2CCC12,0.3183
CC12COC1C1CC1C2,0.3168
c1nc(c(=O)[nH]n1)N,0.1817
NC(=[NH2+])CC(O)C([O-])=O,0.1248
CC(C#N)C(C)C1CO1,0.3033
CC1C2CNC(=O)OC12,0.3066
Cc1nc(c(=O)on1)O,0.1875
CN(C)Cc1ccon1,0.2051
OC12CC3C1C2OC3=O,0.2649
OC12CC1C(C2)OC=O,0.2773
CC1=CCC2(CC2O)C1,0.2602
C1CC(O1)C12CCC1O2,0.3114
C1C2C=CC3COC2C13,0.2403
NC1CCCCOC1=O,0.2381
c1cnc(cn1)N=CN,0.1757
COc1c(c[nH]c1N)O,0.2257
COCC1C(O)C1(C)C,0.3134
OC1CC2CC=CC12O,0.2442
OC1C2C3C2C2C3CC12,0.3095
CC1C(O)C(=O)C1C#N,0.2191
CC1CC(CO)(CO)O1,0.3099
CN1CC2OC3(CC3)C12,0.2848
N=C1CCC(=O)N1C=O,0.2147
C1CC=CC2NC2C1,0.2506
OCCC1C2C3CN3C12,0.2844
C1NC1C12NC1CC=C2,0.2388
OCC1NC11COC1=N,0.2651
C#CC1OC2C3CC2C13,0.2805
CC1C2OC(C1C)C2=O,0.2344
CC12OC3CC1(C#C)C23,0.2571
CC1CC(OC1C)C#N,0.2925
CC12CCC3COC1C23,0.313
[O-]C(=O)C1C2CC1[NH2+]2,0.1795
Cc1c(cnc(=O)[nH]1)F,0.1668
Cc1c(oc(=O)o1)C,0.2508
C#CC#CC#CC1CC1,0.1766
CC12OC3CC1(O)CC23,0.3036
CC1(O)CC11CC(=O)C1,0.2212
CCNC(=O)C#CC#C,0.1978
c1cncc2c1[nH]nn2,0.2036
C1CC2CC1OC=N2,0.2695
CCCn1cccc1,0.2467
CC(C#N)C(=O)N1CC1,0.2512
COC1OCC=C1C#N,0.2206
NC(=O)C(=O)C1CN1,0.1753
CCC1C(CC)N1C,0.288
O=C1CNC2CC2N1,0.2525
c1c(c([nH]n1)N)C=O,0.1997
O=C1C2C3C2C2C3N12,0.2243
C1COC(OC1)CO,0.3275
CC12CC(C=O)C1(C)O2,0.2193
CC1C=CC2CC12O,0.2453
CC1(C)C2CC(=N)OC12,0.2712
CC1(O)CC1(CO)CO,0.282
CN1CCc2c1nn[nH]2,0.1942
CC12CC(C)(C1)C=CC2,0.2551
Cc1ccnc(c1O)O,0.2046
C1COc2c1c([nH]n2)N,0.2372
C1c2c(onc2N)CO1,0.2377
CC1CC=CC1OC=O,0.2574
C#CCc1ncc(o1)N,0.2178
C#CCCOC(=O)C#N,0.2104
CCc1coc(c1O)N,0.2187
CCC12OC3(C)C1CC23,0.3188
CC1(C)C=CCC2OC12,0.2683
CC12C3C4N1C2(C)C34O,0.2669
CC1(C)CC2COC2C1,0.3212
CCC1CCC1C(N)=O,0.2702
N=COC12CC1C(=O)C2,0.2306
N#CC1(C#N)C2CC1C2,0.3029
CC1OC(C)(C)C(C)=C1,0.2501
N=C1C=NOC=N1,0.2028
N=C1NN=NC=N1,0.1588
CC12COC3C(O1)C3O2,0.2946
c1cc2n(c1)CC=CC2,0.2127
C1C=C(CO1)C2COC2,0.2416
OCC1OCC(=N)O1,0.2801
OCC12CN3C1CCC23,0.2882
OC1CC2CCC1CC2,0.3262
CC1(CC1)NCC#N,0.2631
CC1CC(CC#N)C1C,0.3339
CC(=N)OCCCC#C,0.2979
COC1C2NC2C1C=O,0.2103
CCC1C2OC1C=C2,0.2365
Cn1cnc(=O)cc1O,0.2096
OC1CC11CCC(O)C1,0.3257
CC1(C)OC1C#CC=O,0.2009
CNc1cnnoc1=O,0.1746
OC1CC2OC2C1C#N,0.311
CC1(CC1NC=O)C#N,0.2709
CC1=C(CC2CC12)C=O,0.1889
c1c(c(no1)C=O)C#N,0.1892
c1c(c(nc(=O)[nH]1)F)N,0.1608
CC1CCC(=O)OC1C,0.2723
C(CC(=O)NC=O)CO,0.2219
OC12CC1OCOC2=N,0.2516
NC1(C#N)C2NC(=O)C12,0.2371
O=CC1OC2C(C#N)C12,0.2155
O=CC1CC2OC1C=C2,0.2224
CC1C(O)C(=O)CC1=O,0.2002
C1OC23COCC2NC13,0.293
CC1(O)C2C3CC1C23O,0.307
CC12CCC1C2CC=O,0.2225
OCC1=CCC2CCC12,0.2576
CC(C)(C)c1cn[nH]n1,0.2574
CC(C)C1CC(C)CO1,0.319
CCOCC1(C)CO1,0.3392
C(C=O)OC(=O)C=O,0.1739
CN1C2CC2C1(C)C#N,0.2562
CC12OC1C1COCC21,0.313
C1=CC2N=CN3C1C23,0.2271
CCCN1C=NCC1=N,0.2165
Cc1cc([nH]c1NC)O,0.233
NC(C#N)C#CC(N)=O,0.2265
O=C1CC23OC4C2CC134,0.1935
C1C2OC1C1CC2O1,0.2767
O=C1NC=CC1C1CN1,0.2122
CC(=NC)OC(C)(C)C,0.2707
CC(=N[O-])C1=CNC=[NH+]1,0.1026
OC1C(O)C1C1COC1,0.2836
CC12CC(=O)OC1CO2,0.2699
N=C1[N-]N=C(NC=[NH2+])O1,0.0821
CC1OC1C1(C)OC1C,0.341
C#CCC1OC1CC#C,0.3043
OC1C2C1C1OCCC21,0.3079
CC1C=CC2=C1NC=C2,0.19
CC1=CC(O)CC1(C)O,0.254
CC(C)(C)c1c[nH]nn1,0.2514
N=C1NN=NN1CC#N,0.2013
OCCC(C#N)C1CN1,0.2783
CCC1CC(C)N1C=O,0.2617
CN1CCC=C(C1)C#N,0.1919
CC1(O)CC2OC=NC12,0.2617
CC1NC11CCCOC1,0.3171
CC1OC2(CO)CCC12,0.3082
CC12CC(O)(C=C1)C2=O,0.2361
CN=COCC#CC#N,0.2072
c1cn(cc1N)CCO,0.223
Cc1ccncnc1=O,0.1654
C#CC(C=O)C=O,0.1912
CC(=O)C(O)C#CCO,0.2205
CC1=CCC2(C1)COC2,0.2599
COC1=NOC=NC1=N,0.2048
CCNC1=COC(=N)O1,0.2362
OC1CC2COC1O2,0.3332
OC1CN2CC2C2OC12,0.2876
CCC1OCC11CC1C,0.3151
C1NC1C1=CCCC1,0.2451
OC1C2C3CC1CC23O,0.3145
NC(N)=[NH+]C1=NC=N[N-]1,0.1841
CN=C1OC(C)OC1=O,0.1974
Cc1nc(c(o1)C=O)N,0.1758
CC(C)C1OC2(C)CC12,0.3111
CC1CC(O)C2CN2C1,0.2857
C#Cc1ccnc(=O)o1,0.1621
OC1=C(NN=N1)C1CO1,0.2173
Cc1cncn1C,0.2483
CCC1(CC1(C)C)OC,0.3093
CC(O)C(C)(C)C(C)=O,0.2278
OC1CCC(=CC1)C#C,0.2127
CC(CO)C(C=O)C#C,0.2197
OCC(C=O)N1CC1,0.2214
CC12C=CCC3C1OC23,0.243
CC12OC3CC1(O)C23O,0.2672
CNC(=O)OC(C)C#N,0.284
CC1(OCC=C1)C#C,0.2514
CCC12CC3C4C(C13)N24,0.3029
N=CN1C2CC2NC1=O,0.2375
c1cnc([nH]1)N2CCC2,0.2342
CCC1OCCC11CN1,0.317
CCC1CCCOCO1,0.3342
O=CC12C3CC1OC23,0.2158
NC1C2C3N2C(=N)C13O,0.2474
CCC1CC(C1)(C)C,0.3577
CN1C=CC(=N)C(F)=N1,0.1741
C#CCC1=CCNC1=O,0.2237
OC1C2CN=CN2C1=O,0.2247
CC(C)(c1nnon1)O,0.2197
C1NC2=NC3C4NC13C24,0.1829
CC1CNC(=O)C(=N)N1,0.2042
O=C1CC(CCN1)C#C,0.2633
CC(OCC#C)C(N)=O,0.2594
COCCC1=NCCO1,0.2713
Cn1c(c(cn1)N)N,0.2382
O=C1OC2CNC12C#N,0.2314
N#CC12C3C4C3C1OC24,0.2772
CC1C2C(CO)N=CN12,0.2294
Cc1c(=O)[nH]nc(n1)C,0.1713
CN1CCC(=O)NC1=N,0.2257
O=CC12NCC3OC1C23,0.1903
OC(C=O)C(=O)CC#C,0.195
CNC(=O)C1CCC1,0.2722
CC(O)C(C)C(N)=O,0.2684
CC1=CCC2(C)CC1C2,0.2523
Cc1cc([nH]c1)CC=O,0.1757
CC(=O)CC(=O)C(=N)N,0.179
CC1CCOCC(=O)C1,0.2162
NC1C2OC1(C=C2)C#N,0.2292
CCCC(C)(O)C(N)=O,0.266
CC1(O)CC11COC1=N,0.2583
CCCC(O)C(=O)OC,0.2695
CN=COC(C)C#C,0.2716
CCOC(=O)CC1CN1,0.257
NC(CCO)C#N,0.2937
CCC(O)C12CC(C1)C2,0.3279
OCC1NCC1C#N,0.2716
O=CC1CCC1CC#N,0.2259
CNc1ccncc1F,0.2147
CNc1c(nc(o1)N)N,0.2187
CCCC#CC1(CC1)C,0.2843
OCC1(C#N)C2CC1O2,0.2763
CCC(O)(C#C)C#CC,0.2719
CNc1coc(n1)CN,0.2059
CCN=COC1CC1,0.2714
OC12C3C4CC1C4C23O,0.2941
CC1OC11C(C)CC1C,0.3214
COCC1C(C)CC1=O,0.2197
CNC1(COC1=N)C=O,0.1915
O=C1CN2CC2CN1,0.2616
C#CCNCCC#N,0.2826
COC1C=CC2OC12,0.2393
CCC12CN3C1CC23,0.3101
COC12CC3C1N3C2,0.2984
C1CC2(C1)C=CCC2=O,0.2172
CNc1c(nc[nH]1)C#N,0.2128
NC(=O)C1=NC2CC2O1,0.214
CC1(O)CC2CC1C=C2,0.2522
c1c(c[nH]c1C#N)CO,0.2061
OC12CC(C1)C(=O)NC2,0.2729
O=C1CC2CC1NC2=O,0.2114
CC(CO)(OC=O)C#C,0.2784
OC1CCC2=C1COC2,0.2442
OCC1(CCC1O)C#N,0.295
CCOC1(CC1)C(C)C,0.3135
CCC1OC1C(C)C,0.3436
CCNC1C(N)C1C#N,0.2474
CC(COC=O)C(N)=O,0.2674
CC1C2OC2C(O)C1O,0.3245
N=C1CN=COC(=O)N1,0.2492
c1c(c[nH]c1CCO)O,0.2284
C1C(CO1)C(=O)CC#N,0.2204
COCc1ccno1,0.2445
CC(O)CCC1CN1C,0.2874
O=C1CCNC(C1)C#N,0.2222
O=C1C2CCN3CC2C13,0.197
CCC(O)CC(C)C#N,0.3162
CC(C)C(C)CCCO,0.3425
CC(C)C#CC(N)C#N,0.2736
CC1CC(C)(C)C1O,0.3202
C(C#N)C(CO)(CO)N,0.2808
O=CC1C2CC2C1C#N,0.2143
O=CC12NC1CC21CC1,0.2024
OC1CC11CC(C1)C#C,0.2977
CC12CC(C1)CC2,0.3726
C#CC1CC=CC11CC1,0.2471
CCC12CC3N1C3(C)C2,0.3115
NC1(CC1O)C(O)C#N,0.2439
OCC12CN(C1)C2C#N,0.2538
CC1=C(C)C(OC1)C=O,0.1991
C1C=CC23OC2C=CC13,0.2231
CC#CCCC1CC1O,0.3022
CC(=O)OC1CC1,0.2825
O=CC1(CN2CC2)CO1,0.2054
CC1(CN1)C#CCCO,0.2806
OCC1C2CC3CN1C23,0.276
OCC1CC2C1N2C=O,0.2441
CC#CC1NC1(C)CO,0.2676
COCC(=NCC#C)N,0.2593
C[NH2+]C(C)C#CC([O-])=O,0.2013
CNC(=O)C1C(C)C1C,0.2729
CCC(=O)CC1CC1,0.2337
CC1C2C(C#N)C1N2C,0.2542
CC(O)C(=O)OC(C)=N,0.2525
CCC(N)(CC#N)C#C,0.2794
CN=C(c1cc[nH]n1)N,0.2129
CCC1C2C3OC1C23,0.304
NC(CC1CCO1)C#N,0.2805
C1NC1C1NC11COC1,0.3004
ON=C1CC2C3CN2C13,0.2347
ON=C1C2C3C(O)C1N23,0.2347
CC1CC2CC3OCC123,0.3055
CC12C(CC1=O)C2C#C,0.2268
Cc1ccncc(=O)n1,0.1654
COCCC(=O)C#N,0.1831
CC1CN(CC=O)C1=O,0.2105
CC(C#C)C1CC(C)O1,0.2957
N=C1CC2(CC2C=O)O1,0.2222
Cc1c(con1)OC,0.2291
CC1OC(CC1O)C=O,0.2131
O=C1C2COC11COC21,0.2084
CCC1CN=COCO1,0.2595
CCCC(C)(C)OC,0.3247
CC1CC2CC(C#N)C12,0.3131
CC12CC1C1COC21C,0.3109
O=C1CCC2OCC2C1,0.224
C(=O)N(C=O)C=O,0.2162
CC1=CCC2C(O)C12O,0.2372
OCC1NC1C1CC1O,0.3152
[NH3+]CC1OCC1C([O-])=O,0.264
CCOC(=O)CC=O,0.2269
CC12OC3C1OCOC23,0.3092
CC12CCNC(=O)C1N2,0.2578
COC1CC1CN1CC1,0.3158
O=C1CC2NC2C2OC12,0.2153
c1c[nH]c2c1OCC2,0.2187
CC(O)(C#N)C(=O)C=O,0.1459
OC1C2OC=NC12,0.2557
OC12C3C4C3C1OC24,0.3004
CCCC#CC(=O)NC,0.2357
CNC(=O)C#CCC#N,0.2315
CCc1c(nc[nH]1)CC,0.2432
N=C1CC2(CC3CC23)O1,0.2856
CC12C3CC4C(CC13)N24,0.32
NCC1(COC1=N)C#N,0.2466
COC1(CN2CC12)C=O,0.2012
CC1CC1COCC#C,0.2877
OCC1OC11CNC1=N,0.2508
NC(=[NH2+])N1[CH-]C(=O)C=C1,0.1091
Cc1c[nH]c(c1O)N,0.2366
CC(C)C1(CC1)OC,0.313
CN=C1OCC1C,0.2791
CC(OCCO)C1CO1,0.331
c1c(coc1C#N)CO,0.2023
c1c(nc(o1)C=O)O,0.163
Cn1cc(c(n1)O)C#C,0.2143
OC1CC2NC(C1)C2=O,0.2274
CC1=CCC(=O)NC1=O,0.2092
CC1(O)C2OCC12C=O,0.2146
CC1C2CC2C1(C)O,0.315
CC1N=COCC1CO,0.2742
CC1CC2C(CC#C)C12,0.3071
O=C1NCCC2OC12,0.246
C(COC(=O)C(=O)N)O,0.2059
Cn1c(cnn1)C(=O)N,0.2242
CC1CCC2=C1NC=N2,0.2385
NC1=[NH+]C2=C(C1)N=N[N-]2,0.1322
CC12NC1C=CC2(C)C,0.2435
OC1CC11CC(=O)CO1,0.2184
[NH3+]C1COC1CC([O-])=O,0.1809
CC#Cc1ncc(o1)N,0.1794
CCC1NC1(C)CC=O,0.2183
CC1CC=C(C)NC1=O,0.2144
c1c(ncc(n1)F)C#N,0.202
C(C1CN1)N1C=NN=N1,0.2621
Cc1coc(c1O)NC,0.2142
c1cc(nc(c1)F)C=O,0.1782
CC(N)(C#C)C(O)C#N,0.2699
CCN1CC1C1(C)CC1,0.3032
CC1C2OC2C2CC1C2,0.3418
CC1C(CO)C1CC#N,0.3024
c1c(nc([nH]1)C=O)O,0.1647
CC12OC(C#N)C1C2O,0.2575
CC12OC1(CO)CC2O,0.3172
CC1(O)CC1C(O)CO,0.3129
CC1C2C(CCN12)C#N,0.2689
ON=C1CC23CN(C2)C13,0.2057
CC12CC1OCC2,0.3134
COc1c(nn[nH]1)C#C,0.2222
CC1NC11C2NC2C1=O,0.2114
OC1C(C=O)C1C=O,0.2096
NC(=O)C(=O)C1CO1,0.1687
c1c(c(=O)onc1F)F,0.1829
CC1CNC(=O)NC1=O,0.2488
CCC(O)CCC(C)O,0.3277
O=C1CCNC1C1CO1,0.2015
C#Cc1ccn(c1)C=O,0.1783
CC1CC(C)C(CO)=C1,0.2578
CC1C(=O)C2OC12C#N,0.2086
CN1CC2CCC2C1=O,0.2666
CC1=CC2OC(C1)C2O,0.2348
CCN=C1NC2COC12,0.2411
NC(=O)C1COCO1,0.269
CCC(=O)N(C)C1CC1,0.2564
CCC(C)(C=O)C(C)O,0.2157
N#CC1C2CCC1CC2,0.3367
C1CC=C(C1)NC(=O)N,0.2271
CC(NC(C)C#N)C#N,0.2708
CC1CN2N=CC(C)=C12,0.2556
Cc1cn(nc1NC)C,0.2235
c1c(c(c[nH]c1=O)F)N,0.1799
CCCC1C2CC(O)C12,0.3211
CC1C(O)CC2(C)CN12,0.2888
N=CN1C(=O)C=CC1=O,0.1618
CC1C(C)C2(CO2)C1O,0.3168
C1CC1C1=CCC2CC12,0.2374
O=C(C#N)C12CCC1N2,0.1987
NC(=O)C1CCCC1=O,0.2144
C1C2NC3=C(C=NO3)C12,0.2106
CC1C2CC3COC2C13,0.3199
C1C2N1C13CCC21CC3,0.2636
OC12CC3(O)C(CC13)C2,0.3194
O1CC11C2C3N4C3C1C24,0.3057
CC12OC1C(C#N)C2N,0.2699
CC12C(C#N)C1C1CN21,0.2572
O=C1CC2C3CC(C3)C12,0.2152
OC1CC2OC3C1C23O,0.2943
CC1C2CC3C(O)C1C23,0.3129
C1C=C(CC1=NO)CO,0.2422
OC1=CC(=N)OC=N1,0.1755
C1CC1(C#CCCO)O,0.2728
CC1=CC2CCC=C2C1,0.2484
O=CC12OC1C1CC21,0.1995
CNC(=O)OCC=O,0.2269
CC#CC#CCC#C,0.2251
N#CC1NC2CCC=C12,0.2331
CC12C(C#C)C1C1CN21,0.2586
CCC12CC=CC1C2O,0.2336
CC(O)C1CCN2CC12,0.2951
COC1CNCC1=O,0.1875
C1C(=O)CC2=C1COC2,0.2116
COC1CC2CCC2C1,0.3178
CC12C3C1C1C2C3C1=O,0.2152
OC1C2C3CC3N2C1=O,0.2215
COc1cc([nH]n1)CO,0.2386
N#CC12CC3(CC3)C1N2,0.2825
CC1=CC(O)CC11CC1,0.2446
CC1=CC2OC2(C)C1=O,0.1752
CC1=CCCC(=O)C1O,0.2123
C1CC12CCOC2=O,0.2775
CC12CC(C)(C1)C(O)C2,0.3361
CC1OC2(C)C=CCC12,0.2491
CC1COC(C1)C1CC1,0.3299
N=C1NC(=O)NCCO1,0.2666
O=C1C=CC2CCOC12,0.1729
CN1C=NC(=N)C(F)=N1,0.1865
CC1=C(COC1)CC=O,0.2011
CC12COC=NC1CO2,0.2579
OC12CC(C1)C=C2C=O,0.1722
OC1C2C3CN4C3C1C24,0.2954
CC(C#C)C1C2CCC12,0.3038
CC1(O)CC1(O)C(N)=O,0.2443
NC(=O)C12OC1C1CC21,0.2392
CC1CCCCC=C1C,0.2509
CC1CC11CC2CC12O,0.3043
CCOCC1NC1C#C,0.2827
C1C2OCC3CCC3C12,0.2967
CC12COCC1C1CN21,0.3142
c1c(oc(n1)C=O)CO,0.1814
CC(O)CC(O)C1CN1,0.2886
COCC(COC)C=O,0.2296
OC1=CC(F)=COC1=N,0.1633
CC12CC1C1NC21C,0.2815
CCOCCN1CC1,0.324
CC1C2OC2(CO)C1C,0.3088
CCC(C)([NH3+])C([O-])=O,0.2704
NC(=O)C1C2CC2C1=O,0.218
C1CC1C2=CC(=O)CC2,0.1924
C1OC11CC2OCC=C12,0.2219
OCC12CCC1=CCC2,0.2429
Cc1c([nH]c(=O)[nH]1)O,0.2301
CCC1CCC1CC=O,0.2276
O1C=C2C=CN=C2N=N1,0.1539
COCC(=N)OC(C)C,0.276
CC12CC1(CO2)N1CC1,0.3016
COC1OC(=O)OC1C,0.3269
OC12CC1CN1CC21,0.2991
COC(=O)C(=O)C(C)O,0.1839
N#CC1C2COCC12,0.2934
c1c(oc(=O)o1)C(=O)N,0.2114
COC1(CC1O)C(N)=O,0.2572
CCC1CC(C)(CC)O1,0.3183
OC(C#C)C1CC1O,0.2507
C#CC12COCC1N2,0.2839
COC12CC1C1C(O)C21,0.2722
CCCOC1CC1O,0.3024
CC1OC(=N)C(=N)O1,0.2374
CN1C2C(CC12C)=NO,0.2395
OCC1=CC(O)C2CC12,0.2405
O=C(C#N)C12CCC1O2,0.1903
C1C=CCC11CN=CO1,0.2613
CN=C(C=O)OCC=O,0.1716
CCC1(CO)COCO1,0.3379
N=C1OCC1CC1CC1,0.2894
CN1CC1(CC=O)C#N,0.2172
CC1CC(OC=N1)C#C,0.2677
CC1(CO1)C12CC1CC2,0.3297
CC1C(O)C2CC12O,0.3102
C1C2COC3CN2C13,0.3023
CC1CC2(O1)C1CC2C1,0.3306
c1c(nno1)C2(CC2)O,0.2137
N=C1CC2OC2C(=O)O1,0.2427
OC1(CCOC1=O)C#C,0.2542
CC1C2C3C(O)CC3N12,0.269
C1C2OCC3=C2N1N=N3,0.1833
OC(C=O)C1CCO1,0.2162
CCC#CC(O)C#CC,0.2639
O=CN1C(CC1=O)C#N,0.2206
OC1CC2OCCC=C12,0.2496
CCCCC(O)CC,0.333
C1C=C(CO1)CCC#N,0.242
c1cnn2c1NCCC2,0.2338
C1C(COCO1)C=O,0.2186
CC12CC1C(=O)C(=N)O2,0.1876
C1OC2C3OC3C=C12,0.231
CC(C)N=CNC=O,0.2326
CCC1OC11CCCC1,0.3309
COc1c(cn[nH]1)C#C,0.2284
OCC1(COC1=O)C#C,0.2565
CCC(C)C1CC(C)C1,0.3622
CCN(C)C(=O)OC,0.2971
O=CC12CC1C(=O)C=C2,0.1883
CN1CC11CC(O)C=C1,0.2314
C1CC(=O)NCC=C1,0.2384
CCC1(CN1)C#CC#N,0.2249
CC12CC1(CC2)OC=N,0.2735
OC12CC1(OC2=N)C#N,0.2353
CCc1ccc([nH]1)C,0.2334
Cc1cc[nH]c1N2CC2,0.234
N#CC1COC2CC12,0.2831
c1c(n[nH]n1)NC(=O)N,0.2282
C1CC11OCC2NC12,0.2979
CCC(=O)OC1CC1O,0.2583
CC12CC1C1C3OC1C23,0.3107
CC1=C(N)N=NNC1=O,0.1694
CC1(O)CC1C(N)=O,0.2678
CN1C(C#C)C1C1CN1,0.2537
CN1CC11C2OC2C1O,0.3037
O=C1NCC11CCCO1,0.2591
OC1CC2C3N2CC=C13,0.2098
c1nc(no1)N=CN,0.2144
CCC1(CO)CO1,0.3314
O=C1COC1C1CCO1,0.2215
COC(C(C)C)C1CC1,0.3241
O=C1CC2CCC2C1,0.222
CCC1=C(COC1=O)N,0.2153
CC1(O)CC1(C)O,0.2909
CC1(CCC2CN12)C=O,0.2196
CCOc1c(ocn1)C,0.2115
OC12CCC11CC2CC1,0.283
N#CC1CCCCCO1,0.2933
CC(C)CC(C=O)C#N,0.2254
CN1CC1C(CO)C#N,0.2689
CCCn1c(=O)onn1,0.2288
C#CC12CCC1C1CC21,0.2712
OC1C2C1C1(CO1)C2O,0.3146
CC1COC1C1(C)CN1,0.312
C1C2(N1)COC(=O)OC2,0.3155
OC1CC2C3CC1(O)C23,0.304
O=COCC1NC1C#C,0.2728
CC12OC3CC1C23C,0.3116
OCCC1CCC(=N)O1,0.2858
N=CN1CCCCC1=O,0.2338
C1C2OC3OCC2C13,0.3364
CN=COC(=O)CO,0.2453
N=C1CC(O1)(C=O)C#N,0.2079
OCC1NC(=O)CC1=O,0.2055
N=C1OC2CCC1CC2,0.2853
O=C1NC2C3CN(C3)C12,0.258
CC1CC(=O)C=C1C=O,0.1523
C1CC2C=CC3C1OC23,0.2376
CC12CC1NC(=O)CO2,0.253
CCCC12CC(O1)C=C2,0.2349
C1C2N1CC21C2CCC12,0.3041
CC1=CC(O)CC1(C)C,0.2567
CN1C=NNC(=N)C1=O,0.1832
OC1CC2OC3COC123,0.2813
OC1CC2(C1)C1COC21,0.3027
O=CCOC12CC1OC2,0.2086
CN=c1[nH]c(n[nH]1)C#N,0.1604
CC1CNC2=C1NC=C2,0.2126
[O-]C(=O)C#CCNC=[NH2+],0.2028
CC1OC(C)C=C1,0.248
CCC12CC3OC3C1O2,0.3178
CC12CC3NC1C2C3=O,0.202
CC12CC3C1COC3C2,0.3206
C1CC2(C1)C(=O)NC=N2,0.2228
CC(C)C1(CC1C)C=O,0.2289
CCCC12COCC1O2,0.3342
CCC1C2OC2CC1C,0.3308
CC1(OCC=C1)C1CN1,0.2481
CC12NC1(CO)C1OC21,0.313
C1COCCOCC1=O,0.2052
C1C(CC(=O)C1=O)O,0.1462
N=C1C=CC(=O)NN=N1,0.1678
C(CC(=O)C(=N)N)C=O,0.1799
CC1(O)CC2CCC12C,0.3168
CC1C2CC(OC12)C#N,0.2786
CC1NC11C(C)CC1=O,0.2129
CC1CC(C#C)C1(C)C,0.3011
O=CC1C2CC(C#N)C12,0.2192
O=C1NC2C3CC2(C3)N1,0.2964
C1CC1C1CN1C1CC1,0.3169
COC1CC=C2COC12,0.242
CCc1cnon1,0.2583
CC1(CC2CC2N1)C#N,0.2687
CN1CC(C#C)C1C=O,0.1975
N#CC12CC1CCC2,0.3106
CCC12C3CN1CC23C,0.3045
COC(C)C#C,0.2933
COC(=O)C12CN1CC2,0.2395
C1C2C1C1C2C11COC1,0.2813
CCOc1cc([nH]c1)O,0.2435
CC1C=CC(=O)C2CN12,0.1796
CCCC12CC1(C)OC2,0.3028
CCC(=NO)COC=O,0.2497
COc1cc(ccn1)F,0.2204
C(C=O)N(CC#N)C=O,0.2138
C1C2C3CC22OCOC132,0.3241
Cc1c(c(c[nH]1)C#C)N,0.2011
Cc1coc2c1cc[nH]2,0.2242
C1CCC(=CC1)C(=O)N,0.2211
c1[nH]c2c(n1)onn2,0.195
CC12COC1CC1NC21,0.3044
C1NC11C=CC2OC12,0.2374
CC1CCOC1C=O,0.2102
O=CN1CC2CCN=C12,0.2245
CC1CC(C=C1)C#N,0.2629
N#CC12CN1C1CCC21,0.2437
O=CC1C2OC3CN1C23,0.1931
CC1=NC2CC(O)C2O1,0.2644
CC1C2N=C(N)OC12C,0.2679
NC1=NCC(=N)OC1,0.2533
CCC1(C)C2CC1C2=O,0.2521
C1C(CO1)CCCO,0.3177
N=COC1CNC(=O)O1,0.2806
CC(C)(O)C1CN1C=O,0.2597
CC1C(C=O)C1C#C,0.2198
c1c(c(nc(n1)F)O)O,0.2009
Cc1cocc1NC,0.2244
CCC(=O)C1(CCC1)O,0.229
CC1CN(C2CC2)C1=O,0.27
O=C1CC2(O1)C1COC21,0.2526
N#CC12CC1C1CC2O1,0.288
OC(C#N)C1CCCC1,0.3089
C1C2CC=CCC=CC12,0.2478
CC1CC23OC(C12)C3=O,0.2459
c1c(cnc(n1)O)F,0.1991
O=CC12CC1C1(CN1)C2,0.2245
CC12OC=NC1C2C#N,0.2557
CC12OC1CC2(C)C=O,0.2206
CC12NC1CC2OC=N,0.2591
CC(=N)OCC#C,0.2923
CC1C(C)C1C#C,0.2879
O=C1CC2CC1OC2=O,0.2158
OC1CC11C(O)C2CN12,0.2835
CCOC(=N)C(=N)OC,0.2344
CC12OC1C1OC2C1O,0.29
CCCC1C2OC1C=C2,0.2364
CC(=NO)C(=NO)C,0.1952
CC1=NC(=N)N=C(O)N1,0.2052
c1c(cnc(n1)C=O)F,0.1796
CC12CC3C(COC1)C23,0.3234
CCC1(CCO1)C(C)C,0.3075
N=C1OC2(CC12)C#N,0.2597
CCC1(O)CC2(C)CC12,0.3085
CC(C)Oc1ccc[nH]1,0.2445
CC1=CC=CCCC1O,0.1908
C#CCC(=O)CC1CC1,0.2217
CC1CC2C1OC2=N,0.2851
COC(C)C1CCC1C,0.3251
CC(C=O)N(C)CC#N,0.2055
CC1=CCC2CCC12C,0.2585
OC1CC2NCC12C#N,0.2695
CC1(CO1)C1=NCCN1,0.2364
C1C=C2CN=C3NC1C23,0.2036
COCC1OCOC1=O,0.2642
Cc1ccc2n1C=CC2,0.191
C1COC1=NCC#N,0.2772
C#CC1(CCCC1)O,0.3
C1OC1C1C2CCOC12,0.3072
CC1=C2C3CC3N2C=N1,0.2259
C1CC=CC(=O)CC=C1,0.2153
CC(O)(CO)C(N)=O,0.273
C1C2C3C4C=CC13N24,0.2115
c1c(nc[nH]1)C#CC#N,0.1899
CN1C2C3CC3(O)C12C,0.2971
C1CC12CC(=O)C(=N2)N,0.171
CCNC1(CC1)C#N,0.2672
OC12COC1C1NC1C2,0.2947
c1c2n(nn1)CCN2,0.2306
Cc1c([nH]nc1N)CO,0.2284
COC(=O)C(=N)NC=N,0.2006
CC(C)Oc1c[nH]cn1,0.2262
CCOc1[nH]cc(n1)N,0.2331
CC1C(CO)C1(C)O,0.3125
COC12CC1C(C2)=NO,0.2461
N#CC12COC(O1)C=C2,0.2453
OCC1CC=CC=CC1,0.1906
C(C#CC(=O)CO)C#N,0.2076
C1CC1C1CCC2CC12,0.3413
CC12CC3C4C(C14)N23,0.3069
CC1OC2C(O)CC2=C1,0.2321
CC1C=CC(O)C2CN12,0.2362
CN1CC2(C1)OC2C#N,0.2237
CNC(=O)CCO,0.2795
CCC(=O)C1CC(=O)N1,0.2226
OCC(CC#N)OC=O,0.2842
CCC12CC1CCC2=O,0.2251
COCCC(O)C1CN1,0.3172
CCCC1CCC(O)C1,0.3197
CC1C2C3C(C)C3(C)N12,0.3079
c1coc(c1O)N2CC2,0.2146
CC1=CNN=NC1=N,0.1699
CC(C)CC1(CC1)C#C,0.2947
C1C2CCC3C4CC23C14,0.3077
OC1C=CC2C1N2C=O,0.2299
CCOC(=O)NC(=N)C,0.2547
COC1C(C)CCC1O,0.309
CC1CCC1OC1CC1,0.3259
CC1CC(C)(CO1)C#C,0.2945
CC1NC1(CCO)C#N,0.2842
CC1=CC2CC2C1CO,0.244
C#CC#CC#CC=O,0.1553
CC(CC1(C)CC1)C#N,0.3182
CC1OC2CC2(C)O1,0.3331
CC1=CNC(=O)C(O)C1,0.2096
NC(=O)OC1CCC=C1,0.2651
Cc1cc(=O)nccn1,0.159
ON=C1C2NC2C1O,0.2345
Cn1ccc2c1OCC2,0.2256
CC1(CCCCCC1)O,0.317
CN=c1ccocc1,0.1891
CN=C1CCC(=O)O1,0.2533
OC12COC3C1OC23,0.2984
CC12OC1C1NC2C1=O,0.246
CCC(C)OC(N)=O,0.3241
C1=C2C3C4C2C2C1C2N34,0.1898
CC#CC(C)(C)OC=O,0.2718
CCN(C=N)C(=O)C#C,0.201
CCC1C2OC1C2C=O,0.2037
c1ccc2c(c1)CCC2,0.2309
CCCc1cc(n[nH]1)O,0.2441
CN1C2C(C#C)C1C2=O,0.2436
CNC(=N)C(OC)C#N,0.2329
CC(O)C1(C)CC1C=O,0.2241
c1c(ncnc1F)O,0.2406
O=CC1NC23CN(C2)C13,0.1882
OC1C(=O)C2OC2C1=O,0.2035
O=C1NC2CC=CC12,0.2425
CC12C3CC=CC1OC23,0.2241
OCC(O)C1=NC=CO1,0.24
CC(NC(C)=O)C#C,0.2707
CC(=O)NC(C)(C)C=O,0.2116
CNC(C#N)C(C)C#N,0.2743
CC1(CO)N2CC2C1=O,0.2148
CC(C)(C)C(=O)NC=O,0.2173
OCC12CC1OC2C#C,0.2596
CC(C)Oc1conn1,0.1999
C1NC11COC2CCC12,0.3029
C#Cc1cocnc1=O,0.1949
CC12CN3CC1(CO)C23,0.2857
CC12CC1(CO)OC2=O,0.2749
Cc1cccnc1O,0.2125
C(CNC=O)C(F)(F)F,0.2809
CC(CC#N)C1(C)CO1,0.3106
CC12COC3C1C2C3O,0.3066
c1cc2c(nc1)nco2,0.2069
CC(=O)C(=O)C1CO1,0.1661
OC1C2C3CC1C23C#C,0.2628
OC1(C=O)C2C3OC2C13,0.1973
COC1CCC(O1)C#C,0.2954
O=CC1CC(=O)C2NC12,0.2027
O=C1C2C3CN2CC1O3,0.1839
CC1C2OCC3(CN3)C12,0.3067
CC#CC1(C)CC(=O)N1,0.2729
CC1COC1CC=O,0.2235
CC(C)CCCOC=O,0.2863
OCC1C2C3NC2C13O,0.3042
CC1CC1(CO)N1CC1,0.312
OC1C(NC1C=O)C=O,0.1989
CCC1(CO1)C1COC1,0.3129
CC1CC(=O)CC1(C)O,0.2229
CC1C2C1C(=O)N2C=O,0.2235
CCc1cnoc1NC,0.2181
C1OC2C3OC4CC12C34,0.2946
CCNc1nc([nH]n1)N,0.2346
CC(C)C1CC1(O)C#C,0.2738
CC1(C)NC1(C)CC#C,0.2838
CCN1C(C)COC1=O,0.2988
CC1C=C(C)CC1CO,0.2566
c1c2c([nH]c1O)CCC2,0.2347
CC1C(O)C2C(C=O)N12,0.2171
NC(=O)C12OC1CC2=O,0.2056
CC(=O)Nc1cc[nH]n1,0.2281
CC(O)C1(CC=O)CN1,0.2194
CC(CN)(OC=N)C#N,0.2602
N=C1ON=NNC1=O,0.2081
CCN1C2CCC12C=O,0.2181
Cc1cnc2n1nn[nH]2,0.1885
CC12CN1C1(CC1)C2O,0.2982
OC1C23CCC12C=CC3,0.2298
CC(C#N)C(=O)C1CN1,0.2242
O=C1CC2CCC12C#C,0.2096
C#CC#N,0.2559
C1CC1n2nnnn2,0.2591
CCc1cc(c(o1)C)N,0.2128
CN1CCCNC1=O,0.2857
O=CC1(CO1)C#CC#N,0.2028
N=C1OC2C1CNC2=O,0.2491
CC(C#N)C1=CN=NN1,0.2557
COC1CC(=O)CC1=O,0.1925
Cc1conc1O,0.2547
CC1OC(C(C)=O)C1=O,0.2003
CC12C3CC11CCC2C31,0.3473
CCC1C2CCC12O,0.324
CN1C2CC3OC2CC13,0.2968
Cc1c[nH]c2c1CCC2,0.2387
CC1(CO1)C1(CC1)C#C,0.2909
CC1(CO1)C(O)C1CC1,0.3421
CC(=O)OC12CC1CC2,0.2683
O=CC(=O)C12CC1CO2,0.1495
CC1C(C#N)C11CCC1,0.3028
CC(=N)OCCC(C)=O,0.2339
CCc1n[nH]c(=O)n1C,0.241
CC1(C)NC(=O)OC1=N,0.2727
CC1CCC(O)(CO)C1,0.3188
O=C1CCC1C#N,0.2223
CC1NC1C1NCC1=O,0.214
CCN1CC1C#C,0.2634
CC(C)C1(C)COC=N1,0.2708
OCC1COCC2CC12,0.3152
CNC1=NCC(C)C1=O,0.1757
C1C2C3N4CCC13C24,0.3001
C1C2CCC3CC=CC123,0.2425
CC12CC(C1)C1OC1C2,0.345
COC1CCC1=O,0.2009
C1OC1C1=NC=NC=C1,0.2108
CC(O)C1(CO1)C1CO1,0.338
C#CCC1CC1C#N,0.2912
N=COC1(CCC1)C#N,0.2784
O=C1C2OC3C2C=CC13,0.1918
CC1CC11C2CCC1O2,0.3212
C1OC11C=CCN2CC12,0.2321
O=C1CC2(CO2)C(=O)N1,0.234
CC1(OCC1C#N)C=O,0.2143
CC(O)(C#N)C1CN1,0.265
CC1CC2NC2C2NC12,0.2925
CC12NC1C1(O)CC2C1,0.2966
C1OC23COC(C2)OC13,0.3069
CC(C#C)C12CCC1O2,0.2993
CC12OC1CC2N1CC1,0.297
CC1OC(=O)NC1(C)C,0.3114
OC1CC(=O)C(C=O)=C1,0.1592
N#CC12CC1C1CCC21,0.2698
OC1=NOC=C1OC=N,0.2353
c1c2c(c(co2)N)on1,0.1879
Cc1cn(cc1CO)C,0.2455
Cc1cc(oc1N)C,0.2291
CN=C1OC(N)=NC=N1,0.1856
CCC([NH+](C)C)C([O-])=O,0.2631
CC1(O)C2COC1C2=O,0.2085
CCC12OC3C1NC23C,0.2983
CCC1=CCC(C)C1,0.2579
CCCC(=NO)CC#C,0.2588
OC1=NOC(=N)C(O)=N1,0.1678
CC1(CC#N)OC1C=O,0.2172
CCC1=NCCO1,0.2697
OCC1CCC1OC=N,0.282
CC1(O)C2CC1C(=N)O2,0.2761
C#Cc1c(cncn1)N,0.1682
CC(COC(C)=N)C#C,0.2927
O=C1OC2CC3COC123,0.252
O=C1NCC2C3OC3C12,0.2658
OCC1CCC1(O)C#N,0.2864
O=C(C#C)C1CCCO1,0.1892
C1OC2CC3OC12C=C3,0.246
OC1C(C=O)C11CCC1,0.2213
OC1C2C3COC3C12O,0.2886
CC1OC2CC1C1OC21,0.3292
NC1CN=C(N)NC1=O,0.2264
CC1OC1CCCC=O,0.2286
N#CC12CC1C=CC2,0.2497
CC12CCCN1CC2=O,0.205
CC1C2C3CN3C12C,0.2846
N#CC12CCC1OC=N2,0.2623
CCCC(CO)C#C,0.3047
OC12CC3C(C13)C2C#N,0.2829
CC1(OC11CCC1)C=O,0.2173
CC(C)COCC1CC1,0.3363
CC12CC1(CCO)OC2,0.3053
CCC1CC=CCC=C1,0.2552
CC1(CC1)CC#CC#C,0.2303
Cc1cc(n(c1)C=O)O,0.162
CC(O)(C#C)C#CC#C,0.2218
OCC1NCC1(O)C=O,0.2001
CC(=N)N(C)C=O,0.2361
C1C2NC1C1=NNN=C21,0.226
OC1(C#N)C2C3NC2C13,0.2551
C1COCCC1(C#N)N,0.288
CC12C(CO)N3C1CC23,0.3114
Cc1c(c(c[nH]1)C#N)N,0.197
C#CCC1CN1CC#N,0.2691
CC1=NC2CCN=C2N1,0.232
O=CN1C2CC1(C2)C=O,0.189
FC1=C(F)C(=N)ON=N1,0.1616
COC1(C)OCC2CC12,0.3383
[NH3+]CC(CC#N)C([O-])=O,0.2763
C#CC1(CCCC1)C#C,0.2886
N#CC1CC11CCC1,0.3071
C#CC12COC3CN1C23,0.2667
CCC(O)CC#CCO,0.2803
CNC1(CC1)C(=O)OC,0.237
CC(COC=O)C#N,0.2863
CCC1(C)OC1(C)C=O,0.2148
Cc1c(ccc(n1)F)N,0.1891
CCCC1CC=CC1O,0.262
c1c(nn[nH]1)N,0.217
OC1(COC=N)CC1,0.2419
c1cc(cc(c1)F)O,0.223
CCNc1cn[nH]n1,0.2134
CC(=O)n1c(=O)[nH]cn1,0.2157
CC1CCC2CCC2=C1,0.2547
C#CC12CC3CC(C1)C23,0.2861
OC(C1CO1)C(F)(F)F,0.3601
CC1(CC(N1)C#N)C=O,0.2106
CC1[NH2+]C2[C-](C=O)C12O,0.1667
CC1=C([N-]N=N1)C(N)=[NH2+],0.1814
CC1CC2NC2C(O)C1,0.3113
CC1(C)NC1C#CC#C,0.2158
Cc1cc([nH]c1)CCO,0.2419
c1c(=O)oc(c(n1)F)F,0.1533
C1C2(CO1)COC2,0.3064
OC1CCC2COCC12,0.298
CC(=Nc1cnno1)N,0.1821
COC=NC(CN)C#N,0.2456
CC1(CCC1CO)C#C,0.3027
CC12C3C4C1CC2N34,0.3049
CC#CC1(CO1)C(C)O,0.2742
CC1(C=O)C2COCC12,0.2295
CCC1C2CCC1C2C,0.3671
CC1(C(=O)NCCN1)C,0.2604
CCOC(=O)C1OC1C,0.2649
CC#CCCOC(C)C,0.3044
C(C(=O)NC=N)O,0.2296
CC1C2N1C(C)C2=NO,0.2278
CC1=NC(C(=O)O1)(C)C,0.2475
CCC1CCOC1CO,0.3313
CC(COCC#C)C#C,0.288
CC1=NC=CC(=N)N=C1,0.1526
N#CCC12NC1C1CC21,0.2472
CCC(CC#C)OC=O,0.282
CN(C)C(C=O)C1CN1,0.1931
OC1CC11C2OC1C2=O,0.2463
OC1CCCC=C1C#C,0.2123
CCCC12CC3OC1C23,0.3032
OC1CC2(O)COC1C2,0.2986
CC1OC11CC2NC2C1,0.3124
CCC(O)(CC)C1CO1,0.3096
C1CC2=C(C1)COC2,0.2498
CCC1(C)CC1C(N)=O,0.2709
CC1C2N3CC2(C)C13C,0.3105
CNC1C2OC(=O)C12O,0.2182
CC1(O)C(OC1=N)C#N,0.2772
OC1C2CC3C2OC13,0.2993
CN1C2C3C1C(=O)C23C,0.2152
N#CC1NCC2CC12,0.2726
N=C1OC2CC(=O)C2O1,0.193
CC1=C(C)CC(C1)C#C,0.2537
O=CC1CC=CC2NC12,0.2147
CC1(C)OC1C#C,0.2794
OC12CCC1C21CCC1,0.3062
OC1CC1COCC=O,0.229
CC1OC2CC12C,0.3101
O=CC1=CCN2CCC12,0.1625
c1c(n2c(n1)CC2)O,0.2422
CC1=CC2(CN2C1)C#N,0.232
CC1COC(C)C(C)C1,0.3159
OC1(C#N)C2CNC12,0.2621
COC(C)C1CC(=N)O1,0.2882
CCOC(CO)C(N)=O,0.2562
NC1=CC(CC1O)=NO,0.188
CC12CC3C1N2C3(C)C,0.3199
OCC1(O)CC1(O)CO,0.2973
C1CC1CCC(=O)CO,0.2402
C#CCC12CC(O1)C=C2,0.2353
C#CC1(CC(=O)O1)C#C,0.2556
CC1OCC2(C)NC12,0.3092
CC(C=O)(N=CN)C#N,0.2103
Cc1c([nH]nc1C#N)C,0.2292
Cc1cnoc1CC#N,0.2388
C1CC1N(C=N)C=O,0.2177
CC1(C)OC1C1CC1,0.3406
CC(C=O)C1(CO)CC1,0.2229
CCC1OCC(O)C1=O,0.2172
CC1(O)C2C=CCC12O,0.2322
COCC12CN1CC=C2,0.2337
C1CC2COC3C1C23,0.3132
NC(CC#N)CN1CC1,0.2844
CCC1NC1(C)COC,0.3137
c1c(c(cnc1O)O)O,0.1977
C#CC1CC2OC1C=C2,0.2536
C1CC(=O)C(=CC1=O)N,0.1578
OC12C3CC1C1(CO1)C23,0.3101
CC1C2CC1(C#N)C2=O,0.2494
CC1C=CC(O)CC1O,0.2583
c1c(nc2n1CC2)N,0.216
CN1CC11CC2C(O)C12,0.3032
OCCC1CN1C1CC1,0.2877
NC1=NC2=C(ON=N2)O1,0.1337
CC1(CO)CC2CC1C2,0.3373
C#CCCc1ncno1,0.2446
CCC1(CC1O)C=O,0.2299
CC1=C2CN3C2C3C1=O,0.1466
CC1(C=O)C=CC2OC12,0.2209
CCC1OC11CN2CC12,0.3124
O=CCC1OC2CC1C2,0.2247
OC(C#N)C(F)(F)F,0.3222
O1C2C1C1C3C=CC1C23,0.2263
O=CC1NC2CC12C#C,0.1933
C1C2OCC3=C2N1N=C3,0.1936
CC1C2C=CC1C1CC21,0.2479
NC1C2OC=NC12C#C,0.227
CC(O)C(O)C(C)C#C,0.2943
CC(O)CC(C)NC=O,0.2594
c1c2cnoc2ncn1,0.2001
CC12OC3C1NC23C=O,0.1985
CC1NC(C#N)C1=O,0.2194
CC1(COCC#N)CN1,0.2682
OC1CN=C2OCC=C12,0.2019
CNCC(=O)OC(C)=N,0.2203
CCC(CO)OC,0.3234
CC12OC3C4C1CN4C23,0.2903
OCC#CC(CO)C=O,0.2182
CC1(CN1)C(=O)CO,0.2278
OCC1C2OC2C11CO1,0.3126
CC12C3C1C1CCC3N21,0.3046
COC1CC(C)CC=C1,0.262
CCc1cc(c([nH]1)C)O,0.2197
CN1CCC(=O)C1C#C,0.2035
CC12CC1C1C(O)C21O,0.2728
C#CCCCC(=O)C=O,0.1565
OC1C2C3C1C(C#C)N23,0.2592
CN=C1CC(O)CCO1,0.2648
CCCC1(CC1)CC=O,0.2242
N=C1NN=CN=C1C=O,0.1303
CCOCC(=O)C(=N)N,0.1955
CCC1N2C3CC1(C)C23,0.3148
CC1(CCCC=C1)C#C,0.2586
CC(=NO)C1(CO)CN1,0.2377
O1C2C3C4C3C2C14,0.328
N=C1OC2CCC2O1,0.3089
C1CC2OCC1C1OC21,0.3268
CC1=NNN=C1OC=N,0.2279
c1c(ncoc1=O)CO,0.1987
CC1C(C)C(=O)C1O,0.2232
OC1CC=CC1C1CC1,0.263
CC12CC3C1C1OC1C23,0.3265
COC(C)C(O)C1CO1,0.3263
CC1CC(CO1)C(C)=O,0.2318
CCCC(O)C1CC1O,0.3133
COC(C=O)C1NC1C,0.2154
CC(=O)c1ccccc1,0.1931
OC(CC#C)C1CCO1,0.2933
COC(=O)C(=O)C1CN1,0.1796
CCC1(O)CC1(C)C,0.3189
CC1C=CC2(O)C(O)C12,0.2293
OC1CC(C1)(C=O)C#C,0.2212
c1c(=O)c(coc1N)O,0.205
CC(O)C#CC(C)(C)O,0.2902
N#CC12CCC1OCO2,0.288
CC12CC(CC=O)C1N2,0.2268
CCC(=O)C(=O)CO,0.1577
OC12CC(C1)C=C2C#C,0.1901
CC12COCC1O2,0.3454
O=C1CCC(C#C)C1=O,0.1417
N#CC1CC1C1CC1,0.3013
CN1C2C3C4C2C1C34C,0.3014
CN1CC1(CO)C(C)=O,0.2095
c1c(c2c([nH]1)nc[nH]2)N,0.2021
CC1NCC1(CO)C#N,0.267
CNC(=O)c1conn1,0.2075
c1c2c([nH]n1)NCCN2,0.2248
CC1=NC2C3CC(O1)C23,0.2562
O=C1NC2C=CCC12,0.2471
COC1C(CO)NC1=N,0.261
CC(=O)C1CC(N1)C#N,0.2186
CC1CC2=C(OC=C2)O1,0.2211
C1CC23N=CN4C(C24)C13,0.2281
CC#CC(O)CC1CC1,0.287
CC1NC1C1(O)COC1,0.3025
c1nc(no1)NCC#N,0.2292
C1C(CNC(=O)N1)CO,0.2925
CN1C2C1C1=CCOC21,0.2201
Cc1[nH]c2ncnn2n1,0.242
COC1CN2CC2C1=O,0.1987
CCC#CC#CCC#N,0.2218
O=CNC1=NCCN1,0.2012
CC1CC2N(C)CC12O,0.2801
CC(C)C1C2CC2C1C,0.3307
CC1CN(C=O)C=C1,0.2085
O=CC(=O)C12CCC1N2,0.1585
C1CC2OC3CC1C2O3,0.3278
CC1CC1(C)OCC=O,0.2271
COC1(C)COC(=N)C1,0.286
CC12CC1CNC(=O)O2,0.3014
CC1(CC2CCO2)CO1,0.3247
CCC12CC1(O)CC=C2,0.2458
O=CCC1OCC11CC1,0.2222
CC(C)C1OC(C)C=C1,0.2457
C1C2OCC3OCC12O3,0.3173
CC1CC1C1=NNN=N1,0.2353
CC(C)(C#N)OC1CC1,0.2862
O=C1C2CC3CC2C13,0.2288
N=C1OCC1C=O,0.227
CC(O)C1(C)CN1C=O,0.2494
CC(CO)C#CC1CN1,0.2682
CC1C2C3C1C2C31CO1,0.3476
COC1(CC1)CO,0.3321
CC12CC3CC1CC23O,0.3267
CC1OC2C3C2N(C)C13,0.2705
COC1C2C(O)C1C2=O,0.2298
N=COC1OCCC1=O,0.2157
C#CC#CC1C2CC1O2,0.2183
CC#CC(=O)C(=O)NC,0.1633
Cc1c(nccn1)O,0.2003
NC1=C(OC=N)ON=N1,0.1764
CNC(C#C)C(=O)C#N,0.1567
CCc1coc(n1)OC,0.2455
O=C1COC(CC#N)C1,0.2201
CC12CC1C(O)C(=O)O2,0.263
CC(C)Cc1c[nH]cn1,0.2506
c1cnc(nc1N)C#N,0.1942
C1CC2OC1CCCO2,0.3259
OCC(=O)C1(CN1)C#N,0.2251
C#CC(CO)(C#C)O,0.2724
OC1CC2CC(O2)C1O,0.312
CCc1c(c[nH]c1N)C,0.2422
COC1C2CC1C2C=O,0.2156
C1C2OC3CC(CO3)C12,0.3161
C#CC1OC2CCC2O1,0.2895
OCC1=CC(OC1)C=O,0.2036
C1OC23C1C1C2CCC31,0.3034
C1CN1CCCO,0.3102
COCC(=N[O-])C1C[NH2+]1,0.1193
C1C2CN3CC4C3C1N24,0.2754
OC1CC2CC1(O)C=C2,0.2466
COC=NC(C#C)C#C,0.261
C#CCN=COCC#C,0.269
O=CC1CCC(O1)C=O,0.206
CC1(O)CC2C(O)C2C1,0.3112
COC12CC1OC=NC2,0.2588
CC1(C)C2COC1C=C2,0.2448
CC1(CCC2CN12)C#N,0.2884
OC1CCN=COC1=O,0.2368
CC(O)C1=COC=N1,0.246
CC(C)(C(F)(F)F)NC,0.3049
C#CC1(COC1)NC=O,0.2638
c1c(cc(cc1O)F)O,0.2307
CC12CCOC1OCC2,0.323
OCC1NC(=O)C2NC12,0.2547
CC12CC(C1)N2CC#N,0.267
CC1C2C1C1CCC2C1,0.339
CC1=CNC(=O)C11CO1,0.19
O=CC1CC(CC#C)C1,0.2226
c1c(c(ncn1)N)C#N,0.1931
C1CC2=C(C1)COCC2,0.2536
CN1CC(O)(CO)C1=O,0.2605
CCC(=O)C(=O)N1CC1,0.1734
C1C2COCOC12,0.3142
CCC12CC1CC2(C)O,0.3086
COCC1(CC1)NC=O,0.2735
O=C1CC2OCCCC12,0.2238
CCC1CC(=O)C(=O)N1,0.1723
O=C1OCC2C3CC2C13,0.2656
CC1CCCC(=O)NC1,0.2699
CC1C2CC1(O2)C1CC1,0.3113
CC1N2CC(C2)NC1=O,0.2357
c1c(nc(c(=O)[nH]1)N)O,0.1548
OC1CNC(=O)C1C=O,0.2125
CC1C(O)C1(C)C1CN1,0.2969
COC(C)C1CC1C#N,0.2937
CCCC(=O)C(=O)C#C,0.1503
CN(C)C12CC(C1)C2=O,0.2133
Cn1ccc(n1)O,0.2412
CC1CC2C1C1CC21C,0.3151
CC12NC(C1O)C21CO1,0.3215
OC1C2CC2C2CC12O,0.3053
O1C=CC2=C1ON=N2,0.1395
OCCC12OC3C1CC23,0.307
COCC(O)C(=O)CO,0.2302
CCCC1CC1(O)C#C,0.2748
CC1(CN1)C1CN1C=O,0.2551
CC12C3C1C1(O)C3OC21,0.3009
N#CCC1C2CCN12,0.2786
CCN=c1[nH]cc(o1)N,0.2235
CN1CC1C1=NC=NN1,0.2323
C1OC11C2CC1COC2,0.3224
C1C2(N1)CN(C2)CC#N,0.2563
O=C1OC2C3C4C3N1C24,0.2651
CNc1connc1=O,0.1425
OC1C(=O)C(O)C11CO1,0.1936
CC12CC1CN1CC21,0.3002
CC#CC1CC(O1)C=O,0.213
C1C2OC2C2=C1ON=C2,0.2308
CC1(O)CC(C1)C(N)=O,0.2732
OCC12CC1(CO)CC2,0.3214
CC1(C#C)C(N)C1C#N,0.241
CC1CN=C(N)C(=O)N1,0.2011
CC1(C#C)C2C3CN3C12,0.2556
COC1C(O)CC1(C)O,0.316
C1C2OC3(C12)C1COC31,0.279
NC(=O)C1(O)CC=CC1,0.2552
C1C2C=CC3C4CC23N14,0.187
N=C1OC23CCC2OC13,0.2525
CCCC#CC(C)C#C,0.2878
CC12OC(=N)C3C1NC23,0.2576
c1c2c(c([nH]1)N)COC2,0.2408
OC1C2OC1C(C=O)=C2,0.1825
CC1C(=O)C(C)C1(C)O,0.2184
CC(=O)CC1OC1C#N,0.2358
CC12CN1C(CC2)C#N,0.2801
CCC1(CC)CC2OC12,0.3243
CC12C3CC1OC2CC3,0.3131
C1C=C(COCO1)C#N,0.2211
O1C2C3C4C5C2C1C5N34,0.2823
OC1C(NC1=N)C#C,0.2685
CN1C2C3(C)CC2(O)C13,0.2785
OC12CC3COC(C1)C23,0.3044
CC(C)OCC(O)CO,0.329
N#CC1NC2CC3C2C13,0.2781
CC(=O)C1N=CN2CC12,0.2182
O=C1C2COC1CN2,0.1931
OC1C(C#N)C11COC1,0.2755
COCC1C2OC1C2=O,0.247
C#CCNc1cocn1,0.2154
CC1(C)NC1CCC#N,0.2954
CC12OC3(C#C)C1OC23,0.2515
O=C1OC2C1C21CCO1,0.2518
CCn1cc([nH]c1=O)O,0.2292
CC1(O)CNC=C1C=O,0.1771
c1c([nH]cn1)CCC#N,0.2442
N#CCC1NCC2NC12,0.2663
CC(=N)OC1=CNC=C1,0.2486
OC12CC3C1C1(CN1)C23,0.3105
CCC1OCC(C)=C1C,0.2479
N=C1OC2CC1C2C#C,0.2645
C1OC2CC1CCO2,0.3284
CCC(O)CC(O)CC,0.3105
CC1CC=CCC(=O)O1,0.2419
CC1C2CC1(O2)C1CN1,0.3006
CCc1c(oc(=O)o1)C,0.2491
Cc1cnc(c(=O)o1)F,0.1725
COC1COC1=N,0.2705
CC12CC3C1N3CC=C2,0.2507
OC1(C#C)C2OC=NC12,0.2397
CC(CC#N)(CC#N)N,0.2681
C1OC2C3OC3C3C1C23,0.2932
CC1C(=O)CC=CC1=O,0.1818
N=C1NC=CN=C1C#N,0.1349
CCC1(CC1(C)C)C=O,0.2274
CC1(C#N)C2OC1C=C2,0.2338
C1OC23COC12C1NC31,0.2702
CCCCC#CC#C,0.2315
CC1(CC(C1)=NO)C=O,0.2248
CC1N=C(N)OCC1O,0.2735
CNC12CC(C1)OC2=N,0.254
CN(C=O)C1CNC1=O,0.2596
OCCC1(O)CC(O)C1,0.3006
CC1C=CCC1=O,0.2226
C#Cc1nc([nH]n1)N,0.2164
N=C1OC2OC1C1CC21,0.2848
C1C=CC2C3OC2C13,0.2399
Cc1c(nn(n1)C)N,0.2188
N=C1NN=C2OCCN12,0.2437
C1C2OC3C=CCC2C13,0.2405
O=C1NC=C2CC=CC12,0.2073
CC(O)C12CCC1C2C,0.3144
CC1CC(CC=C1)=NO,0.2533
C(C#CC1CN1)C1CO1,0.2661
Cc1ccc(n1C)C#N,0.2026
OC(CCN1CC1)C#C,0.2656
C1CC2=CCC3OC3C12,0.2544
CC1CC2CC2C=C1C,0.2459
CCC1C=C(C)CC1=O,0.2199
C#CC1C2C3CC1N23,0.2866
C1CN=C(NC=N1)C=O,0.1699
CC12CC3CC(O)(C1)C23,0.321
CC1=CC2CC1NC2=O,0.2181
CC#CCC1(CN1)C=O,0.2209
CC1(CN1)C1=CNC=C1,0.2466
CC12CC1(NC=N2)C#C,0.2375
CCC1(C)CC2(CO2)C1,0.3321
O=C1OC2CNC12,0.2426
OCC(O)CCC1CO1,0.3194
N=C1OC2CC2C11CC1,0.2674
CC(C)C1(CO1)C=O,0.2202
CCCN=COCC=O,0.2188
OC12C3OC3C3C1CC23,0.3123
CC1C2OC1C1(C)NC21,0.3082
CC1CC2NC2(C1)C#N,0.2767
CC#CC(C=O)C=O,0.1869
CCNc1c(non1)N,0.2125
CN1CC(OC1=O)C#C,0.2647
C1CC2(O1)C1C3OC2C13,0.2938
C1C2OC2C2=C1C=CO2,0.2205
CC1CC1(CO)C1CN1,0.3271
CC1C2C3N2CC13C=O,0.2086
CCC1=CC2CC3C2C13,0.235
CCC(=NO)C(C)(C)O,0.255
OCC12CC3C1N3CC2,0.3031
CCC1CN2C(CO)C12,0.3014
O=C1NC=C2CC3C2N13,0.1892
CC(C=O)C(C)C=O,0.2154
CCC(C)C1(CN1)C#N,0.2943
OCC1NC1(CO)C#N,0.2818
CC(C)(C1CCCC1)O,0.3249
CC1CC(O)CC11CC1,0.3309
CCc1ccc(cc1)O,0.2134
CC12CC3C(C13)C2O,0.3269
CC1OC(=N)C=CC=C1,0.172
CC1=CCC(CC#N)C1,0.261
CC1CC(=O)C=CC=C1,0.1685
CC(=O)Cn1cncn1,0.2256
ON=C1CC(=O)C2NC12,0.2099
C1C2CCOC1C1NC21,0.3075
CCC1CC(C)OC=N1,0.2708
C1CC11C2CCC1OC2,0.3181
COCCC(=O)C(C)O,0.2333
CC1OC2CC(C2)C1=O,0.2222
OCC1(O)CNC1C=O,0.2085
C(C=O)N=c1onno1,0.1804
Cn1ccc(n1)C=O,0.2001
CCOCC1C2CN1C2,0.3179
CC1C2CC1C(=O)N2C,0.2582
CCC(O)C(C)(C)CC,0.3273
NC(=[NH2+])[C-]1NC=CC1=O,0.1581
NC1=NC(CC1O)C#C,0.2541
c1c(c[nH]c1C#N)O,0.1918
O=C1CC=CCC2OC12,0.2195
C1COc2c1c(no2)O,0.241
C1CC2N=COC12,0.2636
COC(=O)C1(CC1)C=O,0.226
OC1(COC(=N)C1)C#N,0.2671
CC(C)C(=N)NC(=O)N,0.2526
CC(C=O)C#CCC#N,0.2204
OC1C2CC(OC12)C#N,0.2675
O=C1NC2C(NC12)C#C,0.2434
OC1=CNC=C1OC=N,0.1865
C1CC1C12OC3CC1C23,0.3022
CC(=O)C12CC1C(=O)C2,0.2079
COC1CCC1CCO,0.3241
C1CC1CCC2(CC2)O,0.3284
CC1COCC(=O)CO1,0.2128
CC1=CC(=N)NC(F)=N1,0.1909
CC1(O)C2CC1C(O)C2,0.3009
CC#CC(=O)C1(C)CN1,0.1927
C#CC1OC2COC1C2,0.2784
c1c2n(cn1)C(=O)OC2,0.2178
CCC(O)C1CN1C,0.2953
C#CCN1CC2(C1)CO2,0.2614
CC1OCC(C)(O)C1O,0.2973
O=CC12COC3C(O1)C23,0.1815
CC1COCC1(C)C,0.3095
C#CC12CC3C(C1)OC23,0.2765
C#CC1C2OC1C2C#N,0.2736
CC(C#N)C1=NOC=N1,0.2701
CC1=CCCC1C1CO1,0.258
c1coc(=NC2CC2)[nH]1,0.2106
CC1C2CC(C)C1C2O,0.334
C(C#N)C(=O)OCC#N,0.2867
N#CCN1C2CCC12,0.2873
CC1(C)OC11CCOC1,0.3295
c1coc(=O)c(=O)[nH]1,0.1796
OC12C3C4N=C1NC2C34,0.1605
CCN1CC12CC(=O)C2,0.2111
CC1C2N3CC1CC23C,0.3207
O=CC1CC2N=COC12,0.2225
CC1(C=O)N2CC1(O)C2,0.2149
OC1COC2C(C#C)C12,0.2679
c1noc(=NC2CC2)o1,0.2171
N#CCCC1OC2CC12,0.2883
CCC(=O)C1CCC=C1,0.2144
CC1=CC=CCC(O)C1,0.1901
CC1(CC#N)CCOC1,0.2911
CC1N=C2C3C4C(C13)N24,0.1569
CC#CCCNC(=O)C,0.27
C1C2N=CNC=NC12,0.206
COCC1CC1(O)C#N,0.2755
CC1(CC(O1)C#C)C#N,0.268
c1c(c(on1)N)C#N,0.2242
Cc1c(cn[nH]1)OC=O,0.2367
C1OC2COC=NCC12,0.2579
CCC1OC1(CC)C#N,0.2993
O=C1C2CN3C2C13C#C,0.2248
CC1=C2CCC2CCC1,0.2489
OC1CC=CC1(O)C=O,0.2075
C1CN2CC3OC3C12,0.2974
OC1CCC2=NNC=C12,0.2519
CC1NC11CC2(C)OC12,0.3163
COC1(C)C2COCC12,0.3069
CC1(O)CC(C1)C#C,0.3
O=CNC1COC1C#N,0.2601
COC=NC(CO)C#C,0.2603
COC1C2COC1C=C2,0.2411
OCC(O)C1OC1C#C,0.2621
CC1C2C3CC=C1C23,0.18
O=C1NC=C2CCC2N1,0.2157
OC1C2CCOC12C#N,0.271
N#CC#CC12CC1CC2,0.2121
CCC1=CON=NC1=O,0.198
CNc1c(nccn1)O,0.1797
NC1=CC(=O)OC2CC12,0.2075
CNC(C#N)C(N)CO,0.2792
CC(C)C1N2CC1(O)C2,0.3089
CC1C2COC(C)(C)C12,0.3181
C#CCN1CC12COC2,0.2697
CCC(CO)CC#CC,0.2943
NC12COC1(C#N)C2O,0.2309
CC1NC11C(C)NC1=O,0.2679
C(=O)C=O,0.1555
CN=COc1nnon1,0.2052
C1C2CCCC3CC3C12,0.3222
CCCOC1CCC1O,0.3249
CC1OCCC1CC#N,0.2879
CCC1(C)CC(C)C=C1,0.2624
CCC1C=CCC1C,0.2611
C(c1[nH]c(c(n1)N)O)O,0.2219
OC1C2OC1(C=O)C2=O,0.2129
CC(C)(C(=O)NC=N)O,0.2185
Cc1ccc(o1)NC=O,0.1928
CC1CN2CC(=O)C12,0.2022
c1c(c(noc1=O)N)F,0.1687
CC1(OCC(=N)O1)C#C,0.2831
CC#Cc1cc[nH]c1C,0.2144
Cc1c(c(n[nH]1)C)C#N,0.2378
CCOC(C)(CO)CO,0.2991
CC(=O)C1=CNCCC1,0.1833
O=CC#CCC1CN1,0.1968
CC12OC1C(=O)C2O,0.1963
C1CC1CN(C=O)C=O,0.2152
CC1=CCC2CC1(C)O2,0.2419
CC(C)OCCOC,0.3311
CC1(C)OC1CC(N)=O,0.2704
CC1=NCCC2(O1)CC2,0.2677
CC12NC(C3NC13)C2O,0.282
CNc1c(ocn1)N,0.2019
C#CC(CCO)C#C,0.296
CN1C2CC1C21COC1,0.2898
ON=C1C2CC3CC2C13,0.2529
N=COC1=NOC(=N)O1,0.225
NC1=C(C=CO1)C1CO1,0.227
O=CC1C2CC1O2,0.2035
Cc1cc([nH]c1)C#C,0.1998
c1cn(cn1)C(=O)CO,0.1983
CC(C)CC1CC(C)O1,0.3284
CCC(C#N)C(=O)CC,0.2325
CCC12OC1CNC2=O,0.2518
COC(=O)C1(COC1)O,0.2449
CCC12CC3C(C1)N3C2,0.3079
CN=C1OC=NC=C1F,0.1777
OC1CC2C1CCC2O,0.3102
CC1=CC2CC11COC21,0.229
Cc1ccc(o1)CO,0.2266
CC1=C(CCCC1)C,0.2542
CC#CCCC#CC,0.2903
c1c([nH]c(n1)O)O,0.2479
CC1CC2(CC=CC2)O1,0.2668
COC1CC(O)C(=O)O1,0.2738
O=C1C=CNC2COC12,0.1797
NC1=NC2C3OC2C3O1,0.2631
Cn1nc2c(n1)COC2,0.2276
OC(C=O)C1OC2CC12,0.2051
OC1COC1C(=O)C#C,0.1713
CC(O)C1CN=C(C)O1,0.2722
ON=C1CC(O)C1C#C,0.2457
CC1=C(C)C2NC2C1,0.242
CN1C2C3NC(=O)C2C13,0.2263
CC1(O)CC=CC1(C)O,0.2542
CC12OC(C3CC13)C2O,0.3174
C#CC1C=CCC2NC12,0.2619
OC12CC(C1)C2NC=O,0.2782
CC#CCC1C(C)C1O,0.3025
C1CNC(=O)C(=NC1)N,0.1998
CC1CC2(O)CCC2O1,0.3095
C#CCC1CCCC1,0.3136
CC1C(O)C2OC2C1=O,0.2102
CNC1CN=COC1=O,0.2063
CC(CO)C(N)=O,0.2756
CNC1(COC1=N)C#C,0.2477
CC12CCC11CC2CO1,0.3015
c1c(n(nn1)C=O)C#N,0.1966
OCC12CN1CC2=O,0.2231
CCC1(COC1C)C=O,0.2197
CC12C(O)C1CC21CO1,0.3092
CN1C=NC(O)=NC1=N,0.1885
CCCC(C#N)C(C)=O,0.2319
COc1c(onn1)C=O,0.1716
Cc1c(c(n[nH]1)O)C=O,0.1864
Cc1c([nH]cnc1=O)C,0.2121
C1OC11C2C3C1CN23,0.3267
CC1(CCC1)CCC#C,0.3146
C(=O)(C(=N)N)C(F)(F)F,0.1796
OC12CC1NC2=O,0.2435
CC1C=CC(C)(O)C1=O,0.2123
CC#CC#CCNC=O,0.2191
OC12CN3C1C1CC1C23,0.3056
CC1CC23OC12CC=C3,0.2308
CCCC(C#N)(C#N)N,0.2685
CC1=NC2CCC2CO1,0.2664
OC1C2C3CCC1C23,0.3171
N#CCC1CC2(CO2)C1,0.299
OC(C=O)C1=CCOC1,0.1877
CC12CC3(CO3)CC1O2,0.3415
CC(O)C1C2OC1C=C2,0.2353
CC1C2CN2C1(C)C=O,0.2182
CNC(=NCC=O)OC,0.2144
C(CCO)CC#CC#N,0.2399
CC(C)C12CC(C1)OC2,0.3058
CC1C2CC3(OC3C)C12,0.3303
C(C#N)C(=N)NC(=O)N,0.2578
CCOC1CC2CC2C1,0.3269
CC1=CCC2(CO)NC12,0.2472
CC1(O)C2NC2CC1=O,0.2143
CC(NC1CC1)C#N,0.2595
N=COCC1(CO1)C#N,0.266
C1C2CC3=C(C=NN3)N12,0.2311
O=CC1OC2CCC1O2,0.2196
CCC(=NCC)NC=O,0.2307
COC12CN3CC1CC23,0.3063
CC1(O)C2C1C1CCC21,0.2958
CC1(OCCO1)CC#N,0.2982
CC(O)C1CCC1CO,0.3197
CC(C=O)C(O)C=O,0.2188
OCC1NC11CCC1=O,0.2143
OC1C2CC1C2CC=O,0.2274
CC12CN1CC(=O)C2,0.2048
CC#CC(C)C(C)(C)O,0.2945
C1CC(=NO)C(=C1)C=O,0.1663
O=CCC(C=O)C1CO1,0.2129
CCC(C#C)C(=N)OC,0.2801
CC(=O)C1NCC11CO1,0.2163
CCCC(O)C(=O)C#N,0.1915
OC1=CC=NC(=N)C=C1,0.1547
OC1CCCCN2CC12,0.2761
CC1=CC2(C)CC2C1,0.2439
C#CCCC#CC1CO1,0.2699
CC1OCC=C(C)C1=O,0.1805
CC(CC=O)C#CC=O,0.1969
OCC1OC2CC2O1,0.3002
COC1CC(=O)OC1C,0.2721
C1c2c(onn2)C(=O)O1,0.2058
CCC12CC3=CCN1C23,0.1647
CC1OC2CC1(C)C2,0.318
OC1C(NC1=N)C1CO1,0.2672
CC(CC#C)C(=O)C#N,0.1869
OCC12CC1C=CCC2,0.2459
CC1C2COC(O2)C1C,0.3251
CC(C)CCC1CC1C,0.3466
CC(C)C(C)C(C)C,0.3687
O=C1CCCC2OC12,0.2176
CC1OCC1CCC#N,0.2863
CC1OCOC1C#C,0.2867
CC1=CC(N)(CC1)C#N,0.2438
[O-]C(=O)C1=CC(=[NH2+])NC1,0.1051
CC1=CC2C3CC1C2O3,0.2406
CCC1C(CC#C)N1C,0.2694
CN1N=C(F)N=CC1=N,0.1376
CCc1c(noc1N)N,0.2344
CC1(CC2CO2)CCC1,0.3416
CC12CC1COC(=O)O2,0.307
NC1=CC(=O)C2NC2C1,0.1912
C(C(=N)NC(=O)C=O)O,0.1621
CN1C2C1C(O)C2O,0.2799
Cc1c(noc1CO)C,0.2371
CN1CCC=CC1C=O,0.1938
c1c2c([nH]c1N)ocn2,0.2046
C1CC23CC(OC12)C=C3,0.2461
OC1CCC23CC(C2)C13,0.3253
O=CN1C(C#C)C1C#N,0.2539
CC1=NC(=NN1)C1CO1,0.2475
Cc1ncc(cn1)C#C,0.1991
OCCC1(CN1)C1CO1,0.3122
Cc1c(non1)C(=O)N,0.2112
c1cc(cnc(=O)c1)O,0.1581
COC(CO)C(O)C#C,0.2846
c1nc2n(n1)CC(=N2)N,0.1934
CC1CC2(O)CC12O,0.2876
CCC1CC1COC,0.338
CC1(O)C2NC(=O)C12C,0.2451
CC(C#N)N1C=CC=N1,0.2594
C1C2C3CCC4C1N2C34,0.2919
N=C1N=CN2CCC2=N1,0.1952
CCC(=NO)C(C)C#N,0.2535
N=C1OC=C(C=O)C=N1,0.17
c1cnc(nc1O)C#N,0.2088
CCCC(C)C,0.3901
CC12CC1C1C(O)C1C2,0.2994
OC1C2C3CCC2C13O,0.3253
CC1OC11COC(=N)C1,0.2816
CC12OC3(C)C1CC23C,0.3076
C1OC11CC2C3CC1N23,0.3106
CC1CC(=O)C2(C)NC12,0.2154
CCC1CN(C=O)C1=O,0.2168
C1C2OC3CCCCC123,0.3042
CCC1(CN(C1)C=O)O,0.2667
CCC(=O)C#CCO,0.2102
C1OC2C1C1CC=CC21,0.255
CC1CC2(O)C=CCC12,0.2616
OCC1CC(N1)C#N,0.2645
CC(=O)C(F)(F)F,0.2279
OC1CC2CC1C2,0.3401
CC1C(O)C2C3CC3C12,0.2882
CC12C3C4C1OC2CN34,0.2862
CC1=C([O-])C(=[NH2+])C=CO1,0.1318
CC1COC2C1NC2=O,0.2558
N=C1OC2CC12C1CN1,0.2488
CCC1C2CC(O2)C1O,0.3204
CC1CN=COCC1O,0.256
N#CC1NC2C3CN3C12,0.2504
COCC(C)OCCO,0.3396
OCC(=O)NCC1CN1,0.2754
CC(O)C1=NON=C1O,0.2326
CC1CC2C(O)C(O)C12,0.2926
CC(CO)OC(=O)CN,0.2599
N=C1ON=NN1C1CC1,0.1954
CNC(C#C)C(=O)CO,0.2017
OC1C2NC2C1C=O,0.205
N#CC1C2CC1C2C#N,0.3223
CN=C1OC=CC(F)=N1,0.1737
c1coc(c1N)NC=O,0.1834
C1C23COC12C=CCO3,0.2193
CCOC1C=CNC1=O,0.2062
CCCC1(CC1C)C=O,0.2322
OC1C2C1C1C(O)C21,0.2703
CN1CC11CC2OC12,0.3142
CN=C1N=CNC(F)=N1,0.192
Cc1cn[nH]c1OC,0.2523
OC1(CC1(O)C#C)C#C,0.2606
CC#CC(=O)NC(C)C,0.2317
Cc1c([nH]c(=O)[nH]1)OC,0.2341
N#CC1COCC11CN1,0.2847
CC1CC(C)=CC(=O)N1,0.2092
C(C#N)NC(=O)NC=O,0.242
N#CC1C2CN2C1C#N,0.264
CC(C)c1c(cco1)N,0.2167
C1NC1C12C3CC1CN23,0.2997
CC(=N)OC1=CNC=N1,0.2346
c12c(n[nH]n1)oc(n2)N,0.2098
C1CC2C3C=CC(=C1)C23,0.1845
OC12CC3CC1CCC23,0.3292
CC#CC(C)CC(N)=O,0.2664
NC1=NC(O)=NOC1=N,0.1725
CCOC(=O)C(O)CC,0.2702
CCC1CNCC(=O)O1,0.2401
CCC#CC(N)C#N,0.2749
OC1(CC1)C12CC(C1)O2,0.3017
CCN(C)C(=O)CCO,0.2682
CC1CC(=O)N1C(C)=O,0.2292
CC(N)C1=NC(O)=NO1,0.2397
CCOC(C#C)C(N)=O,0.263
CCC1CN2CC2C1=O,0.2132
CC(O)C1NC1CC#N,0.3029
OC1C2CCC2NC1=O,0.2695
NC1=CC(=O)C(C1)C#N,0.2099
N=C1C=CNN=NC1=O,0.1568
CC(CO)C(CO)C#C,0.3014
CC1(CNC11CC1)C#N,0.257
CCC#CC1(CO)CO1,0.2751
CC12CC3CC1C(=O)C23,0.2286
CC12CC(C=C1)C2O,0.2379
N#CCC12CC(N1)C=C2,0.2354
CC1N2C3C(O)C3C12C,0.2734
C(C(CO)(CO)C=O)O,0.2175
O=CC1CNC1=O,0.2212
CN1C2C3C(O)C3(O)C12,0.2888
CC1=NNC(=N)N=C1C,0.1538
CC1(CC1(C)C)C,0.3318
C1CC2(C1)CCOC2,0.3213
CC1(C#N)C2CC2C1=O,0.2215
CN1C2C3CC2(C)C13C,0.2869
N=C1N2CC2CCC1=O,0.1781
COc1c[nH]nc1CO,0.2316
CC1(CCC1)C2CCC2,0.3458
CC(C)C1CC1C#C,0.2907
CC(C)(O)C1COC1=N,0.2878
C#CC(CCO)(C#C)O,0.2695
OC1CC1C(=N)NC=O,0.203
c1c(n2c([nH]1)nnn2)N,0.205
CCC(CC#CC)OC,0.2865
C1C2CC1C1OC1CO2,0.3138
CCN1C(C)C1C=O,0.1954
CC(NCC(C)=O)C#N,0.2133
CC1(COCOC1)C#C,0.3058
c1c[nH]c2c1c(no2)N,0.2278
NC1C2NC2C1(O)C#N,0.2458
NC1COC(=O)NC1=O,0.2364
Cc1ncn(n1)CCO,0.262
CN1CCC1(CN)C#N,0.2597
CC1OC(=O)C1CC#N,0.2776
CC12CC(C1)C1(CC1)C2,0.3475
CCC1C(C)NC1C#N,0.2677
N=C1OCC11CCCC1,0.2908
CCNC(=O)CCO,0.2777
CC1OC11CNC1C=O,0.2111
C1OC2C3COC2C13,0.3076
CC1=C(COC1=NC)N,0.2058
CCC(C)C1=NC=CO1,0.2445
c1c(nno1)C(F)(F)F,0.2434
COC(C)(C)C(C)C#N,0.3028
CCn1cc(cn1)C#N,0.2398
NC(=O)C1C(O)C1C#C,0.2528
CC#CC(=O)C(O)CO,0.1898
CC1(CO1)C#CC1CN1,0.2606
C1C2CC3=CCOC1C23,0.2402
CC1C([NH3+])C1(O)C([O-])=O,0.2676
O=CC12CC1CCCO2,0.2252
O=C1CC2CCC1O2,0.2145
C#CC1=C(COC1=O)N,0.1923
OCC1NC1C=O,0.2226
Cc1c(nno1)C(=N)N,0.2014
CC1=CC2NC1C2C#N,0.212
CC1=NCC2C(C#N)N12,0.2412
O=C1C2CCC1(O2)C#N,0.2329
CN1C2CC(C)(CO)C12,0.2877
NC1=NCC2OC1C2=O,0.2084
COC1C(C)OC1C=O,0.2116
CC(O)C1C2OC2C1O,0.3249
CN1CC2OC(=N)C=C12,0.2012
O=C1CN2CC=CC12,0.2041
OCC1C2COC12C#C,0.2439
COCc1c[nH]c(=O)[nH]1,0.2337
COCC1CC(CO)C1,0.3264
COC1CC(C=O)C1C,0.2232
CN1CC2(CN2)C1=O,0.2643
N#CC12CC1CC=C2,0.2469
CC(=NO)CC(=O)C,0.2096
NC(=O)C12CC(=O)C1O2,0.2113
Cn1c2c(cn1)C=CC2,0.2014
CN1CC2(C)OC(=N)C12,0.242
CCCC1CC1(C)OC,0.3291
Cc1c(nc(o1)C#N)N,0.1661
OC(CC(O)C#N)C=O,0.2231
CC1=C(CCCCC1)C,0.2485
C1CN(C(=O)C=C1)C=O,0.1857
Cn1cc(nn1)N=CN,0.2068
N#CC1C2NC3CN1C23,0.2452
C1OC2C3OC(C=C1)C23,0.2224
CC1(N)C2NCC12C#N,0.2372
CC#Cc1cn[nH]c1O,0.2288
CC(C)(O)C1CC=CC1,0.264
c1c[nH]c2c1OC=NC2,0.2139
OC1CC2OC3C(O2)C13,0.2994
CC1=CCOC12COC2,0.2473
CN(CCCCO)C=O,0.2723
CC1(C)N2CCC12C#C,0.2458
CC1CNC(C1)C#N,0.2702
C1C(=O)NC(=N1)CC=O,0.2177
CC12OCC1CC2C=O,0.2259
NC1=CN=C(F)C(=N)N1,0.1597
CC12CN1CC2CCO,0.3039
COC(=O)C(O)C(C)O,0.2636
COC1C(C)C(O)C1C,0.311
CC(=O)NCCCOC,0.2792
N=C1OCC2=C1OC=C2,0.2034
C1CN1C(=O)CCO,0.2537
CN1C2C3NC2C3C1=O,0.2423
O=C1C2C3OC2(C#C)C13,0.2257
CC(O)C(=O)OC1CC1,0.268
CC1C2OC1C(C)C=C2,0.2377
N=C1C=CC2(CN12)C#N,0.1955
CC1=CC(=O)C=CCN1,0.1691
CC1CC2CC1(O2)C=O,0.2164
CC1(C=CC=CCO1)C,0.1925
c1c[nH]nc1NCCO,0.2243
N=COCC#CC1CO1,0.2653
COC1CC(C)C1O,0.3188
CCC1(C)NCC1=O,0.2175
CN=c1ccoc(n1)O,0.2035
CC12CN1CC1NC1C2,0.2893
OCC1C2COC2C1=O,0.1963
OC1(C=CC2NC12)C#C,0.2323
CC1OC(C)C11CCO1,0.3167
CC1(O)CC1C#CC#C,0.2174
CC1CC(C)(O)C(C)O1,0.2958
OC1CC1NC(=N)C#N,0.2006
CC(=O)NC(=NC)CO,0.2189
[NH3+]C1CCC1C([O-])=O,0.2727
O=C1CNC2CC2OC1,0.2044
O=CC12C=CC3CN1C23,0.214
CN1CC11C2C3C1CN23,0.2991
O=C1COCC1C1CC1,0.2123
C1C2CC3COCC1C23,0.3089
CC1=C2C3C4C3N(C1)C24,0.1541
CC1CN2C3C2C1C3O,0.3028
CC1N=COCC2CC12,0.2631
CN1CC11C2NC1C=C2,0.222
C1C2CCC=CC12,0.2465
CCCCC#C,0.3166
C1OC2C3OCC1OC23,0.2817
OC1CC11OCC2OC12,0.3166
OCC1CC(O)CC=C1,0.2652
FC1=CC=NNC1=N,0.1647
CC(=N)OC(=O)C1CN1,0.2441
CNC(=O)OC=N,0.2731
OC(CCN1CC1)C#N,0.2561
COC(C)(C#C)C(C)=O,0.2169
CN(C)c1cnon1,0.1967
c1c2c(co1)onn2,0.1665
COCCC1(C)CC1C,0.336
C1C2COC3C4CC23N14,0.2346
CCC1C(C)C1(N)C#N,0.287
O=CC12CC1N=COC2,0.2132
COC1C2CC3CC2C13,0.3339
O=C1OC2CC(O1)C=C2,0.2485
Cn1cnc(c1O)CO,0.2364
O=C1C2C=CC1N1CC21,0.212
CC12CN1C(=O)CCC2,0.2442
NCC(N)(CO)C#N,0.2705
CC1=C(C(=O)NC1=O)C,0.1825
C1OC11CCC2CC1O2,0.3174
C1CC2C=CCOC2O1,0.2482
N#CC12NC1CC1NC21,0.258
CC1(OCC(=O)O1)C=O,0.2122
N#C[C-](C#N)C1C[NH2+]C1,0.1539
c1[nH]c2c(n1)N=CNC2,0.1941
CN=C1OCC=CC1C,0.2533
CC1(CN1)C1(C)CCO1,0.3101
CC(C)(C)C1(CC1)CO,0.3239
O=C1C=CC2N=COC12,0.1818
OC1CC(=O)C1C#C,0.2148
CC1CC(CO)OC1=O,0.2775
CC12OCC(C=C1)C2=O,0.216
C#Cc1cc[nH]c1N,0.2098
N=C1OC2CC(=O)CC12,0.2214
N=C1NC(C#N)C11CO1,0.2582
OCC1(O)CC2COC12,0.2904
CC1C(C)C2=CCCC12,0.2471
N=COC1CC2OC2C1,0.2802
Cc1c[nH]c(n1)N(C)C,0.2352
CC12NC3C1C2C3C#N,0.2667
Cc1cc(co1)CC#N,0.2338
Cc1c(c(no1)O)OC,0.2335
CC1C=CC2OC1C2O,0.2357
CC1=CCC(C)(C)C1O,0.2594
CCCOC(=O)CCO,0.2855
CN1C2C3OC3C12C,0.2652
Cc1c[nH]cc1C2CC2,0.2494
C1C2CCC3CCOC123,0.3095
CC12C3CC1C(C#N)C23,0.2945
CC(O)CC1CC2CN12,0.2966
CC1=CCCC1(C)C,0.2603
CC1(C=O)C2OC1C2O,0.2266
CN=C1OC(C)=NC=N1,0.1741
O=CNCC1CC1C#C,0.275
CN=C1OCC2CC12C,0.2711
C(CCO)CC(=O)N,0.279
CC12C3C4C5C(C1N45)N23,0.2626
CN(C=O)C1CC1C=O,0.2183
CN=C1NC(=O)OC1C,0.2549
C(C1CO1)N1C2CC1C2,0.3134
NC(=O)C1NCC1O,0.2575
CCN=CN(C=N)C=N,0.2215
C1CNC(=O)C(=C1)C#N,0.1923
CC12COC1C1(CC1)O2,0.2913
CC1C=CC2C1NC2=O,0.2418
CCC1C(N)C1(O)C#N,0.2703
C#CC12CN1C(C2)C#N,0.2471
CC12CC3COC13CO2,0.2998
CC1NC1(CO)C1CO1,0.3154
CC1OC=NC11CC1,0.252
CC(CO)C1OC1C=O,0.2159
N#CC12CC(N1)C1OC21,0.2579
CC12CC3(CN3)C1(C)N2,0.2909
OCC12CC3=CCN1C23,0.1656
c1cncc(nc1=O)O,0.166
CCN(C)C(C=O)C=O,0.1741
N=C1OC2C=CCOC12,0.2476
NC1=CC(=N)ON=C1F,0.1618
CC12COC(C1)C(=O)N2,0.2495
CN1C2CC1(C2)C(N)=O,0.248
C1CCC(=O)COCC1,0.2061
OC12COC1C2(O)C#N,0.2521
C1CN(C1)C2(CC2)C#N,0.2553
CC1OC1C12CC(C1)C2,0.3491
CC1CC2CC2OCO1,0.3244
CCC12C3C4C3C1OC24,0.3249
N#CC1CCCC2CN12,0.2718
OCCOC1CC2OC12,0.3213
CC1C2CC3CC2OC13,0.3276
C#CC1C2CC1(O2)C#N,0.2546
NC1=NC(=N)NC(=O)N1,0.2228
O=C1C2CC(C#C)C1N2,0.236
OC1CCC11CC1,0.3331
CC(C#N)C1OC1C#N,0.2972
OC12CC3C1OC23C=O,0.2121
CC(O)C12CC1(C)CC2,0.3105
N=C1OC2C3CC2(C3)O1,0.3
CNC(=O)n1nnnn1,0.2175
CN1C2C3CC3C(O)C12,0.2604
CC(=NO)C12CC1OC2,0.2357
CC1C2OC(CC=O)C12,0.223
CCC1C2CCC12C#C,0.2664
c1c(oc(n1)C#N)C#N,0.1883
N=COC1=CC=NN1,0.2325
CC1C2CC11CCCC21,0.3456
COc1cnc(cn1)F,0.1857
OC1=CC(=NN1)C1CN1,0.2416
C(C(CO)CO)O,0.3133
OC1C2C3CCCN2C13,0.2849
c1c(ncc(n1)N)C=O,0.1754
COc1c(cc[nH]1)C#N,0.2211
CCCCC1(CO1)C#C,0.2862
O=C1C2C3NC(=O)N1C23,0.223
CC(N)(C#N)C1COC1,0.2828
c1c(oc2n1cnn2)N,0.2296
CC#CC1N(C)C1(C)C,0.2546
CCC12CC1CC(C)=C2,0.2434
CC1(O)C2CC2C2CC12,0.3216
OC1CC11OCCC1=O,0.209
COc1c(c(n[nH]1)O)N,0.2548
CC(C)CC1(CN1)C=O,0.223
O=C1OC23CC12CC=C3,0.2406
CC1=NC2(C)CC2(C)O1,0.26
CC1C2C(CN12)C=O,0.2146
CC12CC3C(CO1)C23O,0.2934
OCCC1CN1CC#N,0.2771
O=C1NCC11OC2CC12,0.2524
CC(C)C1OCCCO1,0.3495
CC1CC(COC=O)C1,0.2863
CC12COC1C2CC=O,0.2249
CCC#CC#CCC=O,0.2
OCC1CC2C(O)C2C1,0.3185
CC12CC3CC1C2OC3,0.2973
OC1C(O)C(=N)NC1=N,0.2483
CC1(N)C2CNC12C#N,0.2421
C#CCN1CC=CC1=O,0.2151
COC1CC11CNC1=O,0.2765
C1CC12CC(=O)C=C2N,0.204
CN=C1C(=O)CCCO1,0.1896
CC(C#C)C1=NC=CO1,0.2432
CC1CC2CCC(C)=C12,0.2419
CC(O)(CO)C(=O)C#N,0.1979
CN1C2C3COC3C12C,0.2742
OC1CCC(O)C2OC12,0.3307
C#CC(=NO)CCC=O,0.2088
O1C2C1C1N=CN3C2C13,0.2389
O=C1C=CCOC2CC12,0.19
CCC(=O)C12CCC1O2,0.2225
C1CC(C1)C#CC#N,0.2392
CN=COc1ncno1,0.2586
c1c(nc[nH]1)C2COC2,0.2471
CC12CCC1(C)OC2,0.3129
CN=C(CN1CC1)OC,0.2648
C1C2C3C4C1CCC2N34,0.306
CC1CC1C(O)C#C,0.2947
C#Cc1c(oc(=O)o1)O,0.2045
COC12CNC1C2O,0.2913
OC12CC1CN(C2)C=O,0.2681
CC12CC(O)C1CC=C2,0.2581
O=C1NCC11C2CC1O2,0.2565
CC1=CC2(CC1)CC2,0.244
CC1(O)CCC1(C)C=O,0.2285
CCC1NC(=O)CC1C,0.2732
CC1(COC1C#C)C=O,0.2234
CC1C2OC2C(=O)C1C,0.2093
CC(O)CCC1CO1,0.3359
CC1(CCO)OC1C#C,0.2732
CC([NH+]=CN)C([O-])=O,0.2435
Cc1c(cccn1)C#N,0.208
CN1C=C(OC1=N)C#N,0.1769
C1CC23C4CC2C(O4)C13,0.3209
CC(C#N)C1OC1C#C,0.2818
ON=C1CCC(C1)C#N,0.2446
N#CC1CC2CC(C1)O2,0.2847
CC12OC1CC1NC21,0.3104
CC1(COC(=N)C1)C=O,0.2239
O=CC1CN1,0.2258
C1C2CC3CCC2C1C3,0.3397
OC1C2OCOC12C=O,0.2156
CC#CC(OC=O)C=O,0.2139
CC1NC11CNCC1=O,0.1924
CC(=O)NC1CC1(C)O,0.2662
CC12CC1CCC=CC2,0.2596
CC(=NO)CC1COC1,0.2536
CC1(O)C2CC2N2CC12,0.2996
NC(=O)OCC(O)C=O,0.232
O1C=NC23C4C5C(C24)C135,0.208
c1[nH]nc(n1)C#N,0.2445
CN1CC11CC2CC12C,0.3127
CC1OC(C)C1CC#C,0.2935
C#CC1COCC2CN12,0.2676
OC1CC2OC2C1O,0.3271
C#CCCC1NC1C#C,0.2794
OCC1=NC(=N)OC=N1,0.1906
CC1C2OC(C)(C#C)C12,0.2611
CC#CC1OC1CO,0.273
CC12CCCC(O1)C2O,0.3255
O=CC1CCC2OCC12,0.2215
CC1(C)OCC(O1)C#N,0.2875
N=C1ON=C(CC#N)O1,0.2407
c1conc1C#CC#N,0.1999
CC12CN1C1CC2C1,0.3245
N=C1OC2=C(CCC2)O1,0.2422
C#CCC1CCOC1,0.2981
CC1(CC(C1)(C#N)O)C,0.3051
CC(N)(CC(N)=O)C#N,0.2607
CCOCCC(C)(C)C,0.3209
CC12C3C=C4CN(C13)C24,0.1805
O=C1NCC=CC11CO1,0.2372
OC1=NN2C3CC3C2=C1,0.2172
CC1=CC2CC2(O)C1O,0.2321
OCC1(O)CCC=C1,0.2654
CCC12CC3C(CC13)C2,0.3521
CC12NC1C1(C)OC21C,0.2801
OC(C1CN1)C1COC1,0.3017
CCC1C(CO)NC1=O,0.2798
OC1C2C3C4CN4C2C13,0.3089
OCC1N2CC2C11CO1,0.3043
CC#Cc1cc([nH]c1)N,0.2101
N#CC12CC1C1CC2C1,0.2983
CC1CCC2C(C#C)N12,0.2565
CC12CC3(O)CC1C2C3,0.3242
OC12CC3C1C2CC3=O,0.2246
CC12OC3(C=O)C1CC23,0.2086
CCOC1CC(C)C1,0.3293
CCC(C)CC(O)C#N,0.3123
c1cc(c(cc1F)F)F,0.2222
CC1C(C)C1CC#C,0.3125
CCC(C)(O)C=O,0.226
CC1(CNC1=O)C1CC1,0.2806
C1C2OC3=C(C=NO3)C12,0.2234
CC(C)CN(C)C(=O)N,0.2908
COCC1OC1(C)C=O,0.2202
COC1CCOC1=NC,0.2585
c1c(nc2n1nno2)O,0.1683
CC(C)(C)C(=O)C1CC1,0.2279
CCC(O)C1=NC=CO1,0.2441
C1C2OC1C1=C2ON=C1,0.2203
COCCC(F)(F)F,0.3487
O=COCC1CCC1=O,0.2209
CC(=NC)NC(=O)CO,0.2343
CC1OC2COC=NC12,0.2666
CC1C(C)C(C#C)C1O,0.2871
CC#CC1OCC=C1,0.2525
CN=c1n(nc(o1)N)C,0.2245
CC1(CCC1)C(O)C#C,0.2932
[O-]C(=O)C1C=CNC1=[NH2+],0.2321
C1C2CC3(COC3)OC12,0.3028
CC(OCCO)C(C)=O,0.2123
CC1(CC1)C1C2CCC12,0.3307
CC1C2CC(C2)C1C#N,0.3395
OCCOC(CO)C#N,0.2873
Cn1cc(nn1)C=O,0.203
CC1C2C(C)CC12C#N,0.2843
CC1C2OC3CC(C3)C12,0.3104
CC1OC11COC1CO,0.3104
Cc1nc2n(n1)nco2,0.227
CCc1ccco1,0.2355
CC1=C(CCC1)C2CC2,0.2414
O=CNCC(C#C)C#N,0.2717
C1CC23C1OC1C2NC31,0.3009
c1([nH]c(=O)[nH]n1)N,0.2481
OC1CC(O)C1C1CO1,0.3044
CC(C)C1(CO)CN1C,0.3061
CC1C2C3N2C1C3=NO,0.2382
CC(O)(CCO)C#N,0.2949
CC1=CC([NH2+]C1)C([O-])=O,0.235
O=C1OC2CC3CN1C23,0.2701
CCC#CC1CC1C=O,0.2185
C1CC1CC#CCC#N,0.2873
CCC1CC2CC12O,0.3232
CC1=CC(O)CCC=C1,0.1899
CCC(CC)(CC#C)O,0.3008
OC1CCCCOC1,0.3166
CC1C2CCOC12,0.318
OC1CC23CC12OCO3,0.2845
CC([NH3+])C1=NOC([O-])=C1,0.2058
N#CC12OC3C(C=C1)C23,0.219
NC1=C(NC=C1)C1CO1,0.2131
O=CC1CN2N=CC=C12,0.2017
c1c(c(=O)nc(o1)O)F,0.2158
CC1(C=O)C2CCCC12,0.2318
OC1CCC11C2CC1O2,0.2919
CC1(OC1C#C)C1CO1,0.2735
CC(C)CC#CC(C)C,0.2981
CC1CN2CC12C1CN1,0.2985
CC1CCC(O)C1O,0.299
CCC1CC2C1N2C=O,0.2439
CCC(=O)COC(=O)C,0.2359
C1OC11CC2CCCC12,0.3187
N#CC1C2OC1C1CC21,0.2934
CCNc1c(nn[nH]1)N,0.2196
O=C1CC2NC2C11CC1,0.2265
CC(O)C1CC(=O)C1C,0.2183
O=CNC1=CCN2CC12,0.1999
O=C1CC2(CC3CC23)O1,0.2811
COCC1CC1OC=O,0.2575
Cc1ccnn1C=O,0.2091
CCC1(O)CC1C(N)=O,0.2721
c1c2c(on1)OCC2,0.2258
CC1=CNC(=N1)C1CO1,0.2326
Cc1c(cc(cn1)O)F,0.2058
CC(=O)C(=NCCO)N,0.1879
COC(=O)C(C)(N)C#C,0.2488
CC(C)(CCOC)CO,0.3183
C(C#N)NCC(F)(F)F,0.2845
CC1(CC1)C(O)CC#C,0.3034
CC1CN=C(C)OC1C,0.2735
CN1C2C3C=C(C)C1C23,0.2166
CN1N=C(OC1=N)C#N,0.1684
NC1=NC2CNC2C1=O,0.1648
CC12C(O)C1OCC2O,0.3171
CCOC1(CCC1)C=O,0.211
CN1CCC1C#CC=O,0.1734
CC(C)C12CC(N1)C2=O,0.246
CCC12CC=C(C)C1N2,0.2361
NCC(O)(C#N)C1CC1,0.2557
CC1=CC(O)CC(O)C1,0.254
NC(=O)C1CN1CC=O,0.22
CC1=CC(=O)N2CC12C,0.2
O=C1CN2C3CCC3C12,0.1954
CC1CC2C(OC=O)C12,0.2694
C1OC2CCOCC2O1,0.3353
C#CC1CC2CCC2C1,0.3024
O=CN1CC2CCCC12,0.264
CC1CC2=C(O1)C=NN2,0.2205
N#CC12CN(C1)C2,0.2761
CC1CC2=C(N1)N=CN2,0.2076
COCC(OC)C#C,0.2868
O=C1COC2COC2C1,0.2128
C#Cc1cncc(n1)O,0.1797
OC1C(C#C)C11CCO1,0.2586
O1C2C3C4C1C1C2C3C41,0.3173
C1C2C3COCC3N12,0.3119
CC1C2C1C(=N)OC2C,0.2771
OC1CCC11CC1C=O,0.2257
CC(C)(C=O)C#CC=O,0.1932
CC#CCC#CC#C,0.2284
C1C2CN3CC3COC12,0.3118
CCOCc1c[nH]nn1,0.2511
CC1CC2OCC=CC12,0.2568
CC1CC1C1=CC=NO1,0.2294
CCC12C3OC(C13)C2C,0.3077
CC1C2C=C(C)C1C2C,0.2365
CC1C2CC1(O)C2=NO,0.2693
CC1(CCC(=O)C1)C=O,0.2151
OC1CC(C#C)C1C#C,0.2862
CCC1N(C)C1(C)C,0.2893
COC1OC(=N)C=C1,0.2201
CNC1=NC(C)(C)CO1,0.2743
CC1CC(=O)CO1,0.2196
C1C2C1C13COC1C2N3,0.2944
OC1CC1CC#C,0.3143
NC1=NC2(CC2O1)C#C,0.2591
CC1CC2CC2C(=O)N1,0.2585
CC([NH3+])(C(N)=O)C([O-])=O,0.1974
CC12CC3(C)N1CC23C,0.3054
O=C1CC(CO1)C1CO1,0.2787
CC1(CCC(O)C1)C#C,0.3147
Cc1cnc(o1)O,0.2425
OCC1OC(=O)C1CO,0.2741
C1OC2C3NC12C1NC31,0.2931
CC1(CC#CC=O)CN1,0.1982
OC1CC1C1=NC=CN1,0.2397
c1c2n(nnc1=O)CC2,0.1662
O=CC12C3COC1CN23,0.2138
c1nc(c(c(n1)O)N)N,0.2082
CC1=CC2(C)C(O)C2C1,0.2328
CC12C(O)C3(C)C1CC23,0.318
CC12OC1C1C2N1C=O,0.2466
CNC(=O)C12CCC1N2,0.2602
CCCC(C)(N)C#N,0.301
c1c(nc(=O)oc1O)N,0.211
CN=C1N=CNN=C1C,0.1842
OCC1C2OC1C2C#C,0.2772
OC1C2N=COC2C1=O,0.1898
CC1(O)C2CC(C#N)C12,0.2862
OC12CC3C1C=CC3C2,0.2446
O=C1C2CCOCC1N2,0.2268
COC12C3OC1C(=O)C23,0.2235
C#CC(=O)CC1CCC1,0.1998
OC12CC3(O)C1C=CC23,0.2264
N#CC1NC2C3OC1C23,0.2638
CC1C2OC3C(C)N1C23,0.2777
OC(C#C)C(=O)OC=N,0.2361
C1C=CC(=O)C1=O,0.1396
CCOc1cnoc1C,0.2123
O=CC1OCC2OCC12,0.2163
OC1CC1NC(=N)C=O,0.1597
OCC1=CN=NOC1=N,0.1683
CC1OCOC(=N)C1O,0.2807
CC1(C)OC11CNC1=N,0.2516
CC(C)C(=O)C(=N)N,0.1957
CCC12OC3C(C=C1)C23,0.228
COc1ccnc(c1)F,0.2361
CC(CCO)C#C,0.3151
N#CC1CC2C3CC3C12,0.2811
CC(C)CC(O)C(C)=O,0.2386
CC12C3CC4(O)C(C13)C24,0.2855
O=C1OC2C3C4NC13C24,0.2491
O=CC1CC2(NC12)C#C,0.2005
CC1OC1C(O)C(C)=O,0.2365
CCC1=CC(=NC)OC1,0.2066
O=C1C2NC1C=CC=C2,0.1562
CNC(=O)C(O)C#CC,0.264
OC1C2CC2C(=O)C1O,0.2119
COC1CC(C#N)C1O,0.2963
c1c(c[nH]c1N)N(=O)=O,0.1598
Cc1cnccc1CO,0.23
CC(C)(C)OC=NC,0.2737
COC1C2CCC1(C)O2,0.323
O=C(C#N)C1CC2OC12,0.189
c1cocc1OCC=O,0.1851
Cc1cc(oc1)C(=N)N,0.1968
C1C2CC11CCC3C2C13,0.3149
CC1C=CC2(O)CC1C2,0.2492
CC1C2OC1C(=O)C2=O,0.142
CC1(CC2CC2)CCO1,0.3176
CN=C1OC2CC12CO,0.2693
C1CC1C#CCOC=O,0.2568
CCC12CC1OC2=O,0.2759
CCC(CC)(C#C)OC,0.295
CC12C3C4CC1(O)C4N23,0.2871
CCCCC(O)C(C)C,0.3276
CCC1=CC(O)CC1C,0.2544
Cn1c(=O)ccc(n1)O,0.1601
C1C2CC3=C(OC=N3)N12,0.2204
C1COCCC1(C=O)O,0.2095
CN1C2COC(C#N)C12,0.2524
Cc1cc(nc(n1)O)O,0.2222
C1C(=NO)COCC1=O,0.2088
Cc1c([nH]c(=O)n1C)N,0.2258
Cc1cncc(c1C)O,0.209
CC1(C(C1(C)C)(C)C)C,0.318
c1cn2c(c1CO)CC2,0.2489
O=C1OCC2OC2CO1,0.3132
CCC(OCC#N)C=O,0.2208
CC#CC(C)(C)C#N,0.2848
C#Cc1cnc(nn1)O,0.1633
CC1C2CC=CC1O2,0.2379
CC1OC2C(CO)C2O1,0.324
N=C1C=NOC=C1C#N,0.1808
CC(C1CO1)C1CO1,0.3509
CCC1=C(N)COC1=N,0.2095
Cc1cc(oc1)CC#N,0.2322
C#CC1C2CC=CCN12,0.2533
COC(CO)C(N)C#N,0.2802
CC1C2CN2CC1C=O,0.2035
CCc1coc(n1)CC,0.241
CC1C(NC1=O)C#C,0.271
OC1C=CC2CC1CO2,0.2409
CCC(O)C(CC)C#C,0.3073
c1cc(=O)[nH]cc1N,0.1555
[NH3+]CC1(CC([O-])=O)CC1,0.2716
O=CN1C2C3C2C(=O)C13,0.2209
CCC1OC1C(C)=NO,0.2384
Cc1c[nH]c(c1O)O,0.2332
COCC1(CO)CN1C,0.2938
O=C1CC2C3CC12CC3,0.2285
O=C1CC2C=CC3C2N13,0.2199
CCn1cncc1C#N,0.2153
C1C2C3OCC33CN2C13,0.2911
CC1CC(=O)C(O1)C=O,0.1932
CC(C)C(O)(CO)C#N,0.3102
OC12CC3C(C1)N3CC2,0.2957
NC(=O)C1C=CC2CN12,0.2334
CC1=CCOC(=N)OC1,0.2344
CC(C)CC1(COC1)C,0.3061
N#CC1=NC2CC(C2)N1,0.1988
COC1(CC1)C(O)C#N,0.2765
O=CCCCCC1CO1,0.2289
OC1CCNC(=O)CC1,0.2712
CC1CC(O)C2(CO2)C1,0.3246
CC1(CC#N)CC(O)C1,0.297
CCOC(=O)C1CC1,0.2838
OC12COC1C(=N)OC2,0.2609
CC12COC1COC2=O,0.2693
N#CC1C2CC1(C2)C#N,0.3078
CCC1CCOC1C,0.3184
CC12C3C4C1CC2CN34,0.3142
C#CC12CN1CCC=C2,0.2296
CN1C2CCC1C2=O,0.2375
OCCOCC1CCO1,0.3172
CCCC(F)(F)F,0.4306
CCC1(CN1)C1OC1C,0.3076
CC1(CO1)C1C2CCC12,0.3289
c1c2n(c(=O)[nH]1)CC=C2,0.1629
C#CC#CC1OC2CC12,0.2101
CC12CN1C(CC2)C=O,0.2171
O=CC12CC1C1CN2C1,0.214
ON=C1C=CNC2CC12,0.1785
CCN1C=CCCC1=O,0.2082
CCC(=O)C(=N)NC=O,0.1831
OC1CC2(C1)CN=CO2,0.268
C1C=CCC(=O)C1=NO,0.186
NC1=NC=C(O1)C1CN1,0.2175
OC1CCC2(CO2)C1,0.3229
O=C1CC2C3C=CC1N23,0.1906
C1C=C2C=CCC3C1C23,0.2221
O=C1NC2C3C=CC2C13,0.2056
CC(=O)n1cc(nc1)N,0.1628
CC1CC(O1)=NCC#C,0.2682
CC12OC1C1OC1C2=O,0.1906
OCC(O)CC#C,0.3009
CC1C2CN(C)C(=O)N12,0.2748
N#CC1OC2CC1C2,0.2829
CC1C2C3C(O)C3N12,0.2712
OCC1C2NC2C1CO,0.3012
Cc1ccc(nc1)OC,0.2052
CC(C)c1c[nH]nc1O,0.2456
CC1(CO1)C(N)=O,0.2638
C1CC23OCC12C1NC31,0.2815
CC1C2C(C)C1(C)C2=O,0.246
CC12OC1C1(CO1)C2O,0.3083
O=C1OC2C3CNC1C23,0.243
CC12C=CC3C4C(C13)N24,0.2326
CCC12CC1C1(CC1)C2,0.3243
CCC1(CCC1)C#N,0.3341
CC(CO)NC(C)C#N,0.2645
CC1=CCOC(=O)CC1,0.2512
CC1CC[NH+]1CC([O-])=O,0.2621
CC1C2C3C(C=O)C1N23,0.2128
C(C#CCC(=O)N)C#N,0.2742
OC1CNC(=O)C1O,0.275
COCC#CC(C)C#C,0.2767
CCn1c(c(cn1)C)C,0.2444
C1CC12CC(C2)C(=O)N,0.2712
CCC#CC(C)C(N)=O,0.2686
CCNC(=O)NCC,0.3049
CC#CC1C2C3CN3C12,0.26
O=C1OC2CCC1NC2,0.2487
C1C(CN1)(CCO)C#N,0.2683
c1c(coc1NC=N)O,0.1899
CC12C=CN3C1C2C3=O,0.2005
CCC(=O)C(C)(C)C=O,0.1944
CC1CC2OCOCC12,0.3273
OCCC1COC11CC1,0.2991
CCC(=O)CCC(=O)N,0.2369
N=C1OCC(=C1)C#C,0.1833
C1COC12CN(C2)C=O,0.264
CCCC#CC(=N)OC,0.2379
C1CC1(CC=O)CC#N,0.2295
CCC1C(C)C1(O)C#C,0.2677
CN1CC(C1)NC=O,0.25
OC1(CCC2CC12)C#C,0.2919
CC(C)CCNC(=O)C,0.279
Cc1c2c(on1)NCC2,0.2184
COCC1CC1C,0.3379
CC1(C)CC1NC(N)=O,0.2921
C(C1CO1)C1COC=N1,0.2693
CCC(CC1CC1)C#C,0.3129
C1COCC=CCC1=O,0.2125
CC(O)C(O)(CO)C#N,0.2952
CC1=CC=NC(=N)C=N1,0.1702
CC12CC1C1(CO1)CO2,0.311
CC1(CC2NC12)N1CC1,0.3108
N#CC1CCOCOC1,0.3055
CC(C)(C#N)C1CO1,0.3141
CCCC1CC=CC1,0.2648
CC12CC1N1CC(=O)C21,0.2024
CCNc1cc[nH]c1C,0.2168
C1OC23CC4C2OCC134,0.2839
OCC1(O)C2CCC12,0.295
CC(O)C(OC=N)C=O,0.2121
OC1C(NC1C#C)C=O,0.2075
c1noc2n1c(nn2)O,0.199
N#CC12CN1CCC2,0.2776
C(CO)C(=O)OCCO,0.2811
CN1CC2CC(=O)C=C12,0.2014
CC#CC(CO)C#CC,0.2809
CN1CC2C(O)C1C2=O,0.201
CC1C2C3C1C(C)C23C,0.3344
CC(C)Cc1[nH]ncn1,0.269
C(CO)N(CC=O)C=O,0.2118
C1CCC(C1)C2(CC2)O,0.3222
CCC#CCC(=O)C=O,0.1477
C#Cc1cc([nH]n1)N,0.2144
CC(O)C12CC1CC=C2,0.2467
CCOc1cncnc1,0.2069
CCC1CCC(=O)C1,0.2227
C1CC1CC#CC=O,0.2054
CC(N1CC1)C1(C)CC1,0.3142
CC1=C(C#C)C(O)CC1,0.2074
COCC#CCC1CN1,0.2815
CC12CC1OC1C(O)C21,0.3112
CN=C1NC(F)=CN=C1,0.1514
CN1C2CC1C(=O)NC2,0.244
CC12CC1(C)C(CO)O2,0.3046
CN1N=NOC(=N)C1=O,0.2008
CC1(CO)C(O)C1CO,0.3001
C1N2CC3C4OCC12C34,0.3147
NC1=NC(CC#N)CN1,0.2644
CCC12CN3C1CCC23,0.3013
C(C#CC=O)NC(=O)N,0.1987
CC1OC2CC1(C2)C#N,0.2794
CN=C(c1cnoc1)N,0.2092
OC12C3OC1C3OC2=N,0.2509
CC1C(=O)C2C(O)C12C,0.2268
CCC1C2CCN2C1=O,0.2364
CC1C2C(=N)OCC12C,0.277
O=C1CCC11CC2CN12,0.2016
C#CC1C=C2CN3C1C23,0.1717
O=CC1CC2OCC2O1,0.2208
O=C1CCC2CC(C2)N1,0.2586
CC12C3C=CC1CC23O,0.2271
CCc1[nH]nc(n1)C,0.2655
CC1(O)CCC1(C)C#C,0.2986
O=C1CNC=NC1C#N,0.1951
CNC1(CC=CC1)C#N,0.2437
OC1C2OC(=N)C12,0.2654
OC12C3C4N3C1C24O,0.264
CN=C1NCC(O1)C#N,0.2321
NC1=NC=NC(=N)O1,0.193
CC(N)C1=NC(N)=NO1,0.2319
CC(=O)C12CC(CC1)O2,0.2248
N=C1C=C(NC=N1)C=O,0.1382
CN1CC(NC1=O)C=O,0.2003
OCC1CCC1C1CC1,0.3359
C#CC1C2CC1N1CC21,0.2752
CC1CC(OC=O)C1O,0.2681
N#CC12OC3CCC1C23,0.2479
CC1CC1OC(C)=N,0.2794
NC(=O)C1CC1C1CC1,0.2723
CC(=O)C#CC(=O)N,0.2016
CC(C)C1OCOC1=O,0.2709
O=C1C2COC1C21CN1,0.196
CC1COC2(CC12)C=O,0.2253
CC1=CC(=CCOC1)C,0.1903
CC#CC1(O)CC1(C)O,0.2606
CCC(CC)(C#C)C#N,0.2965
CN1C2CC3(CO3)C12C,0.3146
CC12CN(C1)C2,0.3091
CC1NC1(C)C1(C)CO1,0.3185
CC1CC2CC1(CO)O2,0.3347
COC12C(C)C1C1CC21,0.2852
c1cc(n(c1N)C=O)N,0.1552
CC(C)C1OCC(=O)O1,0.2765
CC1(O)C2CC11COC21,0.2801
CC1CC2C3CC12CC3,0.3149
Cc1cc([nH]c(=O)c1)C,0.1804
[O-]C(=O)C1[NH2+]CC=C1,0.2339
c1cnoc1OC(=O)N,0.2477
CC12CC1CC2C#N,0.3007
OCC12CC3(CC3)C1N2,0.3209
OCC1CC23CC(C2)N13,0.2719
OCC12CC1CO2,0.3025
COCC(C#C)C(C)O,0.3009
CC1(O)CC2(CN2)C1O,0.3087
Cc1cn(c(=O)[nH]1)C,0.2275
CC12NC1C(=O)NC=C2,0.2082
C#Cc1c(nc[nH]1)C#C,0.1837
C1C=CNC(=O)N1C=O,0.2092
CCOCC1CCOC1,0.3317
OCC(=O)C(O)C#C,0.2259
CC1C(O)C1OCC=O,0.2078
C1C2CC3=C(C=NO3)N12,0.2148
CC1=NC=NC(=N)N1,0.1779
CC1C2CC2C2CC12,0.3196
CCC1C=CCC1C=O,0.217
OCC(=O)C1COC=N1,0.223
N=C1NC2=C(CC=C2)O1,0.1595
CCC(C)OCC(N)=O,0.2675
CC(C#N)C12CCC1N2,0.3043
CC1CCC2(CC2)C1,0.3457
CC12CC(C1)C(C2)C#C,0.3083
c1[nH]nc(n1)OCC=O,0.2164
CC12CC1CCN=CO2,0.2592
CC1(C)CC(CC#C)O1,0.2943
COC(C)CC#C,0.3077
Cc1cc[nH]c(=O)c1,0.1819
C#CCCNC(=N)C#N,0.2061
ON=C1C=CCC1C=O,0.1923
CC12NC1C1OC1C=C2,0.2379
CC1OCOC1CO,0.3294
CC(=O)OC1CC=CC1,0.2634
CN=COC1C2CC1O2,0.2688
Cc1[nH]cc(n1)OC=O,0.2285
CCN1C2C3OC2C13,0.2855
OC1(C=O)C2C3CN2C13,0.201
CC12CC(COC1)C2=O,0.2224
OCC12CC3OC3C1N2,0.301
CC(O)C1CCC=C1C,0.257
CC(O)C(C)C1(C)CO1,0.3259
O=C1CC2NC2CO1,0.2721
CCC(C=O)C(O)C#C,0.221
C#CCOCCC1CO1,0.2895
CC1=CC(=O)C2(CO2)C1,0.1848
ON=C1C2CC1OCC2,0.2465
C#CC1C2OC2C11CN1,0.2764
CCCC12CCC1CO2,0.3106
CCC1CCC1(N)C#N,0.2834
c1c(coc(=O)c1F)N,0.1571
CCCc1coc(=O)[nH]1,0.2401
CC1CCC1(C#C)C#N,0.2882
CC1CCC2CC1CO2,0.3148
CC1C2OC2C1O,0.3269
COC(=O)CC1OC1C,0.276
C1C2OC3CNC3=NC12,0.2382
C#CC12CC3OC1C3O2,0.2554
N#CC12NC3C1NC23,0.2484
CC1OC2C3OC1OC23,0.2963
Cc1c(onc1N)CO,0.2299
O=C1CC2(CC#N)CC12,0.2319
CC(=O)c1c(cco1)N,0.1722
CC1C(C)C11C2CC1O2,0.3061
CC1CC(=O)N(C)C=C1,0.2092
CC1CC2C1OC2(C)C,0.3154
O=CC1C2COC12C#C,0.2039
CN1C2C1C1OCCC21,0.299
COC12CCC(C1)OC2,0.3191
CC1(CCO1)C(O)C=O,0.2094
CC12C3N1C1(C)C2C31C,0.2809
CN1N=CN=C1OC=N,0.2407
CC1(C)CNCC(=N)O1,0.2511
CC12C3OC(C13)C2CO,0.2886
CN=C1OC=CC(F)=C1,0.1678
[NH3+]C1CCCC1C([O-])=O,0.2741
CC1C(CC1C=O)C=O,0.2071
OCC(O)C1=CN=CO1,0.2375
CC1(CN1)C1CN1,0.3037
O=C1OCCC1C#N,0.2677
OC1CC2OC(=O)CC12,0.2772
CC12CC1NCC(=O)N2,0.2522
COCC1(C)NC1(C)C,0.3087
CC1NC2C1OC2=N,0.2561
CC12CC3C1C2C3=NO,0.2528
OC1CCCN(C1)C=O,0.2681
COCC(CO)N1CC1,0.2993
O=CC1(CC2OC12)C#N,0.2188
OC12CC1(CC2=O)C#N,0.2131
CC#CC1C2OC2C1C,0.2855
Cn1cc(cc1N)C#C,0.2085
CC1=CC(CO)CCC1,0.2582
c1c2c(co1)OCC=C2,0.1928
CC1C2OC1C(C)=C2C,0.233
CC1(N)C(O)C1(N)C#N,0.2462
CC(=O)C1(CNC1)C#N,0.2091
OC1C(OC11CC1)C#N,0.2527
OC(C=O)C12CN(C1)C2,0.1889
OC1CN2C=C(O)C=C12,0.219
CCC12CC(C1)C21CO1,0.3421
CN1C2C=CC11CCC21,0.2057
CC1OC11CC=CC1O,0.2482
CNC(=O)CN=COC,0.2494
CNC(=O)CC(O)C=O,0.1936
CN1CC1C1COC1=O,0.2453
Cc1c(cn(n1)C)NC,0.2177
C#CCCCC1CCC1,0.315
CC1C2C(C=O)N2C1C,0.2021
CC1(CNC=O)CCO1,0.2781
CC1OCC=CC11CC1,0.2516
OC1CC2OC3C2OC13,0.2905
C#CC1C2CC1O2,0.2761
OC1CCOC(=O)NC1,0.285
N=C1OCC2=C1NC=N2,0.2116
CC12CN(C1)C1COC21,0.3023
CC1C2C3CC=CC2C13,0.2481
OC1C2CCC1O2,0.3113
CC1CC23OC4C2N1C34,0.2814
NC(=O)C1COCCN1,0.2283
CC(C#C)C(CO)CO,0.2976
CNc1c(coc1N)N,0.2212
C1C2CC11OC1CC=C2,0.248
CN1CC(=O)COC1=O,0.2117
CC1COC2COC12C,0.3163
CC1C2N1C1(C)CC21C,0.2892
CC12OC3(C)C1CC23,0.3192
CC1C=CCOC1C#C,0.2641
CC12CC(CC1O)O2,0.3122
CC(C#C)C1=CC=NO1,0.2435
CN1C2CC3NC3(C)C12,0.3078
C1C2C1N1C3C=CC1C23,0.2163
CC1C2C(C#N)N2C1=O,0.2275
COCC1CC=CC1=O,0.1908
C1C2=C(CO1)COC2,0.2477
OCC(CC#C)C#C,0.2831
CC1(CCC(=O)C1)C#N,0.2224
CC12CC3C4C(CC13)C24,0.3504
c1[nH]c(c(n1)CO)O,0.2379
CC1C2OC1C2C(N)=O,0.2506
COC1(CC1)C#C,0.2797
CC1=CC2CC1(C)O2,0.2342
C#CC#CCC(=O)C#N,0.1659
OC1(CC1)C1OCC1=O,0.2212
CC1=NCCC(O1)C=O,0.2112
CC1CC(C=O)C2OC12,0.2228
CC(C)C1(NC1C)C#C,0.2741
CC(N)(C#N)C1(N)CC1,0.2744
O=CC12CN3C1C(=O)C23,0.1966
N=C1COCCCCO1,0.2719
CC1C2CC1C2(C)C#N,0.3286
CC1=CCC2OC(=O)C12,0.2436
CC1CCN2C=CC=C12,0.2429
CCOCC1(CCC1)O,0.3279
CC12C3C4N=C1NC2C34,0.163
CCC(O)C(C=O)C#C,0.2156
CCC1C(C(C)O)N1C,0.2857
CCOCC(O)C1CO1,0.3396
NC1C(O)C2NC12C#N,0.2479
CCC1CCC(=C1)C#C,0.2083
CC12CC3OC1C23C#C,0.2527
OCC(=O)C1CC1C=O,0.2022
Cc1c2c(co1)nco2,0.1882
CC1=CN2C(CC2=O)C1,0.213
CC1=NC2CCOC2O1,0.2758
CC1C2OCC12C(C)=O,0.2229
OC12CC1CC2C#N,0.2989
CCC12CC1CC2,0.3313
CCCc1[nH]c(=O)[nH]n1,0.2434
CC(C)C1(O)CC(C)C1,0.317
CNc1coc(n1)N,0.2233
C1C2OCC3OCC2C13,0.3168
CN1N=NC(F)=NC1=N,0.1647
CC#CC(=O)C1CCC1,0.2043
CC#CC(C)C(F)(F)F,0.3046
C1C2CC3OC2OC13,0.348
CN=c1ccnco1,0.1762
CN1CC1CNCC#N,0.2555
CN(C)C(=O)CO,0.2698
CNC(C=O)C(C)=O,0.1861
O=CC1OCC(O1)C#C,0.21
CC1CC2OC(=N)OC12,0.3081
CC(C#C)(C#C)C(=O)N,0.259
O=C1CC2CC1C1CN21,0.2208
CC(C)C(C)OCC#N,0.2941
CC1OC(=O)CNC1=N,0.2439
OC1(CC1)C1CC2CC12,0.3197
COC(=O)C1C(C)C1O,0.2426
OC1CN2CC2C11CO1,0.2846
O=CC1C2CC1C=CC2,0.2134
CNC(C)(CO)C#N,0.2665
OCCC(OC=N)C=O,0.214
N#CC12OCC1C1CC21,0.2634
CC1=CC2(C)NC2(C)C1,0.2407
CCC(=O)CC(C)CO,0.2349
OC1C2COC(=O)C1O2,0.2433
c1c(nc(c(n1)N)N)F,0.1762
CCC12CC3C1N3C2=O,0.2474
N=CN1C(=N)C=CC1=N,0.1641
CC1(C)C2OC2CC1O,0.3358
O=CC1=CCC2CC1O2,0.1821
CCC(CC1CO1)C=O,0.2275
CC(O)C(O)CCC#C,0.3085
CC(=O)Oc1ncco1,0.235
c1c(oc(=O)[nH]1)N,0.2378
CC#CC#CCCC=O,0.2028
CC1CCNCC1=O,0.2106
CC#CC12CC(O1)C2=O,0.228
OCC1C2C3C4C2C1N34,0.2955
OC12CC3C(C1)N3C2,0.2926
CCc1c([nH]c(=O)o1)N,0.2354
C1CC=CCC(=O)C1,0.2156
CC(C)(C=O)OC(=O)N,0.2261
CC(C)(CCCO)C=O,0.2292
CC12CN1CC2=NO,0.2345
C1c2c(oc(=O)o2)CN1,0.2507
CCC1CC2(C)CC12,0.3298
CC1=C(CC(=O)N1)C=O,0.1805
CC1C2C3C2C2(CO2)C13,0.3504
N=C1NC(=N)C2CC1O2,0.2406
CC1OC11CC(O)C1C,0.3087
CC12CC1(CO)C(=O)N2,0.2527
O=C1CNC2C3CC12O3,0.2043
OC12C3OC1C3C2C#C,0.2692
CC1CC(=O)C1(C)O,0.2179
CCc1c(coc1C)C,0.2329
CCOC1CNC1C#N,0.2643
C1CC(=O)CNCC1=O,0.1898
CCCC1C(C)N1C=O,0.2553
OCC12CC3C(C1O)N23,0.2916
CCC(CC)C(=O)CC,0.2307
CN1CC(C1)(C#N)C#N,0.2399
OCC1CC(CO)C1,0.3335
CCC(O)C1(CN1)C#N,0.2868
C1CC2N=COCCC12,0.263
C1C2CC3CCCCC123,0.3344
OC1COC(C#C)C1=O,0.2105
CC1(COC(=N)N1)C=O,0.1952
OCCC1CC(C1)C=O,0.2264
CC12C(O)C1OC21CC1,0.2887
CC1C2CC1(C)C21CO1,0.3396
CCC1OC(=N)C1C,0.2886
O=C1CC23CC2(C1)OC3,0.2105
OC1C2OC1C1CCC21,0.3264
CCCC(=O)CCOC,0.2346
CC(O)C1(C)OCC1C,0.305
CC1(OC2C(O)C12)C#N,0.2644
OCC1=CC2C3OC1C23,0.2263
O=C1OCC1CCC#C,0.2693
CCC1C2C3CN3C12C,0.2842
CC(O)C1(C)CCC1,0.3249
CC1=NC2CCCC2O1,0.2703
CCOCCCN1CC1,0.3195
CCN=C1CCO1,0.2782
CC1NC1C1=CN=CO1,0.2298
O=C1CC(CC#N)CO1,0.2772
CC1C=CC(O)C1O,0.2591
CC1(C#C)C2C3CC2C13,0.301
CC1=CC2CC1(C2)C=O,0.203
O=C1OCCC1C1CO1,0.2739
O=C1C2C3OC4C3N2C14,0.2082
c1cc(oc1C#N)N,0.1844
CC(C)(C)COCCO,0.3288
O=CCC1CCC1=O,0.2155
COC1C2OC2C1C=O,0.2152
Cc1nc2c(o1)nno2,0.1879
CC1=CC(=O)CC1(C)C,0.1923
CNc1cc(no1)CO,0.2207
CC(=O)C12CCC1(C)N2,0.2047
CN1C2CC3(CCC3)C12,0.3105
N#CC1CCOC1C#N,0.302
COC=NC(C)C1CN1,0.2546
NC(=O)N1CC=CC1=N,0.2016
CNC=[NH+]C(C)C([O-])=O,0.2398
CCC1(C#C)C2CCC12,0.2903
CC(C)(C#C)C(F)(F)F,0.3156
Cn1c(c(nc1N)O)O,0.2156
CC1OCC(=C1)C1CC1,0.2415
CCC1(CC(=O)C1)C,0.2218
OC1CN2C1COC2=N,0.2719
OCCC12COCC1O2,0.3268
C1CC12CC=CC(=O)N2,0.2004
O=CC1CNC(=O)CO1,0.2022
O=C1OC2CC3C2C13,0.2678
CC1C2COC1C(=O)N2,0.2508
OC1(C=O)C2C3CC1N23,0.2187
N#CC12CN1CCC=C2,0.2329
ON=C1C2CN2C1C#C,0.231
CC12OC(C3NC13)C2O,0.2856
C1CC=CC=CCOC1,0.2236
CCC(O)(CC=O)C#N,0.2236
N=C1NCC(C#N)C1=O,0.1841
CC1OC1CCC(C)=O,0.2346
OC12C3CN4C(CC14)C23,0.3041
C#CC12COC1CC=C2,0.2573
C#N,0.3796
OCCC1CC2C(O)C12,0.2786
COC1(C)C2OCOC12,0.3022
CC12OC3C4C3C1(O)C24,0.2868
Cn1c(cnc1OC)N,0.2417
Cc1nc(co1)CCO,0.2387
C1C=CCC(=O)CC=C1,0.2001
CC(=O)C(C=O)N=CN,0.199
CCOC1CC2OC12,0.3272
CC1OCC2(C)C1N2C,0.3046
C1NC11CC2CN3C2C13,0.2988
C(c1c(nn[nH]1)N)O,0.2156
CC(=O)CC(F)(F)F,0.2351
N#CC1OC2OC1C=C2,0.247
NC(=O)NC(CO)C#N,0.2861
NC1=NNC(OC=N)=C1,0.2077
CC1CC2CC(O)C1C2,0.3264
OCC1=NC(=N)C=CN1,0.1947
CC1CC(O)C=C1C#C,0.2071
CCCC1OC1(C)CC,0.3422
CNc1cn(nc1O)C,0.2118
CC1C2(C)CCC12C=O,0.2217
CCC1=CCCOC1,0.2602
CCn1cccc1O,0.24
CC1=CC(=O)C2CC12C,0.1885
N=C1OC(=O)N=CN=C1,0.1788
COC1C2CC1(O2)C#N,0.2522
CCOC(C)(C)CC=O,0.2227
O=COCCC1CCO1,0.2695
C#Cc1c(c(c[nH]1)N)O,0.1887
CC1OCC1OCCO,0.319
OC1(C#N)C2NC2C1=O,0.201
CC1(CNC1=O)N1CC1,0.2493
C1C2C3CC4CC(C34)N12,0.2922
C1NC2COC1OC2,0.289
CC1(O)COC1(C)C=O,0.2104
OCC1CC2CC(C2)O1,0.3231
C#CC#CCOCC#N,0.217
COC1C(CO)C1C=O,0.2179
CCOCC1C(C)C1C,0.3261
Cc1[nH]c(c(n1)C#C)N,0.2088
OCC1OC2CCC12,0.3066
O=C1CC2C(O1)C2C#N,0.2765
O=CN1CC1C(=O)C#N,0.1639
CC12OC1CC21CO1,0.3289
OC1C2CNCC(=O)C12,0.1952
CC(=O)C12CC1C(=O)N2,0.215
CC12C3OC4CC1C4C23,0.3077
O=C1NCC1C1CCC1,0.2795
CCC12OC3(C)C1OC23,0.3007
CC1CN(C=O)C(=O)C1,0.2156
c1nncn1C(=O)C=O,0.1596
OC1(CCC11CO1)C#C,0.2742
CCn1cc(nc1O)C,0.2485
CC1C=C2CCN2C1=O,0.207
OC(CC#N)C1CCC1,0.3146
OCC1=CCCC1C#N,0.2586
CC(OCC1CO1)C#C,0.2948
CNC(=O)C(C#C)C#C,0.2631
CC1=NC=C(F)C(=N)O1,0.181
C1c2c(n[nH]n2)N=CN1,0.1994
c1(nc([nH]n1)O)C(=N)N,0.2136
COC(C=O)C#CC=O,0.182
C#CC1=NC(CN1)C#N,0.2047
C(=O)n1c(=O)oc(n1)O,0.2203
c1c([nH]c(c1O)O)CO,0.2154
CC1(CO)NC1(C)C#C,0.2712
OC12CC1C(C2)C1CO1,0.3337
OC1C2OCC=CC12O,0.2267
COC1(CO)CC1(C)C,0.3081
COC1OCC(=O)C1=O,0.1356
CNC1=CC(=O)OC1,0.2184
CC(O)C12C3CC1CN23,0.2994
C1CC1C(C2CC2)O,0.3364
c1c(ocn1)NC=N,0.2375
C#CCN1C2CCC12,0.287
CC(=O)C1(CC1O)C#C,0.208
CCNC(=NC)C#N,0.2033
CC1=CCCC1(O)C#C,0.2517
NC1=[NH+]C[C-](C=O)C1=O,0.1393
CCC1COCC1C#C,0.3019
O=C1CC=CC2CC1C2,0.2215
CN=C(N)C1(CO1)C#N,0.2389
C1C2OC1C1OC2C=C1,0.2204
CCNC(=O)C1(CC1)C,0.2753
CC1NC11CN2CCC12,0.2778
CN1CC1(C)CC(N)=O,0.2563
CC1N(C)C(=O)C=C1C,0.2111
CC1COCCO1,0.329
CC12C3C1C1=NC2C3O1,0.2179
CC1CC2CC12C1CO1,0.3233
NC1=CC(=O)NC(=N)C1,0.2001
CC12CC1(C#N)C1NC21,0.2699
CC1OCC=CC(=O)O1,0.2191
O=CCC1CN=CO1,0.2222
CCCC1NC1CC=O,0.2206
CCC1C2CC1(C2)OC,0.3296
OC1CCC2=C1N=NO2,0.1757
OCC12C(O)C1C1CN21,0.2806
Cc1c(=O)n(ccn1)C,0.1721
C1C(CN1C=O)C(=O)N,0.2515
CC1(CO)CC11CCO1,0.2992
N#CC1CC2OCC=C12,0.2307
CC12C3CC(C13)C2(C)C,0.3266
N=C1NC(C#N)C1C=O,0.2257
O=CC1NC1C1CC1,0.2211
CC1C2C=CC1C2(C)C,0.2345
CC1C2C3NC3C12,0.2763
CC1OCC(C)(C)C=C1,0.2643
c1nc2n(n1)C=CCO2,0.1999
CC1C2CC3C2C13C,0.3353
c1cncc2c1OCO2,0.2128
C1CC23COC(CC12)O3,0.3267
COC(=O)C(=O)C(=N)N,0.1849
CCC1C(C)COC1=N,0.2838
CC1OC11CCCC=C1,0.251
CC1CC(C)C(=O)N1C,0.2703
OC1=C(F)NC=CC1=N,0.1827
NC(=O)C1C2CC1CC2,0.2687
O=CNC1C=CC2NC12,0.2335
O=CCC1C2C=CC1O2,0.2149
CC12CC3C1C3(O)C2,0.3209
O=C1CC2CC1O2,0.2137
CCC1OCC1NC=O,0.2738
CC(C)COC1CC1,0.3312
OC1=C(F)C=NC(=N)N1,0.1576
CC12C3CC3C1C2C#N,0.2529
CN1C(=N)NCCC1=O,0.2352
CC1CC2(CC2)C1C#N,0.3073
CC1OCC(=N)OC1=O,0.2471
C#CC(C#N)C1CN1,0.2657
OC1CCC1NCC#N,0.2617
CNC1=CC(=O)NC1=N,0.1678
C1CC2=CCOCC12,0.2563
O=CNCC1CC2CN12,0.2778
CC1(CN(C(=O)O1)C)C,0.3019
OC1C2CC11CCOC21,0.3201
O=CC1CCCC11CC1,0.2265
C#CCC1=CCOC1=O,0.2294
CC1CC(=O)C(C)CO1,0.2227
CC(CO)C(=O)NC=O,0.218
CC1OC1(CCO)C=O,0.219
CC(=O)C(CO)NC=O,0.2293
CC1OC1C(=O)N(C)C,0.2553
COC1CCC2(C)CC12,0.3266
Cc1nn2c(o1)nnn2,0.2449
C(CCC(=O)N)CC#N,0.2796
CC1CC(CO)C1=O,0.2176
CC1CC2COC1CO2,0.316
CC(C)C(CO)CC#C,0.3108
CN1C2CC1(C)C2O,0.2696
C1C2NC2C11CCCO1,0.3087
C1COC(=O)C=CCO1,0.1896
COCC1CC(C)(O)C1,0.324
CC1CC2=COC=C2N1,0.2168
Cc1conc1C(=O)N,0.2202
c1c(c(c[nH]1)C=O)C=O,0.1864
c1c(cncn1)CC=O,0.2049
CC1CCCCC=C1,0.2565
CC1(C)CC2(NC12)C#C,0.2545
CC1C2C(N2C)C1(C)O,0.2889
COCC1=CNC(=N)O1,0.223
CC1C2CC2C1CC#N,0.3086
OC(C1CN1)C1CC1O,0.2848
CCCC1(CN1)C=O,0.2234
C1CN1C12CC1CCC2,0.2983
CC1C2CC3CC3C12,0.3117
C1CNc2c1non2,0.2068
c1c(c(c[nH]1)N)CCO,0.2261
OC1CC1(C#N)C1CO1,0.2957
CC12OC34COC(C13)C24,0.2996
C1C=C(CC(=O)N1)C=O,0.1821
CN1C2C3CC2C13C#C,0.2409
OC1COC2C3OC3C12,0.305
OC1C(O)C11C2CC1O2,0.2656
c1cncnc1NC=O,0.2023
OCC12C3CC(C1O)N23,0.3166
OC1C2OC11COCC21,0.3071
CC1CN2C(CC=O)C12,0.2093
CC12CC3N1CCC23O,0.2947
CC1C2C1C1=CC=NN21,0.2348
C#CCCCC1CO1,0.3146
OC1(CC#N)C2CC1C2,0.3132
COC1COCC2OC12,0.3197
C1C=C(CN=CO1)CO,0.2332
CC12C3CC(C1O)C23O,0.2984
CC1=CCC2CC1CO2,0.2561
c1c(nnc(n1)N)CO,0.167
COC1C(C)(O)C1(C)O,0.2948
N=COC1C2CC=CC12,0.2405
CCC1(COC)OC1C,0.33
NC1=CC(=O)NC2CC12,0.209
C1C2C1C1CC2CCO1,0.3179
O=CC1=CC2NC2C1=O,0.1531
CC12OCOC1C1NC21,0.2958
c1c(ncnc1F)N,0.2253
CC1C2CC(C=C2)C1=O,0.2041
c1c(nc(=O)[nH]n1)C=O,0.1447
CC1C2(CC2)CC13CC3,0.34
CC1CC(C)(C#C)C1O,0.2892
CC1CC2C3NC3C12O,0.2912
CC(=O)CC(=O)NC=N,0.2157
CC1C(NC1C#N)C=O,0.2123
CC1C2C3CC1(C)C23O,0.2974
C#CC12NC1CC21CC1,0.2497
CC12NC3C1OC23C,0.2998
CC1OC1C1(CN1)C=O,0.2221
CCn1nnnn1,0.273
CCC(C)(C)CCC=O,0.2295
CC1(O)C2CC1(C2)C=O,0.2132
OCCCC1(CN1)C#C,0.2873
COC(C)=NCC1CO1,0.2726
OCCC12CN1CC2O,0.2919
CC1C2CC=CC12,0.2465
OC1CN(C=O)C1=N,0.2236
C1C(COC(=O)O1)C#N,0.3014
OC1C2C3C1NC23C=O,0.2035
C1OC2OC=NC1C=C2,0.2341
OC1C2C3CCC1N23,0.2969
CC1C2C1C1C(O)CC21,0.2955
CC1OC2C(NC12)C=O,0.2008
OCCC1CC(=N)O1,0.2891
C(CO)C(=O)C#CCO,0.2101
CC12C3CC4C3C1OC24,0.317
CC1NC11C2CC2C1=O,0.2267
COC1C2OC2C1O,0.3136
CC1=C(CC2OC12)C=O,0.1848
OC1CC(C1)C#C,0.3022
CC(=N)NC(=O)C1CO1,0.2207
O=C1CCC(C1)C1CC1,0.2216
Cc1c(ocn1)C(C)C,0.2381
OC(C#C)C1CN1C=O,0.2528
CC12OC(C)(C)C1C2O,0.302
CCC1NC1C(=O)OC,0.26
Cc1c(cco1)COC,0.2356
CCC1(CO)CC1C,0.33
OC1C2OCOC12,0.3079
c1c(nco1)C(=O)CO,0.2034
CC(C#C)N1C=CN=C1,0.2479
OC1C2CN=COC12,0.277
CC(C=O)(C=O)C(=O)N,0.1996
O=CC12CC1CC21CC1,0.2194
C#CC#CC12CCC1N2,0.212
C1C=CC23NC4C2NC134,0.2167
CCOc1nc([nH]n1)N,0.2497
CC1=CC2C3C1CC23O,0.2266
CC#CC12CC(O)(C1)C2,0.2889
CC1C2CC2(O)C=C1C,0.2366
N#CC1CCC11CC1,0.3107
CC(=O)C1C2CC(=O)C12,0.2064
OC1(C2CC2)C2COC12,0.2861
C(CO)c1[nH]c(=O)on1,0.2552
C#Cc1cc([nH]n1)C#N,0.2026
CC1C2CC3CC3C12C,0.313
CN1CC1C1=COC=N1,0.2163
N=C1OCC(=C1)N1CC1,0.2086
CC12NC1C1(C)OC21,0.2794
C1CC1C12NC3C1NC23,0.2857
C[NH2+]CC1=NOC=C1[O-],0.2166
CC([NH3+])C1=C([O-])OC=N1,0.1795
NC1=CC(O)=COC1=N,0.156
OC1C2OCOC(=O)C12,0.2515
CCC1C(O)COC1=O,0.2755
OC1C2OC(=NC12)C#C,0.2071
CCC1(CC(C)O)CO1,0.3289
CCC1(C)CCCO1,0.3171
CC(N=C1CCO1)C#N,0.2725
CCOC1C2C3CC1C23,0.3284
CC(O)C1OCOC1C,0.3156
CC1=CC(O)C2COC12,0.2486
C1CC2OC(C1)C1OC21,0.3154
C1OC2CC1C1NC21,0.3139
CC1=C(CCN1)C=O,0.1776
CNC(C)(C#N)C(N)=O,0.267
C#CCC1CC2CCC12,0.3103
CC1OC(=N)C1O,0.2836
c1[nH]c(c(n1)C#N)CO,0.2248
CC1C2C3C(C)C1CN23,0.3135
CN1CCc2c1onc2,0.2087
CC1OCC1(O)C(N)=O,0.2661
CN1C=NC(O)=CC1=N,0.1785
C1CC1CCC(=O)N,0.2787
CC(O)C1OC2CC12C,0.2971
c1c(non1)CC#N,0.2607
C#CC1CCC(=O)CC1,0.2236
COC(C)C1CC2CN12,0.3115
C#CC1CC2C3CC3C12,0.2822
CC1C2N3C(C)C2(O)C13,0.3118
C1CC23COCCC12O3,0.3205
CC[NH+](C)CCC([O-])=O,0.2767
N=C1NC2=C(O1)C=NN2,0.2162
CC#CC12OC3CC1C23,0.2438
CCc1cc(ncn1)N,0.2201
c1(c(oc(=O)[nH]1)N)N,0.2392
CC1=COC(=N)C(F)=C1,0.1673
C1CNc2c1noc2N,0.2057
CC1OC1C(O)C1CO1,0.3362
CC1=NOC(=N)O1,0.2444
CC1NC1(C#N)C(C)=O,0.2313
CCC1C(O)C1OC=O,0.2505
C1C(CO1)CC(=O)N,0.2637
CC1(O)C2C3N2CC13C,0.2929
OC12C3C1N1C3C21C=O,0.183
CC12CC3(O)C4C(C13)N24,0.2902
CCC12CCC1C(=O)N2,0.2691
N=C1OCC2CC12C#N,0.2741
C#CC12CCC3C1CC23,0.2962
CC1COC(C#C)C1=O,0.2115
CC(OCCC=O)C#N,0.2283
CCC1(C)CN1C(C)=O,0.255
OC1CC2CC1NC2=O,0.2632
c1ccnc(c1)C#N,0.2139
CC(C)C(=O)C1CN1C,0.2006
CCNC(=O)C1CC1C,0.2735
c1c2cncnc2n[nH]1,0.1805
CC12OCC1OC2CO,0.2998
OC1C2C3CC1(C#N)C23,0.2836
CC1(C)C2CC1(C)C2O,0.3306
CCC#CC(C)C1CC1,0.2999
CCn1cccnc1=O,0.179
CC12CC3CC1C1C2N31,0.3283
C(C(CN)(C#N)N)N,0.2751
CC1OC2CC3C1N3C2,0.3061
CCCCCC(C)CO,0.341
CN1C2C=CC1C2=O,0.2383
OC(CCOC=N)C#C,0.282
c1c2c([nH]cn2)[nH]c1O,0.2142
c1cnc(c(n1)CO)O,0.1945
CC1OC2C1CC2(C)O,0.3039
CC1(CO)OCC1=NO,0.2428
CC1NC(CO)C1=O,0.2168
CC(=O)N(C)C(=N)OC,0.2416
CCC12CC1CCO2,0.3104
CC#CC(C#C)C1CC1,0.2883
OC1(CC1)C1C2CCC12,0.291
C#CC1OCOC2CC12,0.2847
CC12CC(N)(C#N)C1O2,0.2905
CC1N2C3CC1(O)C23C,0.2955
C1C2C3COC=NC1C23,0.2505
CC1=CC(=CN1)C1CN1,0.2352
CCOC1CC(C)C1=O,0.2002
N=C1OC(=O)C2CC12,0.2518
OCC12CC1C(O2)C#C,0.2637
CC(=O)OC(=NC)C#C,0.224
CCC1(C)CCCC1=O,0.2168
CC1(N)C(C#N)C1(C)N,0.2624
C#CCCN1CC(=O)C1,0.2094
C#CCCc1cnon1,0.2276
CC(NC(N)=O)C#C,0.2877
OCC12CCC1CC=C2,0.2535
C1C(O1)(CC=O)CC=O,0.2127
CC1(CC1)CCC#N,0.3211
COC12CC1C(=O)CC2,0.2253
OC1COCOC11CC1,0.332
COC1(C)CC(=O)CO1,0.223
CCC1=CCC2OCC12,0.2572
CCCC1NC1COC,0.3236
CCOC1CC1CO,0.3343
CCOC1C(O)C1C=O,0.2225
CC1C2CC(C=O)N12,0.207
Cn1c(c(nn1)N)C#C,0.1833
C1OC11C2C3CCN2C13,0.3239
c1c2c(c[nH]1)OCCC2,0.2302
c1c2cnnn2ncn1,0.1762
CC1CCC11CC=CC1,0.264
CC1CC11COC1C#N,0.2711
OC1(CNC1=N)C1CO1,0.2641
CC1C2(C)C3NC3C12C,0.2776
N=C1CC(=N)OCO1,0.2757
C1C2OC1C1OC21,0.3116
CCc1c(c[nH]n1)C#C,0.2261
N=C1OC=NO1,0.2413
Cc1cocnc1=NC,0.1995
O=C1NCCC1C1CN1,0.2619
OC1C2CC3(O)CN2C13,0.2857
c1c(c([nH]c(=O)n1)N)N,0.179
CC12C3CC4C1C4(C)C23,0.308
C1C(=O)NC(=O)CN1,0.2224
CC#CCC(=O)C(C)C,0.2188
CC1=CCc2n1ncn2,0.2098
Cc1c([nH]c(n1)OC)N,0.2457
CC1CCC(C)(C1)C#N,0.3475
CCc1c[nH]ncc1=O,0.1884
OC1C2OC2C(O)C1=O,0.2268
O=C1CN2C3C2C2C3N12,0.2062
N=COC1=NON=N1,0.2142
CC1(C)CC(O1)C=O,0.2119
OC(C#C)C12CC1OC2,0.2594
CCNC1=NCC(=O)N1,0.2356
COCC(C#N)(C#N)O,0.2761
COC1(CN=CO1)C#C,0.2749
CCC1OCC(=N)O1,0.2888
CC12CC(C1)NC(=O)N2,0.2886
OCC1(CO)CCC1O,0.2953
CC(=NO)C(CO)CO,0.2504
CC1(C)CC(C=C1)C#C,0.262
FC(F)(F)C1(CN1)C#N,0.2982
OCC1CCC=C1CO,0.2592
CC12CCC3CC1C23,0.3412
CC1(O)COC1CO,0.3023
CC1CC1(C)CO,0.3343
COC1CC2CC12C=O,0.2199
CC(O)C1CN1C=O,0.261
O=CC1C=CCC1C#N,0.2087
CC(CCO)C1CC1,0.342
CC#CCCC1OC1C,0.3045
OC1=NC(=N)OC=C1,0.1818
CC1CC1COC1CC1,0.3328
CC1OCC(=O)C1C=O,0.2145
CC1OC2(CC2)C1C,0.3061
OC(C=O)C1=CC=CO1,0.1814
COCCC(O)C=O,0.2172
CC(OC1CC1O)C#N,0.2518
CC#CC(C#CC)O,0.2644
CC(=O)CC(O)CC#C,0.2289
C1C2OC3C2CC=CC13,0.2498
CCC1C2CC2C1(C)O,0.3143
COC12CC1(O)C(O)C2,0.289
CCC1(C)COC=NC1,0.2708
Cc1c(c([nH]n1)C=O)N,0.164
CC1(O)C(=O)CC11CN1,0.2108
Cn1cnc(n1)COC,0.2576
COCC#CC1(CC1)O,0.2694
COC1(C)CCC11CC1,0.3297
CC1(C)C2(C)COC12C,0.3004
Cc1c(nc([nH]1)C#N)N,0.1744
CC12CN=C(N)C1O2,0.2466
CC12CC1C=CC(=O)O2,0.2104
C#CC12CN1C1CC1C2,0.265
CCC1OC11CNC1=N,0.2515
OC1CC2C1CC1CN21,0.2925
CCNC(=O)CC(C)C,0.2769
CCC1(C)CC(C)C1=O,0.2154
Cn1cnc(nc1=O)F,0.2126
CCC1OCC(C=O)=C1,0.1818
OC1C2(O)COC12C#N,0.2396
NC1=CC=NNC1=N,0.1675
CC1=CCOCC1CO,0.2594
OC12CN3C(C13)C21CC1,0.2894
CC1C2C3NC3CN12,0.2812
COCC1=CCC2CC12,0.2484
OCCC1(O)C2CC1O2,0.3247
CC1(C#N)C2OC(=N)C12,0.2576
OC12CC3(C#N)C1NC23,0.2673
c12c(onc1nno2)N,0.1472
CC(C)(CCNC=O)O,0.281
OC12COC(C1)OC2,0.3022
O=CC1C(C=O)C1C#C,0.2071
C1CC2(O1)C1OC=NC21,0.2307
OCCC12CC(O)C1N2,0.3112
O=CCC12C3C4C3C1C24,0.2065
C1OC2=NCCCNC12,0.2502
CCC1(CC)CC1(C)O,0.3147
CC1COC(=O)C1=NO,0.1975
OC1CCC(=O)CC1=O,0.2127
CCC#CC(C#C)C#C,0.2857
O=C(C#N)C#CC1CO1,0.1866
NC(=O)NC(C#C)C#N,0.2697
CC(C)c1nc(no1)N,0.2319
NC1C(C#N)C1(O)C#C,0.2398
OC(CC(O)C#C)C=O,0.2049
CC(=O)C1(CO1)C#N,0.2244
Cc1cc(oc1CO)C,0.2224
OCC1(O)C2CC2C1O,0.2825
CN=C(COC)OC,0.2605
C1OC2C3NC3C=C12,0.2304
CCc1c(n[nH]n1)O,0.234
O=C1CNC2CC2O1,0.247
OC1CC2CCCC=C12,0.2507
CC1OC(=N)C=C1C,0.2159
CCCc1cc(co1)O,0.2235
C(=Nc1noc(=O)o1)N,0.2048
COc1coc(c1O)N,0.2187
CC1OC2C1C21CCO1,0.2761
C1CC12CNC(=O)CO2,0.266
CC1C2CCC2N1C=O,0.2625
CC(C)c1cnncn1,0.1687
CC1CC(=O)C1C(N)=O,0.221
O=CCC(C#C)C1CO1,0.2318
CC1(O)C2COC2C1=O,0.1901
C(N=C1CCO1)C1CN1,0.2557
C1CC2C3OC2C3C=C1,0.2396
CC1C(O)C1(C)C1CO1,0.321
c1c(coc(=O)n1)C#N,0.1772
NC1=C(N)C(=N)N=NO1,0.1257
CN1CC2(O)C3OC3C12,0.2665
CC1(O)CC2CC12,0.3208
CC1CC11CCC(O)C1,0.3299
C#CC1OCC2CCC12,0.2891
CC12C3CCC1CCC23,0.326
CC1NC1C1=CNN=C1,0.2477
c1c(c([nH]n1)CC=O)N,0.1818
CC1OCC11CNC1=O,0.2721
CC1C2COC12CCO,0.3056
Cc1c(c(on1)N)N,0.2273
CCc1cc(oc1C)C,0.2267
CC1(O)CC2COCC12,0.322
CC(C#N)C1OC2CC12,0.2819
OC(CC=O)CC1CC1,0.2223
C1OC2C1NC21COC1,0.2944
N#CC1C2C3CN1C23,0.2566
CC1CC(O)(CO1)C#N,0.2804
N=C1NC(=O)C2NC12,0.2304
CC1C=CC2CC12,0.2472
C#CC(CC=O)C#C,0.2211
c1c2c(ncn1)CC=C2,0.1979
OC12CC1C=C1COC21,0.2246
CCN(C)c1cocn1,0.1996
CCC1CC11CCCC1,0.3427
O=C1CC2OC1C1NC21,0.2143
CC1=NCC=CCO1,0.2504
Cc1c(nco1)NC=O,0.2108
CN1C2CC(C)(C)C12,0.3054
CC1C(O)C2(C)OCC12,0.3045
CC12C3COC1C(=O)C23,0.2187
OC1CCN2N=CN=C12,0.2635
CCN=C(C)OCCO,0.2748
CC(C)Nc1ncon1,0.2186
CC1NC1C(=O)C(N)=O,0.1702
CC1OC2COCC=C12,0.2508
OC12C3CC(=O)C1NC23,0.2093
C(C1CC1)C1C2CC1C2,0.3642
CC1CC=C(C)CC1O,0.2614
OC1C2OC1(C)C21CC1,0.323
CC1=CC(O)C2(C)CC12,0.2385
CC1C2CNC(=O)C12,0.2678
COC(COC=O)C#C,0.2857
CC1CC(O1)(C=O)C#N,0.2069
OC12CC3C1CCC3C2,0.3263
CC1(CN1)C1(CN1)C=O,0.218
c1ccc(c(c1)CO)N,0.2105
C#CC1=CCCC11CO1,0.2073
CC(C)OC(C)C1CN1,0.308
C1NC1C1CC2(CC2)O1,0.2946
C1OC2CCN3C1C23,0.3219
CC1OC(=N)CC2CC12,0.2825
C1N=C2OC3C4OC13C24,0.2073
CC1NC(=O)C=C1N,0.2211
OCC1C2COC(=N)N12,0.2748
N#CCCC#CC1CO1,0.2698
O1N=CC=C2N=CC=C12,0.1403
O=COC(C=O)C#N,0.2182
COC(C#N)C(C)=O,0.2319
CCC(O)CC(C)OC,0.3191
OC12C3CC1CCC2C3,0.3066
CCC1C2CC=CC12,0.2455
CC1OC2COC12C#C,0.2561
NC(=O)C1CNC1=O,0.2594
CCC(C)C(=O)NC,0.2782
CC1(C)C=CC2CC12O,0.2453
O=C1CNCCC2OC12,0.1985
C1C(=CNC(=O)O1)CO,0.2239
C1C2OCC11C=CCC21,0.2431
OC1=CNC(=N)OC1=O,0.1664
CC1(COC1C#C)C#N,0.2678
CC1CC2NC2C(=O)O1,0.2495
CC1C2OC2C2(C)NC12,0.3064
N#CC12NC1C1CNC21,0.2366
OC12CN3C1COCC23,0.3073
O=C1C2CC1(CN2)C#N,0.2011
CCC(CO)(CO)O,0.3071
COC12CN3C(CC1)C23,0.2972
COC1C2CC1C2C#N,0.2889
Cc1c(cn(n1)C)O,0.2312
CC1C2OC1C(CO)=C2,0.2348
CC1=CC2CC(O)C2C1,0.2546
CC(C)C12CCC1C2O,0.3145
COC1(C)CN2CC12C,0.3028
CN1C2CC1C2NC=O,0.2397
CCCN1CC1CC#N,0.2709
COC(=O)CCC1CC1,0.2855
[O-]C(=O)C[NH2+]C1CC1,0.2687
CC1CC(CO)C(=O)N1,0.2727
COCc1cc(n[nH]1)N,0.23
CC1C2COC1C(O)C2,0.3162
CCC(O)C1OC2CC12,0.3005
NC1CC(N)C1(O)C#N,0.266
CCC(N)(C#N)C1CC1,0.2914
c1[nH]c(c(n1)N2CC2)N,0.2279
CC1CC1N1CC1(C)C,0.3062
COCC(O)CCC=O,0.23
NC(=O)C1OC1CO,0.2639
CC1CN2C3CC2C3O1,0.3024
O=CCC1CNC(=O)O1,0.2259
CC12CC(O1)C=C2CO,0.2336
NC(=O)C1COC1C#C,0.2482
N#CC12CCC1N=CO2,0.2616
OC1(CC#N)CC1C#C,0.2666
C1OC2C3OC3CC2=C1,0.2462
Cn1ccc(c1)CCO,0.2443
CC#CC1CCCCC1,0.305
CC1OC1C12CCC1N2,0.3247
C(C=O)C(C=O)C=O,0.194
O=COC1(CC1)C1CN1,0.2389
NC(=O)C12CN1CC=C2,0.23
CC1OC2OC1C=C2C,0.2433
CC12C3C4C1OC4C23O,0.2979
CN=C(C#N)OCC#N,0.2347
c1cn(c(n1)O)C=O,0.1879
CC1(CCC1[NH3+])C([O-])=O,0.2713
CC1CN1CC(C)(C)O,0.3095
CC1(CCO)COC1=O,0.2778
CN1CC1C1=CC=CO1,0.226
CC1CCC11CCC1=O,0.2106
N=C1N(C=O)C=CC1=O,0.1605
NC(=O)OC(C#C)C#N,0.2716
CC1CC1(C)C1CCO1,0.3257
CC1(C)CC(O1)C1CO1,0.3255
CC1(C)[NH2+]C1CC([O-])=O,0.2755
CCN1CCN=C1C=O,0.1506
OC12CC3OCC1C23O,0.2953
CN=COC12CC(C1)C2,0.2716
CCC1CCC2CC2O1,0.3216
OC1CC2OC11CNC21,0.2714
CCOC1CN(C)C1=O,0.2569
CC1C(O)C1C(O)C#N,0.2862
c1c(c(c(o1)N)N)N,0.2237
CC1C(O)C23CC(C2)N13,0.2687
CNC(=O)CC(C)CO,0.2793
OC(C#C)C(O)C1CO1,0.2939
COC=NCCC1CC1,0.2693
COC1(CCC=C1)C#N,0.2535
CC(CO)OC(=O)C#C,0.2298
CC1=CC2CC2(C1)C=O,0.2121
CNc1c(n[nH]n1)OC,0.2072
CC12CC3C(CC1O)C23,0.3203
OC1(COC1)C1CO1,0.3158
CC1=C2CCC2C(=O)C1,0.2147
CCC1(C#C)C2CCN12,0.2721
CC(C)(C#C)C(C)(C)O,0.3127
OC1C=CC2(CN2)C1O,0.2341
[NH3+]C1(CC1)C#CC([O-])=O,0.2106
COCCOCCO,0.3345
CC(C)C1CC=CC1,0.2649
C#CCOCCCCO,0.2891
O=CC1(OCC=C1)C#C,0.2058
C#CC1=CC2CC1O2,0.1908
CCC1CC(CCO)O1,0.3228
CCc1cnc([nH]1)C=O,0.1812
N#CC1OCCN=CO1,0.2548
CC12C=CC34CC(C13)N24,0.2107
CCCN1CC2OCC12,0.2873
O=CC12NC3C1C(=O)C23,0.1955
CCC12CC1OC2C,0.3016
COC=NC1(CC1)C=O,0.2129
CC1(C)OC=NC1(C)C,0.2692
OC1C2C3CN3C1C2=O,0.2097
C1c2c(nn[nH]2)N=CN1,0.1995
CC1NC1C1C2CN1C2,0.2927
C1OC1C1=COC=N1,0.2401
CC12CC(C1)C(C)(O)C2,0.3303
CC1=NCCCCO1,0.2546
CCCCCCCC,0.3858
C1CC12CC=CC2=NO,0.188
OC12C3CC1C1C3CC21,0.3184
C1CC1CCC(=O)C=O,0.1559
CC12OC3C1C2C3C=O,0.2124
c1(nnc2n1nno2)N,0.1616
CC12CN1C(=O)C2O,0.2213
CNC(=O)C1OCCO1,0.2585
CC12CC1CC(O)C2=O,0.2118
CCC1OC1C(C)(C)O,0.3145
c1[nH]c2c(n1)CC=CC2,0.2355
NC(=O)C12C3C4C3C1C24,0.2538
O=C1OC23CN4C2CC134,0.2089
CC1CC(O)C(C)=C1,0.2588
CCC1C2C3OC3C12C,0.2834
CC1CC1(O)C1CC1O,0.3036
C1CN=COCOC1=O,0.2452
CC1=CCCOCC=C1,0.2162
CC1OCC2C3NC3C12,0.2959
C1CC23OC4C2C1C34,0.3039
O=CC1=C2CCC2OC1,0.1815
Cn1c2c(cn1)ocn2,0.2131
N#CC1(CC1)C1CCO1,0.2913
ON=C1CC2COC1O2,0.2416
CC12OC(C1O)C2=O,0.2265
CCOC(C)CC(C)C,0.3261
CN1N=CC(F)=NC1=N,0.1574
Cc1c[nH]c(c1C)C#N,0.2073
NC1(COC=NC1)C#N,0.274
CC1CCO1,0.3325
OCCC1OCC11CN1,0.3084
CNC(CO)C#CC#N,0.1972
O=CC1(CCO1)C1CN1,0.2149
CC1CCCCC1C,0.361
CC1OCC=C1CCO,0.2445
CCc1cc(n(n1)C)C,0.2559
C1c2c(nno2)N=CN1,0.1764
CNC1C(OC1=O)C#N,0.2393
CC1C2CC(=O)NC12,0.2658
CCC1CCC(C)(C)C1,0.3729
O=C1CC2CN3C2C13,0.2141
CCNc1ccncn1,0.2081
CC1(C)CC1(C)C#C,0.2913
C1C2N1CCC21CCO1,0.309
CCCC1OCC=C1C,0.2495
CC1NC11C2OC2C1=O,0.2084
CC(O)(C#C)C#CC#N,0.2325
CCC1OC1C#CC#N,0.2242
CCCC1(O)CC1O,0.3174
CCC1=CC2C3OC2C13,0.2228
OC1C2NC2CC11CC1,0.3109
COC1CCCC1C#N,0.2956
CC1(O)COCCC=C1,0.2407
NC(=O)CC(O)C(N)=O,0.2624
C#CC1C2C3CC3C12,0.2554
CC1(CC#N)COC1=N,0.2873
CC1=CC(=O)C2(C)OC12,0.1752
CCC1CC2CC12CO,0.3175
C1C2CC3OCCOC123,0.3174
C1OC23CC4C(C2)C4C13,0.3189
CC1CC2(OC12)C(N)=O,0.2589
CC1C(O)C(C)C1=NO,0.2483
C1C2COC3OC=NC123,0.2515
CCC(CCC=O)C=O,0.2176
OC1COC2(CC2)C=C1,0.2421
CC(C)C1CC2CC1C2,0.3744
CC(O)CC1=CNC=C1,0.2498
CC(O)CC#CC=O,0.2056
CC1(O)C2CC(=NO)C12,0.2374
OC1C2NC1C21CN1,0.3078
CCC#CCOCC=O,0.224
CCC1=CC2(CC2)OC1,0.2263
OC1CC11C2CC1OC2,0.2972
CN(C=N)C(=O)NC=N,0.2336
CC1OC2CCC1(C)C2,0.3091
C1COCOCCC=C1,0.2591
NC1=CC(=O)C2CC12,0.198
CC1=CC2NC2(C)C1=O,0.1784
N=COCC1C2COC12,0.278
CC(=O)NC(=NC)NC,0.213
c1(=O)[nH]nn[nH]1,0.2325
CNC(=O)C#CC(=O)N,0.2055
COCC(C)(O)C1CN1,0.3076
CCC1C2C3COC2C13,0.3253
CCC(O)C(=O)CO,0.2347
C1CN1C1CCC11CO1,0.3021
C1CC2(C1)C=CC1OC21,0.2407
COc1[nH]c(c(n1)N)O,0.2246
CC1=C2CC(O)C2CC1,0.2424
CCC12OC3COC1C23,0.2889
Cn1cnc(c1N)OC,0.2219
CC1OC1CC#CC#C,0.2303
N#CCC12OC1C1NC21,0.2582
CC1(C)CCC1(C)C#C,0.3018
ON=C1COC2COC12,0.2384
CC1COC1C(C)=NO,0.2409
NC1C(NC1C#N)C#C,0.2526
CCC12CC3C1N(C)C23,0.2944
C(C(=O)C(=O)N)OC=O,0.1753
CC12CC1(CCC2)C#N,0.304
CC(NC=O)C1CN1,0.2577
OC1C(NC1C#N)C#C,0.2543
CNC(C=O)C#CC#C,0.185
OCC(O)C1CCCO1,0.3187
CC1COC2CCOC12,0.3229
CC1OCC(O)C(C)=C1,0.2549
C#Cc1cc([nH]c1O)N,0.2089
CC12CC1OC(CO)O2,0.3316
CC1=CCN(C1)C=O,0.2449
c1c2n(nn1)CC=C2,0.1932
CC12NC1C1CC21C#N,0.2439
CC1CCC(O)CO1,0.3215
CCC(C)(O)C(C)C#N,0.3127
c1c[nH]c(cc1=O)C=O,0.1429
C(c1c(oc(n1)N)N)O,0.2155
CCOCC1(COC1)O,0.3155
CC1OC(=O)NC=C1C,0.224
OC1(CCCC1)C1CO1,0.3212
C1CC23C1CN1C2CC31,0.3125
CC(O)C12CC(C1)C2O,0.3296
OCC12CCC1OCC2,0.311
N=C1CC(CO1)C#C,0.2832
c1c2n(c(n1)C=O)CC2,0.1858
CN(C)C12CC1NC2=O,0.2202
CC12CC3C1N3CC2,0.319
CC12C3C1C1(C)CC3N21,0.3115
CCNC(=O)N1CCC1,0.2921
CC1CCC1C(O)C=O,0.2308
CC(=NO)C#CC1CC1,0.1952
CCc1c([nH]cn1)CO,0.2397
C#CCC(C#C)C#C,0.2836
CC1CCCCOC1C,0.3189
COC12CC(O)(C1)C2C,0.3152
COC1=CN=NNC1=N,0.1698
CCCC(O)CN1CC1,0.2972
COc1c(onn1)CN,0.1964
CC1=CC(=O)C2(CN2)C1,0.1947
CC(O)C1NC1C1CO1,0.3146
CC1C2(C)CC1(O)C=C2,0.2394
CNC1CCC=C1C#N,0.1899
CC1C(NC=O)C2CN12,0.2632
CC1(CO)C2CC1(O)C2,0.3167
NC(=O)N1C=CCC1=N,0.2161
CCC1CC(CC)C1C,0.349
c1nc2n(n1)C(=O)CO2,0.2138
CC12C3CN1C(C3)C2=O,0.2216
CNc1ccc([nH]1)O,0.2338
COC1CCC(C1)=NO,0.2493
CC1CCC(O)C2OC12,0.3336
CN1C2C3C1C(O)C23O,0.2617
C#CC1(CO1)C1CCC1,0.2863
CN1C(=N)C=CN=C1F,0.1865
CC(C)(CCO)CCO,0.3304
Cc1c(nno1)N(=O)=O,0.2103
CC1(CC(=O)O1)C1CO1,0.2819
N=C1CC(O1)C=O,0.2222
C1OC1C1C2C3CC1C23,0.3322
N#CCC1CCC2CC12,0.3186
NC1=CC(=N)OCC1O,0.1978
Cc1cc(c(o1)N)NC,0.2064
CN=C1NCC1OC=O,0.2426
CCCC12CC1C(=O)C2,0.2328
C#CC(=O)CNCC=O,0.1739
CCCc1ncon1,0.2665
OC12C3CC1C(=O)C2C3,0.2154
OC1C2C1C(O)CC2O,0.3129
OC1CC2CC1OC2=O,0.2726
CCC(OC=O)C(C)=O,0.2288
CCCN1CC(=O)C1,0.2067
O=CC1C2C3COC1C23,0.2134
CC(O)C1OC1(C)CO,0.3243
O=CC12CC(C1)N=CO2,0.2089
c1c(c(c(nn1)N)F)O,0.2018
CC1(CO)OC2CNC12,0.2978
CC12OCC1C1CC2O1,0.3165
C#CC1C2CC3CC1C23,0.296
CCNc1ccn[nH]1,0.2383
CC1(OC1C[NH3+])C([O-])=O,0.1516
CCC12CC1(C)COC2,0.3272
C#CCN1C2C3CC1C23,0.2596
CC(C)(C)C1OC1C=O,0.2203
O=CC1OCOCC=C1,0.2176
CC(O)CN1C=NN=N1,0.268
N=COC1CC1NC=O,0.2268
c1ccnc(c(=O)c1)O,0.1606
O=C1C2C3CCC1CN23,0.2161
CCC1CCC(C)C1O,0.3235
OCCOCC1CN1,0.3006
C#CC1=CC(CC1)C#N,0.2098
OC1COC2(CC12)C#N,0.2675
Cc1c(cc([nH]1)CO)O,0.2122
OC1C2NC2CNC1=O,0.277
CCC1CN(C=O)C=C1,0.2074
CC#CC12CC(O)C1N2,0.2686
C#Cc1ccnn1C=O,0.1878
CC12C(O)C1OC2CO,0.2865
CCCC1(CN1)C1CO1,0.3128
CC1(C)OC2C=CCC12,0.2501
O=CCC12CN3CC1C23,0.2051
COC1C(O)C1C1CN1,0.2931
C1Cc2c(onn2)C1,0.2115
CC(=O)C1OC2CC12,0.2214
COC(C=O)C(=O)CO,0.2012
CCC1OC(C)CC1O,0.303
CC1(OC1C1CO1)C#C,0.2815
CC1(CC(=O)C(=O)O1)C,0.1721
O=C1C2CCCC1C=C2,0.2301
O=COCC1COC=N1,0.2626
CC1C(C#N)N1C(C)=O,0.2483
CC1(C)OC(=O)C11CN1,0.2587
CC1(C)CC1(O)CC=O,0.2175
CCC(C)C#CC#N,0.2462
CC1(CC1C#N)C#N,0.2908
CNC(=O)c1ccn[nH]1,0.2217
C1C(=CC(=O)NC=N1)N,0.199
OCC1CC1C(=O)C=O,0.1554
O=C1CC2C3C2C2C3C12,0.2085
CCC1=NCC(=O)O1,0.2499
CC(C)C1(O)CCC1=O,0.2053
N=C1OCC=C1CC#C,0.2206
[NH3+]C(CCC([O-])=O)C#C,0.2632
CC1(CO)COC11CC1,0.2921
CCC1OCC2C(O)C12,0.3074
CCCc1c([nH]nn1)C,0.2433
O=C(OC1CC1)C1CO1,0.2601
Cc1coc(c1C)NC,0.2182
CC1CCOC(=N)OC1,0.2811
N#CC12CC(C1)CCC2,0.3281
NC1(CC=CC1)C#N,0.2639
CC1C(O)C2N3CC12C3,0.2492
c1(c(n[nH]n1)N)C(=O)N,0.1901
CN1N=NC(=N)C=C1O,0.1612
C#CC1OCC2CC1C2,0.2914
C1CC2NC2C=C1,0.2498
CN=C1OC(CO)C1N,0.2615
CCC(C)CC(=O)OC,0.2857
COC(=O)C1CC=CC1,0.2575
COc1c(c(n[nH]1)N)N,0.2259
c1c2c(c[nH]1)NCC2,0.2213
CC1(O)C(O)C1NC=O,0.2648
OC(C#N)C1=NC=NO1,0.2547
CCOC1CCC11CC1,0.3261
CC(=O)CC1COC1=N,0.2294
C#Cc1c(cco1)C#N,0.1807
CC1COC(C)(C)C=C1,0.2641
CC1=C2CCOC2OC1,0.2488
CC1=NCC(O1)C#C,0.2674
CCNC(C)(C#N)C#N,0.2578
CC(C)(CN1CC1)O,0.3237
CC1=CC2(C)NC2C1O,0.2404
Cc1c[nH]c(c1C=O)O,0.1743
CC(=NO)COC(=O)N,0.2522
CCCC(C)(C)NC=O,0.2774
C1C(CN1)(C#N)N,0.2632
CN1C2CCC2CC1=O,0.2708
CN1C2C=CC(=NO)C12,0.1844
CCC1(C)C2CC2C1O,0.3151
CC12CCC3C(O1)C23,0.3102
C1C(=CNC(=O)N1)C#N,0.1942
CCC1(CN1)C#C,0.2871
OCC(CC#C)C1CO1,0.2964
CC12CC(C1)OCCC2,0.3155
CCC1=CCOC1CO,0.2462
CC1OC2CNC1CO2,0.2888
CC12CNC(C#N)C1N2,0.2787
COCC1(COC1)CO,0.3112
CCc1c(ccn1C)O,0.2245
CC12CC1(C#N)N1CC21,0.2583
O=CC12CN3C1CCC23,0.1888
CCc1ccc(o1)C#N,0.1984
C1C2C3C4C3N2C14,0.3075
N=C1ON=C(C=O)C=N1,0.1478
CC12C3C(O)C(N13)C2=O,0.2338
CC(NC1COC1)C=O,0.2087
CC1(C)C2CC(C#C)N12,0.259
CCN=C1OC2CNC12,0.2541
OCCN1C2CC2C1=O,0.2455
CCCC(C=O)C1CO1,0.2251
CNC(=O)C(=O)OC,0.2069
CNc1cc([nH]c1)C=O,0.1521
OC12CC(C1)OCCC2,0.3161
O=C1CN2C1C21CCC1,0.2174
CC#CCN1CC1C#C,0.2585
CC1OC2C1C2(O)C=O,0.1987
CC1C2OC1C2(C)C,0.3265
NCC1(CN=CN1)C#N,0.2488
OCC12CC(C1)C(=O)O2,0.2749
c1c(c(coc1=O)O)N,0.1778
CN=C1NC(=O)C2CN12,0.229
NC12CC1(OC2=O)C#N,0.2275
CNC(=O)C1CCCO1,0.2666
c1nc(c(o1)N=CN)O,0.1679
CC1CC(C=O)C1CO,0.2266
CCC(O)C1=CN=CN1,0.2467
CC1C2CC3(CO)C2N13,0.3125
OC1(C2CO2)C2CC1C2,0.3268
CCC#CCC#CC#N,0.2252
CN=C1CCCCCO1,0.2641
NC1=NNC(OC=N)=N1,0.2112
COCC(=O)CC#C,0.2087
CC1COC2CC2C=C1,0.2509
CCC(=O)C1C2CCN12,0.2144
N=C1CN2CC2C(=O)N1,0.23
CC1CC(=N)OC1CO,0.2835
CC12CN=C3NC1(C)C23,0.1733
CCC1N(C)CC11CO1,0.2948
CC1CC(O)(CO)C1,0.319
OC1CC2C(CC12)C#N,0.2978
C1C2C3C=CC=CC1C23,0.1836
CC12CC(C1)C(=O)CC2,0.2272
O=COC1=NCC2NC12,0.2258
CCC1=CCN=COC1,0.2305
Cc1c(cn2c1CC2)N,0.2202
OC1COC2(CC12)C=O,0.2252
CC(=O)C(C=O)C#C,0.1967
CC12CC1C=CC2(C)C,0.2472
CC1(C#C)C2C3CN2C13,0.2775
C1C2C=C3CN4C2C1C34,0.18
C#CCC12CC1CO2,0.2828
O=C1NC=CC2OCC12,0.2052
CC1(C)NC(C=C1)C#N,0.233
CNc1cc(n(n1)C)O,0.2343
CC1(O)C2NC(=O)C12,0.2475
N=C1OCC=C1CC=O,0.2013
Cc1c(ncc(n1)N)O,0.169
C1CC12C=C(CO2)C=O,0.1635
CC12C3CC3C1OC2=O,0.2619
O=C1CC2OCC3C2N13,0.2346
C1CC12CNCC(=O)N2,0.2616
c1c(n[nH]c1C#N)CO,0.2189
CC1C2CC(C1C)C2=O,0.2303
Cc1c(=O)oc(cn1)N,0.1565
N=COCC1CC(=O)O1,0.2664
C1CC(=CCOC1)C#N,0.2191
CC1C(C#C)C1(O)C#C,0.2568
CCC#CC1NC1C#N,0.2587
COC1C2OC(=O)C12,0.2672
CC1OC1(C#N)C(C)=O,0.2236
O=C1CCNC2CNC12,0.1996
O=C1C2C3NC1COC23,0.205
CC1CC11CC(O)CO1,0.2918
OC1CC23CC(O)(C2)C13,0.2987
COC1CC2(O)CC1C2,0.3218
O=C1NCC2CC2CN1,0.2884
N#CC12OC1CC21CN1,0.2509
C#CCCCN1CC1,0.2925
CC1CC2(CC2)O1,0.3096
CCN1C2C=CC(O)C12,0.2181
O=C1C2CCC1C1OC21,0.2267
N#CC1(CC2CN12)C#N,0.2475
OC12C3C4C1CN=C2N34,0.1449
CC#CC12CCC1CO2,0.263
O=C1CC2CNC1CO2,0.2093
c1cccc(=NO)cc1,0.1261
C#CCCOC1COC1,0.2992
OC1(COC1C=O)C#N,0.2077
CC1N=C2OCC2C1O,0.2651
C1COCOC(=O)CN1,0.2311
CC#CCC1C2CC1C2,0.3043
CN(C)C(=N)C#N,0.1997
CCOC(C=O)C1CO1,0.2151
CN(C)c1ncno1,0.2337
CCC1(CC1)C(O)CO,0.3118
CCC1(OCCO1)CO,0.3116
OC1CC1(O)CC1CC1,0.2971
OC12C3CC(CC1=O)C23,0.2208
CC1CC1OCC1CO1,0.3297
COC1CC1C(C)C,0.3147
O=CC1OC=NC11CC1,0.2032
CCCNC(=O)OCC,0.311
OC1(CC1)C1CC1C=O,0.2232
Cc1c2c(n[nH]1)OCC2,0.2317
NC(=O)C(O)CNC=O,0.2619
CC1C2C(CN12)C(C)=O,0.2168
CC1(C)OC1CCC=O,0.2287
COCC(C=O)C1CC1,0.2259
CN=C(N)NC(=O)CO,0.2178
CC1=CC2OC3C2CC13,0.2385
CC1NC1C1CN1C=O,0.262
CCC1OC2CC12CO,0.3015
CCOCc1cnn[nH]1,0.2515
CCC1(OC1C)C#CC,0.2782
CC(O)C1CC2(CC2)C1,0.325
OC1C2C3OC1OC23,0.3225
CCC12CC(C1)C2CO,0.335
C1C2CC3CCC3CC12,0.3277
C1OC11C2CC3CC1C23,0.3248
N=C1OCCN1C=O,0.243
c1c(c(nc(n1)F)N)N,0.1964
CC1(C)COC(=N)CO1,0.2691
CC1=CN2C3CC3C2=C1,0.2178
c1c(n[nH]n1)NC=O,0.2266
c1conc1CCC=O,0.2274
C1CC(=CCC1=O)C=O,0.1886
CC1CC1C1COC=N1,0.2695
c1c([nH]c(=O)n1C=O)N,0.1859
OC(C#C)C1=NC=NO1,0.2475
CC12CN(C1)C21CC1,0.3165
C1COC(O1)CO,0.3248
CCC(C)C1=NNC=C1,0.2667
CC1CN2C1=CCC2=O,0.2078
CC(O)C(O)C1NC1C,0.2981
OCCC1CC=CC1=O,0.19
CCC(O)C12CCC1N2,0.3143
N=COC1CC2CCC12,0.2811
COCC12CC3C1CC23,0.3399
COC1C2C3C1CCN23,0.3211
CCN=C1NN=NC=C1,0.1575
CCC1=CC(CC1)C=O,0.214
COC12C3C4C1C4(C)C23,0.2834
CN(C=N)C(=O)C(=N)N,0.2024
CCC(O)(CO)C#C,0.2824
CC1C2C3N1C(=O)C23O,0.2434
CC(=N)OC12CC1OC2,0.2561
CC1(CC1C1CO1)C#C,0.2903
NC(=O)C1C2C3CC1C23,0.2612
CNC1(CC(O)C1)C#N,0.2639
O=C1C2C3N2CC13C#N,0.2228
NC1C2(N)COC12C#N,0.2242
CC1CC2(CCCC2)O1,0.3168
CC1NCC(=O)C2NC12,0.1989
N=C1CC2CC3C(O1)C23,0.2733
CC1COC11CCCC1,0.3167
CC#Cc1c(ocn1)N,0.2041
CC1CC2C3OC3C2=C1,0.2384
OC1CCC(C1)OC=O,0.2807
CC(O)C(C[NH3+])C([O-])=O,0.2672
N#CC12CC1N=CN2,0.2394
C1CC(=NO)C=C1C=O,0.1537
C1=C(C(=O)C(=O)N1)CO,0.1463
COC1CC2N(C)C12C,0.3062
CCOC(C)C1(C)CN1,0.3127
O=C1CCC2COC12,0.2008
CCC1COC(C)(C)C1,0.3176
Cc1cc(cc(n1)F)N,0.2253
OCC(O)C1CC1C=O,0.2304
CC1=NNC=C(F)C1=N,0.1799
CC1C2COC(=O)OC12,0.3078
C[NH2+]CC1=COC=C1[O-],0.2236
c1c2c(cno2)oc1N,0.1909
CC1CC(C#C)C(C)=C1,0.2582
OC1=CNC=C(F)C1=N,0.1782
CNc1c(c[nH]n1)C=O,0.1766
CCC1CC2(C1)COC2,0.3119
CC1C(O)C(=O)C1(C)O,0.2049
CCC1(CC1C)C(C)C,0.3354
CC12CC(=O)C1(C)O2,0.2156
C1CC(=CNC1)C(=O)N,0.1992
O=CCC1CC2OCC12,0.224
CC1C2OC3CN1CC23,0.2958
Cc1cc(ccn1)O,0.2415
CC12CC1OC2CC=O,0.2212
CCc1nc(no1)O,0.2442
C1CC1(CC#N)O,0.2989
CCC1(C)CC(O)C1,0.3276
CC1C2C3CN3CC12C,0.2931
OCCC(O)CNC=O,0.2819
CC1CC2CCC2O1,0.3129
N=C1OC=NN1C1CC1,0.2071
CC1=COC(=N)C(=O)O1,0.179
CC12CC3C1OC23C#N,0.2489
CC1NC11CC2CN2C1,0.3056
CN=C1OCC1C1CO1,0.2766
N#CC1C2COCC1O2,0.2701
CCc1c(occ1N)C,0.2208
C(=O)c1c([nH]nc1O)N,0.1835
OCC1OC(=O)OC1=N,0.2693
CCC1(C=O)C2CCC12,0.2311
CCCC1CC=CC1C,0.2637
ON=C1C2OC3C2C13O,0.2391
NC1(CC1CCO)C#N,0.2984
CC1CC(O)CC(C)O1,0.3256
CC1CCC11OC1(C)C,0.3235
C1OCC23C1C1C2OC31,0.3077
CCCC(CO)C#CC,0.2994
N=C1OCC2C(C=O)N12,0.2002
CCC12CC1COC2,0.3336
OC1C(C#C)C1(O)C=O,0.2004
CC1=CCC(O)C1C#N,0.2601
O=CC1CNCC(=O)C1,0.1865
CCC1C(=O)CC11CO1,0.2135
C1COC=NCC1=O,0.2167
CCCCC1COC1C,0.3222
CC1C(O)COCC1O,0.3123
CC(CO)C1=CCCC1,0.2577
COC(CCO)C=O,0.2113
COC1(CC#C)CC1C,0.2913
CCCn1ccoc1=O,0.2355
c1c(n[nH]n1)NC2CC2,0.215
C#CC1NC2=NCCC12,0.2476
O=CC1N2CC2C11CN1,0.2029
CCC(=O)C#CC(=O)C,0.2001
CC1(C)CC11COCO1,0.3225
N#CC1C2CN1CC2,0.2682
CC1OC(=N)CC(=N)O1,0.276
c1cc(oc1)C(=N)N,0.1961
CC12COC=NC1CN2,0.2422
CC1(C)OCC2CCC12,0.3165
CC1(C)N2C(=O)CC12C,0.2349
CCC12CC(C1)CC=C2,0.2528
CC12COC(C)(C)C1O2,0.3345
CC1OC=NC1(C)C,0.2709
CC12CC(C1)C2O,0.3228
CC(C)C(O)CC1CC1,0.3207
CCC1NC(=O)C1CO,0.2813
O=CC1CN2CC(C2)O1,0.1899
C1COC(=N1)C#CC=O,0.1691
Cc1ncc(o1)NC,0.2164
CC12CC(C1)CCCC2,0.3549
OCCC1=CCC2CC12,0.2455
C(CN(C=N)C=O)CO,0.2233
CC12C3CN1CC23C=O,0.2095
O=C1C2OC3CN1C23,0.2089
CC(=O)OC1(COC1)C,0.2601
C#CCC1(CCN1)C#N,0.2632
OC(C#C)C1CC(O)C1,0.3012
CCC(C)(O)C1COC1,0.3003
NC(C[NH3+])C1=N[N-]N=N1,0.239
CC1(C=O)C(O)C1C=O,0.2072
CC1C2C3CC1(C#N)N23,0.263
CC1CC2(O)C(CO)C12,0.2892
O=C1NCC2CN3C2C13,0.2522
CCC12CN3C(CC13)C2,0.3023
C1C2NC2C2=COC=C12,0.2344
C(C1CC=CC1)N1CC1,0.2613
CC(=O)C1C2CC(=O)N12,0.2028
C#CC1OC2C3OC2C13,0.2621
OCC12NC1C(O)C=C2,0.2347
OC1CCCC2(CC2)C1,0.3347
CC12COCC1C(=N)O2,0.2861
C1CC2CC1CO2,0.3182
C1CC12CC(=O)N2C=O,0.2194
CC#Cc1c(non1)C,0.2088
CC1CN1C(=N)C(N)=O,0.2124
C1OC2C3OC2C2C1C32,0.3248
CC1OC(C)C1C(C)=O,0.2124
CC1C(C)C11CCC1C,0.3309
CC12CC1C1COC1=N2,0.2444
CNc1ccc(o1)C#N,0.1792
CNC(C(C)=O)C(N)=O,0.2058
Cn1cc(nc1C#N)O,0.1841
CC1OC11CC(C1)=NO,0.2459
CCC1NC1C(C)=NO,0.2399
CC(=O)NC1=CCOC1,0.2135
C1C2C=CC3=CCCC123,0.1862
CC1C=CC23CCC12O3,0.2304
CC1C2C(O)C=CC12C,0.2347
O=C1C=CC23CCC12O3,0.1781
CC1=CC(=N)NN=C1,0.1611
C1CC2CC(O1)OC=N2,0.2715
CCC12NC1(C)CC=C2,0.2331
C1COCOC1,0.3513
CC(CNCC#N)C=O,0.2208
c1nn2c(nnc2o1)O,0.2052
OC12CC3N(CC13O)C2,0.2769
COC1(CCCO1)C#C,0.3008
CCC1OC(=N)C1(C)O,0.286
CC1C2CNCC(=O)N12,0.2242
CC(C=O)C1OC2CC12,0.2145
Cc1ccc(cc1N)F,0.2115
c1c(c(n[nH]1)O)CCO,0.2447
Cc1conc1N(C)C,0.2218
CC(O)C1(CC1)C(N)=O,0.2719
CC(O)C1(CN1)C(C)=O,0.2181
CN=C(C#C)OC=O,0.2177
O=CNCC(=O)C1CO1,0.2073
CC1(O)C2CCCC1O2,0.3077
CC1(O)CC(O)(C1)C#N,0.2902
O=CCC12CC1CC2=O,0.224
c1c(=O)c(c(on1)F)N,0.1569
c1cnoc1C(=O)CO,0.1929
CC1C(CC#C)CC1=O,0.2203
CC1(O)CC2(CO2)C1=O,0.1885
CC1(C)C2CCC(O)C12,0.319
O=C1CC2C3C4C3C1C24,0.2132
CCC(=O)C1=NCCN1,0.1709
OC12C3C4C3C1(C=O)C24,0.215
C1C=CC(=O)NCC1=O,0.192
c1coc2c1COCC2,0.2335
CC1N=CN2C(C#N)C12,0.2374
C(=N)Nc1c([nH]nn1)O,0.1961
CC1C(O)C1C=O,0.2227
CCC(C)NC(=O)CO,0.2769
OC12CC3C(C1)C3C2=O,0.2299
CN1C2CCC12C#C,0.2712
CCC1OC11COC1,0.3227
C1C2CN3N=NC=C3C12,0.2452
CC12CC1OC(=O)CN2,0.237
OC1C2CCC1CC2,0.31
CC1C2C3OC2C13C=O,0.2003
Cc1cc([nH]n1)CO,0.254
CC12CN3CC1(C=O)C23,0.209
C#CC(=O)CCCC=O,0.1887
CC(C#C)C1=CNN=C1,0.258
CCC12CC3C1N3C2,0.3026
COC1(C)CC1(O)C#C,0.2686
CC(=N)N1C=NCC1=O,0.2254
CC(CO)C1CCCC1,0.3399
N=C1OC2C3OC3CC12,0.2844
OC12CC1(CC2)N1CC1,0.2956
NC(=O)C(O)(CO)C=O,0.213
OCC1(O)CC(C1)C=O,0.2243
c1cocc1OCC#N,0.2295
CC1C2C(=O)C1C21CN1,0.2517
CC1CCOCC2CC12,0.3157
CCc1cn(cc1O)C,0.2317
O=CC1CC1C1CO1,0.2267
c1c(onc1O)CC#N,0.2443
C1C2OC3CCC=CC123,0.2284
C1CC1C12CC3C1CC23,0.3478
CNC(=O)C1CC1,0.2801
CC1CC1(C)C1CCC1,0.3359
CCC12CCC1N2C=O,0.2413
CNC1C(C)OC1=NC,0.2556
OCC(O)C(O)C=O,0.2291
COCc1cnoc1,0.2462
N#CC1C2CC2C2CN12,0.2686
NC1=NOC(=N)C(O)=N1,0.1601
CC(O)C(C)OC(C)=O,0.2805
N#CC12CCC1N=CN2,0.2426
CC1(O)C2CN3CC1C23,0.2769
CC1C2CCCC12C#C,0.2851
OC(CC=O)CC1CO1,0.225
O=C1CC23CC(N2)C3O1,0.2646
COC1(C#N)C(O)C1O,0.2525
O=CC1C=CCC11CC1,0.2094
O=C1C2COC3CN2C13,0.2082
c1nc(c(o1)CCO)O,0.2167
O=C1C2CC(C2)C11CN1,0.2222
CCC1CCC=CC=C1,0.1919
C1OC2OC3C=CC2C13,0.2351
CCC1=CCOCC1O,0.2543
CCN=CN(C=O)C=O,0.2126
CN1C2CNC(=O)C12C,0.253
COC1C2C(C)C2C1C,0.3189
c1c2c(c[nH]1)CCC2,0.2416
c1c(nc(o1)NC=O)O,0.1908
CC1CC2OCOC12C,0.3243
CN=CN1CCOC1=N,0.2351
N=C1OC2CC1C2C=O,0.2179
O=CN1CC11CCC1=O,0.2037
N=C1OCC1NCC#C,0.2624
N=C1OCC=C1C1CN1,0.1978
CC12CC1C1OC1(C)C2,0.3432
C#CC12C3C4CC(C14)N23,0.2485
CCC(C)(C)OC=O,0.2791
CC1(CO)NC1CO,0.3051
OCC1COCCC1O,0.3053
CNC(=O)NCCC=O,0.2197
O=C1NC2CCCOC12,0.2544
CN=c1ncoc(n1)O,0.2001
Cc1c(n[nH]n1)OC=O,0.2379
CC(=O)c1ccc([nH]1)O,0.1758
CC1=CC2OC2C(O)C1,0.236
C1C2OC3COCCC123,0.3034
CCC(C)(O)CN1CC1,0.2908
C1C=C2C=CC3OC1C23,0.1938
CC(O)C(C=O)N1CC1,0.2214
COc1c(c[nH]c1O)O,0.2272
CC(O)C12CCC1O2,0.3156
CC(=O)C(O)C1(C)CO1,0.2245
ON=C1CC(CC#N)C1,0.2463
OC1CCC2(COC2)C1,0.3031
O=COC(C#N)C1CO1,0.2752
CC1N(C)C(CO)C1=O,0.2163
C#CC1=CCC(=O)NC1,0.2151
CC12CC(CCC=C1)O2,0.25
C#CC#CCCN1CC1,0.229
CC12CC1C(=O)C(=N)N2,0.1781
CC1CC(C)C1C#N,0.3306
CCc1nc(nn1C)C,0.2576
OC12CC1C(=O)OC2,0.2697
Cc1cc(c([nH]1)O)C#C,0.2122
CN=C(C#C)OC1CC1,0.2225
CNc1c(nno1)C=O,0.1828
O=CC1(CN1)C1CO1,0.2196
CN1C(=N)NC=CC1=O,0.1971
O=CC1OC2(CC2)C=C1,0.1881
OC1COCCC11CO1,0.3278
COCC1(CO)CC1O,0.3208
c1cc(nc(c1)O)CO,0.2097
CC1(CC#N)NC1C#C,0.268
CCCC12CC3C1CN23,0.3177
COCC1=NCC(C)O1,0.2617
CC12NC1C(=NO)C2O,0.2316
COCC(C#C)C1CN1,0.2899
CC1(C2(COC2)CO1)C,0.3069
NC(=O)C1OC1C(N)=O,0.2578
CC(O)(CC#N)C#C,0.2955
CNc1ncncn1,0.2091
CC12CCC1(OC2)C#N,0.2669
CC1COC2=C1N=CN2,0.2275
CCC12CC3C4C1C2N34,0.295
CCC1=CCOC(=N)C1,0.2545
CC12CC1(N=CN2)C#N,0.2479
CCC1(C=O)C(C)N1C,0.2088
CC(=O)C#CC(O)C#N,0.2051
CC(C1CC1)C1COC1,0.3205
CC12CCC(O1)OCC2,0.3265
CC12CC=CC1(C)N2,0.2417
N=C1N=NON=NC1=O,0.1654
OC1C2C3CC(C23)C1O,0.3112
CC(CO)C1(CN1)C=O,0.2212
c1c(c(co1)N2CC2)N,0.2269
CN(CCOC)CC=O,0.2026
CC1C2CCC3C2C13O,0.3173
OC1C2NC1(C=C2)C#N,0.2318
OC1CC11OCC=C1,0.2247
OCC12CN1C(=O)C2,0.2375
CCc1c[nH]cc1C,0.2491
COCC1COC(=N)C1,0.2854
CC12CC(C)(O)C1(C)O2,0.3117
c1c(c([nH]c1O)C=O)O,0.1784
CNC1(CCC1=O)C=O,0.1764
N=C1OCC1OCC#N,0.2679
OC1CC2(O)C1OC2=N,0.2713
CC(C=O)N1CC1C#N,0.2236
CC(C)C1CCCCC1,0.3661
Cc1c([nH]c(n1)C=O)N,0.1626
CC12CC(O)C1C2O,0.2925
CN1C2C3NC3C(O)C12,0.267
CN(C1CC1O)C(C)=O,0.2606
OC1C2C3CC3C1C2O,0.3086
CCOC1(C)C(C)C1O,0.2913
CC1CN1C(=O)C1CC1,0.2526
CC1C2CC(=O)C(=N)N12,0.1676
C1CC12CC(=O)OC2,0.2774
CC([NH3+])C1=C([O-])ON=C1,0.2325
C#CC1C2CC1C1CC21,0.3015
Cc1cc(n[nH]1)CC=O,0.2178
N=C1NN=CN1CC#N,0.2154
CCC1OC2C3NC3C12,0.2949
OCCOC12CC1OC2,0.3064
O=C(C#C)C1COCO1,0.1926
CC(=O)c1cocc1O,0.1651
CC1CC1C1CC(=O)C1,0.2216
O=CC1CCOC(=O)O1,0.2228
CC1=NOC(=C1)C1CO1,0.2344
NC(=[NH2+])C1=C([O-])ON=C1,0.1789
CC(O)C1=C(N)N=CO1,0.2044
OC1COC2=CNC=C12,0.2232
OC12CC(O)(C1)C2C=O,0.2199
[O-]C(=O)C1NC2C[NH2+]C12,0.2495
C#CC(C#C)O,0.2747
C#CC12OC1C1CC2C1,0.2649
CCC1CC2C(O)C12C,0.3151
c1c(c(n[nH]1)OC=O)O,0.2173
CC1CC2OCOC12,0.3242
CCC12OC1(C)C1NC21,0.314
COC1C2CC1C(C)C2,0.3355
C#CC#CC1OCCO1,0.2246
OCCC1CN1CCO,0.3036
CC12OCCC1(O)C2O,0.2636
Cc1c2c([nH]cn2)n[nH]1,0.2066
C1OC2OC1C=C2,0.2451
COC1CC1C1CO1,0.3357
C1C2CN1C1=C2ON=C1,0.2188
c1c2n(nc1O)C=CC2,0.1877
OC(C#CC=O)C1CO1,0.2034
C(C(=O)C=O)O,0.1563
c1cc(c(nc1)CO)F,0.2112
CC1=CC2(C)CC1(O)C2,0.2368
Cc1cc(oc1C)C=O,0.1783
C1COc2n1nnc2N,0.2077
C1C2CCOCCOC12,0.2962
N=C1CC2C=CC(=O)N12,0.2055
CC1(C)NC1(CO)C#N,0.2791
CCC(O)(C#N)C1CO1,0.2953
ON=C1CC2OCC12O,0.233
NC1=C(NC(=N)O1)C#C,0.1787
CC[NH+]1CC(C1)C([O-])=O,0.1759
CC(=O)C1CC(=O)C1,0.2229
O=C1C=C2CCN3C1C23,0.1684
CCC1(C)C(C)C1OC,0.315
CC1N=C(C)NC1=O,0.2327
C1C2C1C1OCC3C2C13,0.3045
CCC12C3NC3C1N2C,0.2622
OC1CC2NC12,0.3133
COC1CC2NC2C1,0.3093
CCCn1ccc(n1)O,0.2409
CC1C(CC=O)C1C#C,0.2256
O=C1OC23CC12CCC3,0.2663
CN1CC2(CC12)C#N,0.248
COCCCCC=O,0.229
C1C2C3CN=COC1C23,0.2654
CC12COC(C1O)C2O,0.2934
O=CC1COCC1C=O,0.2068
COC(C(C)C)C1CN1,0.3186
c1c(nc2n1nco2)N,0.1811
C#CC(C#C)C1CCC1,0.293
CC1=CCOC(=N)C1O,0.2514
NC12CC1N1N=CN=C21,0.2304
C1C2NC3=C(ON=C3)C12,0.195
CCN=C(N)NC(=O)C,0.2177
CCNc1cc([nH]n1)O,0.2402
CC1(COC1)C(O)CO,0.2983
CCC(O)CC#CC=O,0.2052
CC1C2C3CC(C3C)N12,0.3019
CC#CC(O)C#CC=O,0.2022
OC12CC3OC(C1)C3C2,0.3085
C1CC=CC=C(C1)C=O,0.1639
CCCCC1CCCC1,0.3786
CC1CCC=C1C1CC1,0.2487
CC1(CC1)C1OC1C#C,0.2677
CC1C(O)C(=O)C1(C)C,0.2194
OCC12C3CC1=CCC23,0.1765
CN1C2CCC(C)(O)C12,0.2831
Cc1cccn1C(=O)C,0.186
O=CN1CCC2(CO2)C1,0.2632
CCOc1[nH]c(=O)[nH]n1,0.2617
N#CC1C2C3C4C3N2C14,0.2665
CC1C2N3C1CC23C=O,0.218
CCCCCC(N)C#N,0.2864
OC1=CC(F)=NOC1=N,0.1763
CC1OC11CC2(CC2)C1,0.328
CCN1CC2OCC12,0.2873
CC1CC2CC2C2OC12,0.3355
O=C1C(CC2CN12)C#N,0.2389
CC#CC12CC1CC2,0.2642
C#CC(=O)N1CC(=O)C1,0.2111
CNC(=O)C1NC1CO,0.2633
CCCC1C2CCC12C,0.3254
CCC(O)C(=O)C#N,0.1914
C1CN1C12CC1CC2,0.3006
CC1CC2CC2C(C)=C1,0.2477
CN1C=C(O)N=CC1=N,0.1303
CC(CO)NC(=O)C=O,0.1752
CC(OC=N)(C#C)C#C,0.2631
C1C2OC3OC2C1C=C3,0.2416
O=C1C2NC1C=C2,0.2349
OC1CCC2CC2C1,0.33
CC(=O)C1(C)CC1(C)O,0.2265
CC1(CCN2CC12)C=O,0.2106
OC1C2C3CC2C3C1O,0.3116
CCCC#CC,0.3043
Cc1c[nH]c(n1)NC=O,0.1943
c1c2c(nc[nH]2)n[nH]1,0.2131
CC#CC1=CNC(=N)O1,0.1776
OC1CC2NC12C1CC1,0.2982
CC1(COCCOC1)O,0.314
CN=C1CC(O1)C#CC,0.2655
CC1(CNC(=O)NC1)O,0.2918
CC(C)(O)C1CCCO1,0.3232
c1c(oc(n1)O)N,0.2432
COc1cc(no1)C#C,0.209
CC1CCC(=C1)C1CN1,0.2384
CC1(CC1)C2=NCCO2,0.2585
CC1CC11CCOC=N1,0.2553
OCC1CC1(C=O)C=O,0.2059
OC12CNC1C2(O)C=O,0.1893
C1OC2C1OC1COC21,0.2892
CC1C(C#C)C2OC12C,0.2901
N=C1OC2CC12C#C,0.2593
C1C(=O)NC(=O)CO1,0.2333
O=C1CC2(NC12)C1CO1,0.219
CNC(=O)C(O)C(C)C,0.2758
c1c(nc(o1)CO)C=O,0.2011
C1C2C=C3CC=CC3N12,0.2308
CCC1(OC1C)C(C)=O,0.221
CC1(COCO1)C#C,0.2915
OC1CCC(O)C11CO1,0.3034
CC1C2C(O)C(=O)CN12,0.196
CNC1=CN=NOC1=N,0.1686
C1CC(C1)(C#N)N,0.2934
C#CCC(=O)N,0.2742
COc1c[nH]cc1C=O,0.1872
CC(C#N)N1C=CN=C1,0.2425
CNC(=N)C(=O)NC=N,0.1875
N=C1OC2C(C#C)C12,0.257
CCC12NC1C=CC2C,0.2412
Cn1ncc(=O)c(n1)F,0.1827
CC1CC(C1)C1(O)CC1,0.3
OC12CN3C(COC1)C23,0.2884
CC1(CCN1CC#N)C,0.2584
OCC1=NC=NC(=N)N1,0.1799
C1C2OC2C2=C1ON=N2,0.1693
CC(=O)NC(CN)C#N,0.2599
CC1(CC=O)OC1C#N,0.2222
OC12CCC11OCC1C2,0.2957
OC1CC2(O)C(C=O)C12,0.2203
Cn1nc2c(n1)CNC2,0.2261
OCC12NC3C(C13)C2=O,0.2298
CCC1=CC(=N)OC1,0.2152
CC1=CC(=N)C(C)=NO1,0.1893
N#CC1CC2CCCN12,0.2424
CNc1cnc(=O)oc1,0.1474
CC(C=O)C(=O)N1CC1,0.2091
O=COC12CC1N1CC21,0.2363
N=C1OC(C=O)C2NC12,0.2127
c1noc(=O)n1CCO,0.2485
C1NC11CN2CCC12,0.2772
OCC1CC2=CC=NN12,0.2629
COC1COCC(C)C1,0.3193
CC1C2CC3C(N13)C2=O,0.2189
CC1OC2CC12C#C,0.2642
O=CC#CC1CN2CC12,0.1886
CC1C2CC1(O)COC2,0.3152
CC1OC2CC2OC1C,0.3085
CC(C)CC1(CO)CO1,0.3393
c1c(nco1)NC=O,0.2179
CC(N=C(N)CO)C#C,0.2638
CN=C(C=O)N(C)C=O,0.1715
CC12OC1C1NC21C#C,0.2363
CCCCC(CC)OC,0.3271
COCC1COC1CO,0.315
CCC12COC1C(=N)O2,0.2632
CC(=O)C1=NCC(=N)N1,0.1651
CC(CC#N)CC#N,0.3321
C1OC2CCC=C12,0.2431
c1c(nnc(n1)F)C=O,0.1577
CC1=CC(O)C2(CC2)C1,0.2579
C1C2C3CC4(COC24)N13,0.2997
CC1OC(=N)C2CC12O,0.2772
CNC(=O)C1CC(=O)C1,0.2272
CC1C(C)C11NCC1=O,0.2091
C#CCC1CC(O1)C#C,0.2735
OC12COC3CC1C23O,0.2821
c1(n[nH]c2n1nnn2)N,0.209
NC1=C[NH+]=C(N1)C([O-])=O,0.2527
CNC1=NC(=N)NN=N1,0.1564
c1c([nH]cn1)CC=O,0.1762
CCOC1CCNC1=O,0.2501
CC(C#C)(C#C)C1CO1,0.2868
CCC(CO)OC(C)=N,0.2779
CC12C3C1N1C3CCC21,0.302
C#CCCC(=NO)CO,0.248
O=CC12OC3C1OC23,0.2009
OC1C2C3OC3C12C=O,0.2167
CN(C)C1=CC(=O)CC1,0.2013
C1C=CC2C3C1N=CN23,0.2243
Cc1[nH]cc(n1)C(=O)C,0.2049
C#Cc1[nH]c(c(n1)O)N,0.1826
Cc1coc(n1)NC,0.2328
CCC1C2CC1C2OC,0.3435
OC1C2CC1(CC#C)O2,0.2927
N=C1OC2C1NC21CC1,0.2498
CC#CCC#C,0.2901
OCC1(CCO1)C1CN1,0.3052
CC12CC1CC(O)CO2,0.2953
CCC(CO)N1CC1C,0.3158
CCCCCC#CCC,0.302
OC12CCOC3C1CC23,0.315
C1CC2(O1)C1C3C2CN13,0.317
C1C2CC3C=CCCC123,0.2612
OC1C2C3CC(=O)C2C13,0.2257
COC12CC1COC2=O,0.2569
CN1CC2C(O)C12C=O,0.1864
CCC(C[NH3+])CC([O-])=O,0.2734
CNC(=NC)C(=O)CO,0.1741
FC1=NOC(=N)OC1=O,0.19
CCC1(CC)CN2CC12,0.2992
CC1C2C(CC12O)C#N,0.2996
OCCC1C=CCC1=O,0.2234
C#CC(C#C)(C(=O)N)O,0.2425
CC1C2CC(C)(O2)C1=O,0.2109
CN1C=NC(F)=CC1=N,0.1799
c1c(ocn1)C(=O)C=O,0.1509
CC1(CC2(CC2)O1)C=O,0.2036
CCC1CC1(C)C1CO1,0.3437
Cc1c(cn[nH]1)CC=O,0.2077
CCCC(C)C#CC#N,0.2458
CCC12OCC(O1)C=C2,0.2455
CC1CC23CCC12CO3,0.2848
CC1=CC(F)=NNC1=N,0.1581
C1CC11C2CC1C21CO1,0.352
Cc1cncc(n1)F,0.2077
COC1(CC(C)C1)C#C,0.2892
OC1(CC(C1)C#N)C#N,0.3026
CC(O)C1(CC#N)CO1,0.2995
N=C1OC2CC=CC2O1,0.2422
Cc1nc(c(o1)NC)N,0.2107
COCc1cocc1N,0.2295
OC1C2CCC12C#C,0.2675
COC1COC(C)C=C1,0.2475
CC12CC1C1(NC21)C#N,0.2351
OCC12C3CN1CC23O,0.2899
OC1CN2C(C#C)C12,0.2673
C1OC2C=CC1C1OC21,0.2406
COCC1COCO1,0.3416
CN1C2COCC(O)C12,0.2916
CC(=O)COC(=NC)C,0.2318
NC1COCC1(N)C#N,0.2692
CC(C=O)C(O)CC#C,0.2205
O=C1C2CCOC1C=C2,0.2068
CC12CN1C1(CC21)C#N,0.2471
c1nc(nn1C2CC2)O,0.2405
O1C2C3C4C1C=CC2N34,0.2289
CC#CCOCCC#N,0.2799
OC(C#N)C1=CNC=C1,0.2418
OCC12CCC(C1)C=C2,0.2573
N=C1NCC11OC1C=O,0.2103
C[NH+]=C(N)[C-](C#C)C#N,0.1889
CC1C(C)C2(O)CCC12,0.3145
OC1C2CC1(CC#N)N2,0.2883
C[NH2+]C(C(N)=O)C([O-])=O,0.2413
CC1(C)OC(C=C1)C#N,0.2541
N=C1CCC(CO1)C#C,0.275
CC1(C)CC11CC(=N)O1,0.2738
CC1CC=C(C)N1C=O,0.2106
C1OC23CC4OC2C4C13,0.2969
C1OC23CC(OC12)C=C3,0.2362
CCC1(O)COC1=NC,0.2746
CN1C=NC(CO)C1=N,0.2189
Cc1c([nH]c(=O)cn1)N,0.16
N=C1NCC2OC1C2=O,0.2094
CCOC(C)C(C)(C)C,0.323
c1c-2cnn[nH]c2cn1,0.1228
COCC1CNC(=O)O1,0.3132
CN1C2C3C(O)C2(O)C13,0.266
Cc1cn2ccoc2n1,0.219
CCCC(O)CCC#C,0.3132
OCC12C3C4C1CC2N34,0.2795
N#CCC1OCC2NC12,0.2999
CC(O)(C#N)C1(C)CO1,0.2913
CC1C2C3N4C=NC13C24,0.2114
CN1CC1(C)C1CC1O,0.2993
c1cncn2c1ncn2,0.1988
O=CCC12CC(N1)C2=O,0.2273
COC(C)C1CN1C=O,0.2533
CC1CCC(C)C1=NO,0.2487
CC1OC(=O)C1(C)C#N,0.2708
Cc1c[nH]c2c1cco2,0.2219
OCC1CCC(=O)O1,0.2781
CC(CO)OCC1CO1,0.3284
[NH3+]CC[C-](C#N)C#N,0.2655
N#CC1C2CCCN12,0.263
CCCC1=CCC(=O)C1,0.2242
C1CN(C(=O)N1)C=O,0.239
O=C1CC2OC2CC=C1,0.1925
CC1OC(=O)OC1C=O,0.2222
N#CC1C2CCN12,0.2668
O=CNCC12CC(C1)O2,0.276
C1CC1CC(=O)C(=N)N,0.1969
CCC(C)C#CC1CO1,0.2742
C1CC2(C1)OCC1OC21,0.3333
CN(C)C(C#C)C(C)=O,0.2024
CC1OCC2OC(=O)C12,0.2712
OC1C2CC(=O)C12O,0.2304
CC#CC12CCC1CC2,0.2769
C#Cc1c[nH]cn1,0.2231
OCCC1OC(=N)C1O,0.2764
CC1CCC2=NC=NN12,0.2677
CCOCC(O)CO,0.3317
CCC12OC(C=C1)C2O,0.2383
COC(C1CO1)C(C)=O,0.2195
c1c(nncn1)NC=N,0.1601
Cc1nc(c(n1C)O)O,0.2131
CC(O)C(=N)NC(C)=O,0.2284
OCCC1CC(C1)=NO,0.2495
CC(O)C1(C)OCC1O,0.2989
CC(CCC#N)CC=O,0.2279
CC1(C)CC1CC(N)=O,0.2725
CCCn1ccnn1,0.2582
C(C#CC#N)OC(=O)N,0.2319
CC(C1CN1C)N1CC1,0.2989
N=C1NC2=C(OCC2)O1,0.2203
COC(C(C)O)C1CC1,0.3172
CC12CC(OC1)C2C#C,0.2774
CC(C=O)C(CO)CO,0.2219
CC(C)NC1(CC1)C#N,0.2586
CC(C=O)C(CO)C#N,0.2225
OCC1C(=O)CC11CO1,0.2147
Cc1c(ncc(=O)o1)O,0.1395
C(CO)C(=O)CC=O,0.2119
CC(C)(C)CC#C,0.3107
c1c2ncnn2ncn1,0.1956
CCC1NC1C#CC,0.2769
N=C1CCC2(CCC2)O1,0.2825
NC(=O)N1C2C3OC2C13,0.2765
CCC(C)C(=O)CCO,0.23
Cn1cc(cc1OC)O,0.2308
COc1c(nccn1)F,0.1991
CC1(CC1O)C1CC1,0.3225
CC(=N)NC(=O)OC=N,0.2413
CCC#CC1CC1O,0.2787
c1c2c(c([nH]1)N)CCC2,0.236
COC=NCC#N,0.2708
c1cn(c(n1)O)C(=O)N,0.196
O=CC1CC2=CCCC12,0.2045
C1C2CC3C4NC4C1N23,0.2733
N=C1CCCC(O1)C#C,0.2744
C1OC2COC1CO2,0.3367
CC(C)CCC1CO1,0.3468
CC1(C#C)C(O)C1C#C,0.252
CCC1CC(O)CCO1,0.3271
N=C1OCCNC1C=O,0.2144
CC1C2OC3CN1C23C,0.2783
N=C1COC(O1)C#C,0.283
OCC1C2OC(=O)C12O,0.2448
CC(O)C1(CC1C)C=O,0.2267
CNC(=O)C1(C)CC1C,0.2711
CC12C=CC(C=C1)C2=O,0.2409
CC1N(C=O)C1(C)CO,0.2528
Cc1[nH]cc(n1)C(=O)N,0.229
CC1COC(=O)NC1C,0.2997
O=CC1OCC1C1CO1,0.2123
CC(=O)N(C)CCC#C,0.2654
CC(C(N)=O)C(=O)C#C,0.1708
CC12CC(C1)(C=C2)C#N,0.24
C1CN=C(OC1)C=O,0.1942
CC1CC11CC2CC12C,0.3229
CCN=COCC#N,0.2612
CC1OCOC1(C)C#C,0.2862
O=C1OC2CC11COC21,0.2692
COC1=CC=CC(=N)O1,0.1649
O=CCC1CCC11CC1,0.227
NC(=O)N1C2CC=CC12,0.2383
CC(C)C1=CCC(=O)C1,0.2242
CCC1(CO1)C(=O)NC,0.2657
CC12CC(C1)C(O)C=C2,0.2485
CC1=CCC2OC12C#C,0.2352
OC1C=CCC1C1CC1,0.2609
O=CC1OC2CNC12,0.2058
NC(=O)C1C2CCC12,0.2637
CC1C=CC2CC12CO,0.2473
CC#CC1(CN1)C1CC1,0.271
CC12C(O)C1CC2(C)C,0.3157
CC12CCC1=CC(O)C2,0.2432
N=COC1(CC1)C1CC1,0.2606
c1cc([nH]c1)NC(=O)N,0.2091
Cn1cnc(c1C#C)O,0.1941
CC(C)C1(C)CC1C,0.337
OC1C2CC1(C)C21CC1,0.3192
CC12CC3C1OC23C=O,0.208
COC(=O)NC(=O)C#C,0.2167
C1C=CCO1,0.2491
Cc1c(cc[nH]1)NC,0.2162
CC(O)(C=O)C(=O)C#C,0.1748
c1c(c([nH]c1O)C#N)O,0.2009
O=CCC(C#N)C1CN1,0.223
O=CCC1CC(C1)C=O,0.2185
N#CC1C2C3CC(C3)N12,0.2574
CCC1CNC(=O)C1O,0.259
CC1(C)C2CC1C=CC2,0.2504
c1c(c(=O)ocn1)N,0.1694
CN1C2C3CCC1C23C,0.2794
CC12C3N1C1CC3(O)C21,0.2845
CC(C#N)C1(CO)CN1,0.2842
CC1(CC1CCO)C#N,0.3126
CC(C(O)C=O)C1CC1,0.2246
OC1CC11CC2CCC12,0.3026
Cc1cnc(cc1N)O,0.2188
CC1(CO)NC1CC#C,0.3003
O=C1NCCNC1C#N,0.2605
CCC1C2OC1C21CC1,0.3184
CC1(O)CCC2C(O)C12,0.3145
OCC(NCC#N)C#C,0.2608
CN(C(=O)CO)C(=O)N,0.2535
CC12CC1(N=CO2)C#C,0.2496
OC1C2CN(C2)C1C=O,0.197
CC(O)C1(O)CCOC1,0.3115
CCC1CNC(=O)N1,0.3047
OCC1OC2CC2C=C1,0.2485
NC1(CCO)COC1=O,0.2588
C#CCC1(CC1)CO,0.3114
OC1C2C(O)C1(C)C2O,0.3014
OC12CC3OCOC1C23,0.3037
C1C=CCN=COC1=O,0.2306