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Paused
Paused
| smiles,gap | |
| O=C1NC2C3CCC12O3,0.2433 | |
| ON=C1C=C2CC3C2C13,0.1439 | |
| CCCN=C1CCO1,0.2778 | |
| NC12C(O)CC1OC2=N,0.2586 | |
| CNC(=[NH2+])OCC([O-])=O,0.1391 | |
| CC1CC(OC1=N)C=O,0.2143 | |
| CC1CCC(=O)NC=C1,0.2147 | |
| COCC(O)C(F)(F)F,0.3316 | |
| c1cn(c(n1)CN)C=O,0.1941 | |
| C#CC1CC2C(C#N)N12,0.2563 | |
| CC1CCC(CO)C1,0.3411 | |
| CC#CC1CC2C(C)C12,0.2913 | |
| OC1CC1CCCC=O,0.2285 | |
| CC1C2C(C)=CCC12C,0.2449 | |
| CC1C2OCC=CC12O,0.2307 | |
| OC1CC=CC2(O)CC12,0.2447 | |
| OCC(O)C1=CNN=N1,0.234 | |
| CC12CC=CC(O)C1O2,0.2663 | |
| O=C1OC2C(CC#N)C12,0.2739 | |
| C1OC1C1CCC2CC12,0.3421 | |
| NC1=CC=C(F)C(=N)O1,0.1616 | |
| O=CC1=CC(OC1)C#C,0.1897 | |
| OC(CC#N)C#CC#N,0.2389 | |
| N=CN1C=NCC1=O,0.2266 | |
| CC1(CCC2CC2)CO1,0.3473 | |
| CC(O)C#CC(C)CO,0.2899 | |
| COCC(O)C(C)CO,0.3324 | |
| CC12CCC(C1)C(O)C2,0.3337 | |
| CC(O)C1CC(=N)O1,0.2903 | |
| COCC12CC1CCO2,0.313 | |
| CC12C3N1C1CC=C3C21,0.1614 | |
| c1nc(=O)c(no1)N,0.1904 | |
| N=COCC1CCOC1,0.2787 | |
| CCC1CC2(OC12)C=O,0.2204 | |
| OC1CC2(O)C1NC2=N,0.2583 | |
| c1c(ncoc1=O)N,0.1893 | |
| CC12CCN3C(CO1)C23,0.3173 | |
| CC1=C(O)C(=N)C=NN1,0.1649 | |
| c1c2c([nH]cn2)n[nH]1,0.2125 | |
| CC(C)C(=O)CCCO,0.2314 | |
| CC1C(O)CC(=O)N1C,0.2665 | |
| CC12OC3C4C(CC14)C23,0.3183 | |
| CC12CC(O)C3C1OC23,0.2984 | |
| CC12COCC1NC2=O,0.2753 | |
| CC(=O)C(=N)NCC#N,0.1983 | |
| c1nc2ncnn2nn1,0.1649 | |
| N=C1NC(=CCO1)C#N,0.1818 | |
| CCC12OC3C1OC23C,0.3004 | |
| C#CC12CC3C(CC13)C2,0.2954 | |
| c1c2c(cno2)[nH]c1N,0.1931 | |
| CC#CC#CC1CC1O,0.2135 | |
| CN1C2CCC12C=O,0.2183 | |
| OCC1CCCC=CC1,0.2572 | |
| CC1CC2(O)CCC12O,0.3097 | |
| OC1CC(O)C1,0.3216 | |
| ON=C1CC2C(C#C)C12,0.2409 | |
| N#CCC12CN3CC1C23,0.2666 | |
| COCC1OC(C)C1O,0.2989 | |
| CC1OC11CC(O)C=C1,0.2434 | |
| CC1N=COC2CC12,0.2704 | |
| ON=C1CN2C(C=O)C12,0.1916 | |
| O=C1C2(CC2)CC11CN1,0.2111 | |
| COC=Nc1cnco1,0.182 | |
| Cc1c(nc[nH]1)O,0.224 | |
| C#CC12CC(N1)C21CN1,0.2601 | |
| CC(C)n1ccnc1O,0.2516 | |
| C1CC(O1)C1=CNC=C1,0.2472 | |
| O=C1C2CC1C(C2)C#N,0.2286 | |
| CC1CNC2=C1NN=N2,0.201 | |
| C1C2C3C4C=CC(C14)N23,0.2414 | |
| CC(=O)N1N=CNC1=N,0.1993 | |
| c1cnnc(n1)F,0.1673 | |
| N=C1OC=NC(=N)N=C1,0.1837 | |
| C1C(=CC(=O)C1=O)C=O,0.1183 | |
| CC1OC2CC(O)C2=C1,0.2336 | |
| OC1CCC(O)C1C#N,0.2884 | |
| COC1C(CC1=O)C#C,0.199 | |
| OC1C2C3CC4C3C1N24,0.2883 | |
| COCCNC(=N)C#N,0.2112 | |
| OC12CC3CCOC1C23,0.2987 | |
| CCC1OC1(C)C1CO1,0.3317 | |
| OCC1C2CC2C1C=O,0.2223 | |
| CC1C2CCC2OC1=O,0.2771 | |
| COCCn1ncnn1,0.2472 | |
| O=C1OCC2C3CC12N3,0.2443 | |
| CCC#CC1CC1C#C,0.2639 | |
| CNc1c(con1)CO,0.2326 | |
| CCCC(=O)C(=O)C,0.1577 | |
| N=C1OC=CC(=N)N=C1,0.1653 | |
| CC1C(=O)C2(O)CC12C,0.2197 | |
| OC1C2OC2C1CC#C,0.3088 | |
| CN(CCCC#C)C=O,0.2707 | |
| Cc1coc(c1C#N)N,0.2075 | |
| CCC(C)C(C)(O)C#C,0.3 | |
| CC1(C)CC11OCC1O,0.2825 | |
| O=C1CC2C3COC1C23,0.2101 | |
| N=C1OCOCC11CN1,0.2543 | |
| c1c(c(=O)[nH]nn1)CO,0.1827 | |
| CN(C)C1(COC1)C#N,0.2629 | |
| CC1(CN(C=C1)C=O)C,0.2089 | |
| CCC12OC(C=C1)C=C2,0.2006 | |
| c1c2c(ocn2)oc1N,0.2152 | |
| N=C1CN=CN1C=O,0.2174 | |
| OCC1C2C1C1CC2C1,0.3245 | |
| CC1(CC#C)CNC1=O,0.2751 | |
| CC1OC(C)C1C#N,0.2851 | |
| c1cncc(c1O)O,0.2225 | |
| C(CO)COCCC=O,0.2284 | |
| OC1C(O)C1C(=O)C=O,0.1554 | |
| NC(C#N)C1(O)CC1,0.2966 | |
| OCCCC1COC=N1,0.2699 | |
| CC1C2CC3(CC3)CC12,0.3347 | |
| CC1(C)OC2CC12CO,0.3 | |
| Cc1c(nc([nH]1)O)C=O,0.1894 | |
| Cc1ccncc1OC,0.2124 | |
| COC1C2C1C1CCC21,0.3124 | |
| FC1=NC=C(F)C(=N)O1,0.1859 | |
| CN1CC1C1CCO1,0.2953 | |
| COC1COC1(C)C=O,0.2121 | |
| CC(CC1CCC1)C#N,0.3379 | |
| Cc1cc([nH]c1O)C#C,0.1897 | |
| ON=C1C2CC1C2C#C,0.2697 | |
| CC(CCO)C(C)(C)O,0.3276 | |
| CC12C3COC(C13)C2O,0.3356 | |
| OC1C2CC(C=O)C12,0.2149 | |
| C1CC2(O1)C1C3OC1C23,0.3032 | |
| c1cnnc(n1)N,0.1667 | |
| CC1(C)C2CNC(=O)C12,0.2671 | |
| COC(=O)C(O)C(C)=O,0.2237 | |
| C1CC(=CCOC1)C=O,0.1942 | |
| CC1CCN(C=O)C1C,0.2656 | |
| CN1CC1(CN)C#N,0.2702 | |
| CCCC(CC)C(C)=O,0.2301 | |
| OC12CC1C1(OC21)C#N,0.2446 | |
| NC12CC(OC1=O)C2O,0.2442 | |
| COC1CC2CC1C=C2,0.2524 | |
| CC(C1CO1)C1CCC1,0.3455 | |
| NC(=O)C(O)C#CC=O,0.2016 | |
| CC1OC2CN(C)C12C,0.2787 | |
| OCC1(CO1)C1CCO1,0.3188 | |
| ON=C1CN2C(C#C)C12,0.2263 | |
| CCN1C=CC(=O)C1=N,0.145 | |
| C(CNCC#N)C(=O)N,0.2697 | |
| CC(=O)C(=N[O-])C(N)=[NH2+],0.1454 | |
| CC(O)C(=N)OCC#C,0.2644 | |
| OC1(COC1=N)C#N,0.2678 | |
| CC1=C(OC=C1)C1CN1,0.2186 | |
| C#CC1CN1C1COC1,0.2641 | |
| O=C1OCC(C#C)C1=O,0.1673 | |
| CC1OC(=O)C1C1CC1,0.2745 | |
| CC(CC#C)N1CC1,0.2873 | |
| COC1OCC2NC12,0.3145 | |
| CC1C2NC1(C=C2)C#N,0.2228 | |
| CC1CC2OC(=O)C2N1,0.2339 | |
| CC1NC1(C#C)C1CC1,0.2829 | |
| CC(C)(O)C1NC1CO,0.3112 | |
| CC(OC1CCC1)C#N,0.2939 | |
| CCC1C2C3C2C(=O)N13,0.244 | |
| COCCC1(CC1)C=O,0.2291 | |
| N=C1NCC=CC(=O)N1,0.1825 | |
| OCC12CCCC1N2,0.3138 | |
| CC(OCC#N)C(N)=O,0.2524 | |
| CC1=CCCC11CN1,0.2417 | |
| O=C1NCC2CN2C=C1,0.2048 | |
| CC1C2CC1(O)C21CN1,0.3094 | |
| CC1CCC2(CC2)CO1,0.3285 | |
| OC12C3C4C3N(C14)C2=N,0.2377 | |
| CC1C2C3N4CCC13C24,0.2957 | |
| N#CC1C2C=CC1C=C2,0.2122 | |
| CC#CC1=COC(=N)N1,0.1779 | |
| Cc1cc([nH]c1O)NC,0.2259 | |
| C1C2CC11C=CCC1C2,0.2511 | |
| O=CC1OC11CC=CC1,0.2162 | |
| Cc1nc(co1)C=O,0.2019 | |
| CC1C2CN2CC1(C)O,0.3045 | |
| CC1CCCCO1,0.3314 | |
| CC1=CC2OC1OC2=O,0.2254 | |
| CC(CC(N)C#N)C#N,0.2969 | |
| Cc1coc(c1OC)C,0.2317 | |
| O=CNC1COC11CC1,0.2581 | |
| CCOC(=NC)C#CC,0.2272 | |
| C1OC23CC4C(C2)N4C13,0.2954 | |
| CC1NC1(CC#N)C=O,0.2249 | |
| OCCC1C(O)C2CN12,0.294 | |
| CC1C2OC3C2C13C#C,0.2597 | |
| CC(O)C1CC(C)(C)C1,0.3284 | |
| CCC1=C(C)C(=N)OC1,0.2173 | |
| CN1N=NNC(=N)C1=O,0.1965 | |
| CCC1C(C)C(O)C1O,0.2933 | |
| CC1=CCC2C3CC3C12,0.2591 | |
| CCC1CC11OCC=C1,0.2246 | |
| CCCN=C(C=O)NC,0.154 | |
| CC1C2C=CCC12C,0.2452 | |
| OC12CCC1CC21CO1,0.3067 | |
| COc1ccoc1C#N,0.1945 | |
| NC1=NC(=N)N=NO1,0.2421 | |
| c1coc2c1c(n[nH]2)O,0.2263 | |
| OCC12CC1C(O)C2=O,0.2114 | |
| CC12OC1C1CC2C1=O,0.2411 | |
| CCC(C)([NH3+])CC([O-])=O,0.2756 | |
| CN1CC1(CC#C)C=O,0.2157 | |
| c1cnc(cc1C#N)O,0.188 | |
| CC(O)C1CCC11CO1,0.317 | |
| CC1CC2(O)CN1C2,0.294 | |
| c1nc2c(o1)CCC=C2,0.1883 | |
| COCCC(O)CO,0.315 | |
| CC12NC1C1OC21,0.2769 | |
| CC1C2NC1(C#N)C2=O,0.2463 | |
| C1C(=O)COC(=N1)C=O,0.1789 | |
| O=C1C2OC2C2CCN12,0.2405 | |
| Cc1cncc(=O)nc1,0.1656 | |
| CC#CC1CC1CC#N,0.2726 | |
| CC1C2CC1C(C)C2,0.3731 | |
| C1OC2C3OCC12CO3,0.3068 | |
| CC12CC1CC2C#C,0.2996 | |
| O=CCC(C#N)N1CC1,0.2298 | |
| N#CC1CC2CNC2=N1,0.2482 | |
| CC1C2C1C1C(C)CC21,0.3098 | |
| COC(C)CC(=O)OC,0.2641 | |
| COc1cc(=O)cco1,0.2015 | |
| C1NC11C2C3C=CC1N23,0.2124 | |
| CC1=C(N)C(=N)ON=N1,0.1628 | |
| C#CC1=CC2C3OC2C13,0.1842 | |
| OC1CCOCC1C#C,0.2971 | |
| OC1CC2CCC3C1C23,0.3196 | |
| CN(C)C(C#C)CC#N,0.2529 | |
| C#CC1=CC2OC2C1,0.1979 | |
| OC12C3C4C1CCC2N34,0.2772 | |
| Cc1c(c(c[nH]1)O)C=O,0.1641 | |
| CCc1cc(oc1)C,0.2348 | |
| CC1CC(C)C(C=O)=C1,0.1927 | |
| O=C1C=CC2(CO2)C1=O,0.1381 | |
| CCCC1=CCCOC1,0.2595 | |
| CC12CC1C1(C)NC21C,0.2714 | |
| CC1(CO)OC(=O)C1O,0.2608 | |
| N#CC1C2NC2C2NC12,0.2865 | |
| CC1(C)NC1C1(O)CC1,0.2923 | |
| N=C1OCC2NC2C=C1,0.2023 | |
| CCOC(COC)C#C,0.2846 | |
| CC1(O)CC1(O)C#N,0.2822 | |
| CC1OC(C#C)C(C)=C1,0.2523 | |
| CC1(C)C2COC2C1=O,0.1973 | |
| Cc1ccc(oc1=O)C,0.176 | |
| CC1CC2(CC2)C1=O,0.2156 | |
| OC1CCC2CC3C1N23,0.2934 | |
| CCC1OCC1(C)C=O,0.224 | |
| CN=c1[nH]cc(o1)CO,0.2111 | |
| C(C#CC#CC(=O)N)O,0.1994 | |
| CC#CC1OCC(=O)O1,0.2747 | |
| CC#CC1OC(=N)C1O,0.2718 | |
| C#Cc1nc(c(o1)N)O,0.1597 | |
| CN1CC1C1CC1(C)O,0.2924 | |
| CC1OCC2(NC12)C#C,0.2659 | |
| CCCc1cc(no1)C,0.2472 | |
| OCC1(CC(=N)O1)C#C,0.2788 | |
| OCCC(O)COC=O,0.2847 | |
| CC12CC1(CO)CCC2,0.3293 | |
| CC1OC2CC2C(C)O1,0.3308 | |
| CC1(C)C2C3OC1OC23,0.3255 | |
| COc1c([nH]c(=O)[nH]1)O,0.2268 | |
| CC12CC1(CC=C2)C=O,0.215 | |
| CC12CC(C1)CC2=NO,0.259 | |
| Cc1cc[nH]c1,0.2515 | |
| CC1C(C)C1OC(N)=O,0.3107 | |
| CC1C2CC1C(O2)C#C,0.2784 | |
| CC(COC=O)CC=O,0.2288 | |
| CC(C)c1cc(co1)O,0.2248 | |
| CC1(C2CO2)C(O)C1O,0.2841 | |
| OCC(CC#C)C#N,0.2961 | |
| COC1(C)C(O)C1C#C,0.2695 | |
| OC1(CC1NC=O)C#C,0.2586 | |
| NC(=[NH2+])C[C-](C#N)C#N,0.1365 | |
| CC1C=CN2C=NC=C12,0.2014 | |
| c1c(n2c(n1)CCC2)O,0.2414 | |
| CC1=CCCCC2CC12,0.2363 | |
| OCCCOC(=N)C#N,0.2242 | |
| CC(N)C(=O)NC(C)=O,0.2138 | |
| CCc1cc([nH]n1)C#C,0.2121 | |
| Cc1ccoc(=O)c1O,0.1725 | |
| N#CC1C2CCOC12,0.2761 | |
| COC(C)C1=NNC=C1,0.2617 | |
| N=C1N=NNN=C1C#C,0.1556 | |
| CC1(C)C2C1C1CC2C1,0.3367 | |
| OC1CC2CC2C11CC1,0.3243 | |
| CC1C2C3OC(C23)C1=O,0.2099 | |
| C1OC1C1C2C3CC2C13,0.3505 | |
| CC#CC1=CCC2OC12,0.1973 | |
| O=C1CC23CC(O2)C13,0.2217 | |
| c1c(c(n[nH]1)N(=O)=O)N,0.1512 | |
| O=CCC1C2C3CC3N12,0.199 | |
| CC12NC1C(O)CC=C2,0.2412 | |
| CC1OCC(O1)C1CO1,0.3384 | |
| OC12CC3C1C2C1CN31,0.3029 | |
| NCC1(NCC1N)C#N,0.2642 | |
| CCCC1(O)CC=CC1,0.2661 | |
| CC1C2CCC3OC2C13,0.3083 | |
| O=C1NC2=CCCC2O1,0.2389 | |
| CC1(C)OC(=N)C1C#C,0.2847 | |
| N=C1CC(CCO1)C=O,0.2271 | |
| CC1N2C=NCC12C#N,0.2374 | |
| c1c(ncn1C=O)N,0.162 | |
| NC(=O)C1C2C3NC3C12,0.2586 | |
| CC1C2C3C4C(N24)C13C,0.3018 | |
| CC(C)(C1CC1)O,0.3358 | |
| CC(O)C1NC1(C)C#N,0.2829 | |
| N#CC12C3C4C3N1C24,0.2363 | |
| c1cnc(c(c1F)N)F,0.2072 | |
| CC1(C=O)C2OC2C1O,0.2232 | |
| CC1C(C)C2=CC=CN12,0.2479 | |
| N#CCOC1=CN=NO1,0.1802 | |
| OC1CN=COCC1=O,0.2092 | |
| CC1(CC2(C1)COC2)C,0.3015 | |
| CCC1(CC(=O)N1)CC,0.282 | |
| CC#CCCC#N,0.2878 | |
| OCC1=NC(CN1)C=O,0.2032 | |
| C1NC1C1OC2CC1C2,0.3152 | |
| CC1(CCCC1)C#N,0.3465 | |
| CCC(C#N)C1CCO1,0.2944 | |
| CCC1(CC1)OC,0.3303 | |
| CN(C1CC1)C(=O)OC,0.2839 | |
| N=C1NC2=C(OCO2)O1,0.1877 | |
| Cc1c(cccn1)NC,0.1943 | |
| N=CN1CC2CN2C1=O,0.2355 | |
| CC(C)c1cnc[nH]1,0.2491 | |
| CNc1ccc(cn1)F,0.1804 | |
| OCC1CCN1CC=O,0.2106 | |
| C1C2C3CC22N=COC132,0.2472 | |
| Cc1c(=O)cnccn1,0.158 | |
| CC(C)(C(=O)C#N)O,0.1909 | |
| C1C2CC3=CCC1C23,0.218 | |
| COC12CC3C1CC23O,0.3282 | |
| CC1(CC1)[NH2+]CC([O-])=O,0.2683 | |
| Cc1c([nH]nn1)C#N,0.2186 | |
| CN1C(CC#N)C1(C)C,0.2637 | |
| CC1CC(O)C1=O,0.2217 | |
| COCC1OCOC1=N,0.2755 | |
| CC(=O)C1NCC1=NO,0.2103 | |
| COC(COC=N)C#N,0.2776 | |
| c1ccnc(c1)O,0.2133 | |
| CCOCCNC=O,0.283 | |
| OC(C1CN1)C1CCO1,0.2838 | |
| OC1C2C3C2C1(O)C3=O,0.2467 | |
| CC12CC1COC(=O)N2,0.2893 | |
| CCOC1C2NC2C1O,0.2989 | |
| CNCc1ncno1,0.2106 | |
| CC1(C)OC(CO)C1O,0.2981 | |
| c1c[nH]c(c1O)C#N,0.2033 | |
| CCC12OC1C1CC21O,0.2874 | |
| CN1CC(C1)(C=O)C#N,0.1799 | |
| CC12CC(OCO1)C2O,0.3183 | |
| CC1=CC2NC2CC1,0.2392 | |
| CC1CC11CC(C)O1,0.3061 | |
| CCOC(=N)C(C)C=O,0.2179 | |
| OC1CC(C#C)C1C=O,0.2122 | |
| CCC(=O)N1CC1C#C,0.254 | |
| Cc1cc(on1)CO,0.2462 | |
| [NH3+]CCC1=C([O-])C=NO1,0.211 | |
| N=C1OCC(CC#N)O1,0.2871 | |
| CC1C2CCC1N=CO2,0.2695 | |
| CC(=O)CCC1(CC1)C,0.234 | |
| CC(CC#CC#N)C#N,0.2439 | |
| CC#CCc1ccoc1,0.2425 | |
| CC1(OC=N)C2CC1C2,0.2826 | |
| OC12COC1C1(CO1)C2,0.285 | |
| CCOc1cc[nH]c1C,0.2241 | |
| CC1=CC2(C)C3CC2C13,0.2244 | |
| OC1C2CC1C=CC=C2,0.1765 | |
| CC1CC1OC(N)=O,0.3151 | |
| Cc1c(oc(n1)C)C,0.2333 | |
| C1COC(OC1)C#N,0.3019 | |
| CC1CC2=CC(C)OC12,0.2357 | |
| CC(=O)C1CCCOC1,0.223 | |
| C1C23COC12CCCC3,0.2971 | |
| COC12CC1C1C2N1C,0.2781 | |
| CC(O)(CC1CO1)C#N,0.3186 | |
| NC(=O)C1OCC(=N)O1,0.2552 | |
| Cc1c(occ1OC)C,0.231 | |
| O=C1OCC=CC2NC12,0.2259 | |
| CC1(CC1)N(C)CC#N,0.2598 | |
| C1CC11CCCC2OC12,0.3395 | |
| O=C1C=C2C3C4C1C2N34,0.1447 | |
| OCC1C2C(O)C2C1=O,0.2229 | |
| CCc1cncoc1=O,0.1925 | |
| C1OC23COC12COC3,0.29 | |
| OC1C2CC1(C2)C1CN1,0.3074 | |
| C1CN1C12CC(C1)OC2,0.3179 | |
| N=C1OCC2NC2C1=O,0.1953 | |
| CC1(CC1)C(O)C1CC1,0.3431 | |
| O=C1C2NC2CC1C#N,0.2101 | |
| CC12CC1COC=N2,0.2513 | |
| CN1C2C3NC3C1C2=O,0.2206 | |
| OC1C2C3N2CC13C#N,0.2653 | |
| NC1(C=CCC1O)C#N,0.2487 | |
| O=C1C=CCC2CC1C2,0.1887 | |
| CCC1=CC(=N)NN=C1,0.1598 | |
| CC1C(CO)C2OC12C,0.3177 | |
| Cc1cc(nc(n1)O)F,0.2241 | |
| CC12CCC11CC(C1)O2,0.3184 | |
| OC12CC3C(C1)C3C=C2,0.246 | |
| c1c(c(c([nH]1)O)O)C#N,0.1886 | |
| CCC(=O)N(C)C=O,0.2274 | |
| CC(C)Nc1c[nH]cn1,0.2168 | |
| OCC1(O)C2NC(=O)C12,0.2451 | |
| CC(C)(O)C1CNC1=O,0.2764 | |
| CCC(O)CC1CCO1,0.3084 | |
| O=C1OC2CC12C1CO1,0.2694 | |
| CCC(C)(N)C#N,0.2918 | |
| CC12C3C4N1C4(CO)C23,0.2792 | |
| CC#CC(=O)N1CC1C,0.2181 | |
| C1OCC2C3OC2C3O1,0.3144 | |
| COC(CC#CC)C#C,0.2756 | |
| N=C1OC2CC12C=O,0.2194 | |
| c1c2n(cn1)CCCO2,0.2318 | |
| CCC1C(O)C1C(C)C,0.3032 | |
| CC(C)(CN1CC1)C#C,0.295 | |
| NC12C3CN=C1OC23,0.1521 | |
| OC12CC3C1OC23,0.3 | |
| C1CC23CC(C2)OC13,0.3185 | |
| CC#CC1C(C)C1CO,0.2806 | |
| Cc1ncc(o1)CC=O,0.2 | |
| c1c(nn(n1)C2CC2)O,0.2219 | |
| C1C=CC2C3OC3CC12,0.2606 | |
| CC12CC1C(=O)NC=C2,0.2109 | |
| c1cncc2c1con2,0.1594 | |
| OC12CCC1C=CC2,0.2614 | |
| CC12OC(=O)C1CC=C2,0.2575 | |
| C1OCC23COCC2C13,0.3467 | |
| CC1(C)NC(=O)NC1=N,0.2596 | |
| CCc1c(c[nH]n1)O,0.2357 | |
| CC#Cc1cc(n[nH]1)C,0.2099 | |
| COC1(CC2NC12)C#N,0.2672 | |
| c1c(nncn1)O,0.1709 | |
| C#CC12CC3C(CC13)O2,0.2748 | |
| NC(CNCC#N)C#N,0.2695 | |
| C1OC1C1=COC=C1,0.2377 | |
| CN1C2C1C1(CN1)C2O,0.3028 | |
| OCC1CCC2CN2C1,0.2875 | |
| CC12CC1C1C(C#C)C21,0.2516 | |
| CC1=CCCC2CCC12,0.2569 | |
| OCC1OCC2CC1C2,0.317 | |
| CC12CC1CC2C(N)=O,0.266 | |
| CCC1NC11CNC1=O,0.2707 | |
| CCCCC1(CC1)C,0.3464 | |
| CCCCCC1CC1O,0.3338 | |
| c1c(ocn1)C(F)(F)F,0.2455 | |
| C1COCC=C1C#N,0.2234 | |
| OCC(O)C1CC(=O)C1,0.2229 | |
| CN1CC(=O)N(C1=O)C,0.2459 | |
| c1c(c[nH]c1CO)C=O,0.1908 | |
| CC1CC1C1OCC=C1,0.2488 | |
| COC1C2CC(=O)OC12,0.2684 | |
| C1CN1C1COC11CC1,0.3022 | |
| c1c([nH]cn1)NC(=O)N,0.2181 | |
| Cn1ccc(=O)c(n1)O,0.184 | |
| CC(C)C(C)C(C)(C)C,0.3638 | |
| CC1CC(CO)C1CO,0.3285 | |
| COCC1C(C)N1C=O,0.2627 | |
| OCC(C#C)C1COC1,0.2862 | |
| CC(O)CC(C)C1CO1,0.3271 | |
| CCCn1cnnc1,0.2664 | |
| CCC1=NOC(=N)N=C1,0.1607 | |
| O=C1CC2OC3C(O2)C13,0.2248 | |
| O=C1CCOCC1C#C,0.2158 | |
| CCCC1(C)C(C)C1O,0.2973 | |
| CC#Cc1ccc(o1)N,0.1798 | |
| CC1C(CO)C2OCC12,0.3058 | |
| CC1N2C3CC1(C#N)C23,0.2668 | |
| OCCC(O)CCC=O,0.2299 | |
| OC12C3C4C5C1C(C23)N45,0.2922 | |
| C1C2COC3CCC12C3,0.3181 | |
| CCC(C)C#CC(C)O,0.2876 | |
| Cc1c(cc[nH]1)C#C,0.2167 | |
| CN1CC(=NO)C1,0.2255 | |
| CC1=NC(=N)NC(O)=N1,0.1961 | |
| CC1C2CC2(C)C=C1C,0.2429 | |
| COC(=O)C1C2CCC12,0.2673 | |
| CC1NC(N)=NC1C#N,0.2625 | |
| C(=O)C#CC#N,0.1843 | |
| CC1(OC1C1CC1)C#N,0.2909 | |
| CC1=CC(=N)NC(=O)C1,0.2115 | |
| COC12C3CC1(C)CC23,0.3033 | |
| CCC1=CNC(=O)NC1,0.2208 | |
| CC(O)(C1CN1)C1CN1,0.302 | |
| COC1(C)C2C3OC3C12,0.2704 | |
| N=C1CN2C=NC=C2O1,0.2068 | |
| CC1NC(C)(C#N)C1=O,0.217 | |
| CC(=N)OCC1CN1,0.2777 | |
| CC1NC1(C)C(O)C#N,0.2562 | |
| CCCOCC1COC1,0.3277 | |
| C1CC1C(=O)N2CC2,0.2511 | |
| Cc1c[nH]nc1C(=O)C,0.2047 | |
| C1CC12CC=CC=CC2,0.1903 | |
| O=C1OCC2CC2C1=O,0.185 | |
| CC1(CNC1=O)C=O,0.215 | |
| CC1CC(O)C1=NO,0.2467 | |
| OC12CC=CC1N1CC21,0.2337 | |
| C1C2C3C4C5NC5C13N24,0.2953 | |
| c1c(n(cn1)CC=O)O,0.17 | |
| CCC1N=C2OC3C1C23,0.1619 | |
| COCC1(C)CC(=N)O1,0.2887 | |
| CCc1cc(c[nH]1)C#N,0.2219 | |
| CC(C#N)N1C=NC=N1,0.2702 | |
| C(=O)C#Cc1nnon1,0.1767 | |
| CC1(CC2CN12)C=O,0.219 | |
| OC(CC(F)(F)F)C#C,0.3007 | |
| NC1C2[NH2+]C(C12)C([O-])=O,0.2672 | |
| C1C2C3C1C2C31COC1,0.3222 | |
| OC1C2NC1C=C2,0.2298 | |
| CC1C=CC2C3CC12C3,0.2543 | |
| CCN1CC1C1CCC1,0.3022 | |
| OC1CC2C=CCC12,0.2581 | |
| CC1C2CC(O)C12O,0.3191 | |
| CC1=CCCC1(O)C=O,0.2034 | |
| COCC(CO)C#N,0.3026 | |
| CC1CC11NC(=O)C1C,0.2725 | |
| CC(C)C1OCC1O,0.3033 | |
| COC12CC1C(C2)C#N,0.2945 | |
| OCC12COC1C(O)C2,0.2994 | |
| c1c(nc(o1)N)N(=O)=O,0.1644 | |
| c1c(nncn1)CCO,0.1641 | |
| c1ncon1,0.2719 | |
| CCC(=NO)CC=O,0.2078 | |
| CC(C)C1(CN1)C(N)=O,0.2656 | |
| N=C1CC2C3OC3C2O1,0.2827 | |
| CCC#CCC(=O)CC,0.2284 | |
| O=C1CN2CC1C(=O)C2,0.1791 | |
| COc1cc(on1)C#C,0.2048 | |
| CN1CC1CCC1CO1,0.3073 | |
| Cn1c(cc(n1)C=O)O,0.1919 | |
| O=C([N-]CC1C[NH2+]1)C#N,0.2276 | |
| CC12C3OC1C(C)(C)C23,0.3073 | |
| CCC12CC(O1)C=CC2,0.2406 | |
| CC1C(C#C)C1(N)C#N,0.2489 | |
| C1CC(C1)C1CCCO1,0.3221 | |
| CC1COCOC(=O)C1,0.271 | |
| OC1CCOC2CC12O,0.3053 | |
| OCC1=NCC2CN12,0.2514 | |
| c1cnc-2oncnc12,0.1336 | |
| CC12CN1C1(C)C(O)C21,0.2814 | |
| CC12CCC1(C)C=CC2,0.2623 | |
| O=C1CC2CNC2=C1,0.2058 | |
| COCC1(C)C2CN1C2,0.2993 | |
| c1c(=O)c(non1)C=O,0.1487 | |
| OC1C(O)C11COCO1,0.2676 | |
| CC(C)C(C)(O)C(N)=O,0.2649 | |
| CC1(O)CC2NC2C1O,0.3051 | |
| CC12CC(C=CC1)C2O,0.2477 | |
| CC1OCCOC1(C)C,0.3136 | |
| CC1=C2CCC2OC1=N,0.2077 | |
| NC1C(O)CC1(O)C#N,0.2867 | |
| COC12CC(CO)(C1)C2,0.3187 | |
| N#CC1=CC2CC2NC1,0.1879 | |
| CC12CC3C1OC23CO,0.3067 | |
| C#CC(=O)CC#N,0.2104 | |
| OCC1OCC(O)CO1,0.3241 | |
| CCc1cn(nn1)CC,0.2486 | |
| Cc1cc(c(cn1)O)F,0.2125 | |
| CC(C)(CC=O)OC=O,0.2243 | |
| O=C1CN=COC1C#C,0.1968 | |
| CN1CC2CC2C1C#N,0.2569 | |
| O=C1OC23CCC12CC3,0.2653 | |
| CN=C1NC(=O)CC1O,0.2417 | |
| CC(=O)C(C)(C#C)C#N,0.2212 | |
| NC1=CC(=O)N=NO1,0.2053 | |
| CC1(CNC1C=O)C#N,0.2076 | |
| C1COC2(CC2)CC1=O,0.2224 | |
| C1OC1C1CCC=CC1,0.2678 | |
| CCN=C(C(=O)N)N,0.2144 | |
| COC(C)C1COC1,0.3079 | |
| NC(=O)C12CC(C1)C2=O,0.2385 | |
| C1C2OC3C2COCC13,0.3248 | |
| O=C1C=CC2CN12,0.1979 | |
| CN(C)Cc1c[nH]nn1,0.2185 | |
| C1C2OC2C11CCC=C1,0.2516 | |
| CC(CC#C)(C#C)C#C,0.2831 | |
| CCc1ccc(o1)CO,0.2261 | |
| C1OC2COC1C1NC21,0.3091 | |
| CC#CCNCC=O,0.215 | |
| c1c[nH]c(=O)c(c1F)N,0.1718 | |
| CC#CC(CO)C(N)=O,0.2716 | |
| CN=C1OCC1C(N)=O,0.2593 | |
| CC(=O)C(=N)OCC#N,0.1939 | |
| CC1CC2N(C=O)C12C,0.242 | |
| CC1NC1C1=NNC=N1,0.2469 | |
| CC1(CN1)C1COCO1,0.3202 | |
| CC12CC1(O)CNC2=O,0.2661 | |
| OCCN1CC1C#C,0.2665 | |
| CC1=CC2NC3C2OC13,0.2303 | |
| CCc1c(nn(n1)C)O,0.2271 | |
| CC1CCC2CCC12O,0.3171 | |
| CC12C3OC4C1C4(C)C23,0.3155 | |
| OCC1(O)CCC2OC12,0.312 | |
| CC1(C)C2NC(=O)C12N,0.2303 | |
| CN1CCn2c1ccc2,0.2229 | |
| NC1=CC(=N)NC(=O)N1,0.2063 | |
| C1C2OC22CC1CCC2,0.3242 | |
| CN1C2C(=O)CC12C=O,0.1888 | |
| O=CC1(NC1C#N)C#N,0.2197 | |
| Cc1cc(oc1)N=CN,0.1751 | |
| OCC1=CCC2CC12,0.2487 | |
| CC(C)C(C#N)C1CN1,0.2808 | |
| C1C2N3C1C21C=CCC31,0.2248 | |
| CCC1C2CC1N=CO2,0.2605 | |
| C1CC23OC(C=C2)C13,0.2207 | |
| O=C1NC2CC2C1C#N,0.2616 | |
| O=CC1C2CCC2C1=O,0.2082 | |
| O=C1NC23CCC2OC13,0.2392 | |
| CC(C)CC(=O)OC=N,0.2527 | |
| O=C1OC2OC1C=C2,0.223 | |
| CC12CCC1CC2C#N,0.3096 | |
| C1CC11OC2CCC12,0.2982 | |
| OCC1OC2C1NC2=O,0.2485 | |
| CC1CNC(=N)C(=N)O1,0.1998 | |
| N#CCC1OC2CNC12,0.2851 | |
| CC(C)OCCO,0.3337 | |
| CC1(C)C2CC1(O2)C#N,0.256 | |
| CCC1(C)C2C3OC3C12,0.2822 | |
| CC1C(O)C1(O)C=O,0.2212 | |
| N#CC1CN2CC(C2)N1,0.2515 | |
| OC1COCOCC1O,0.309 | |
| CC1C2C=CC3C2C13C,0.2317 | |
| Cc1coc(n1)CNC,0.2346 | |
| CC1(CO1)C1OC2CC12,0.3133 | |
| CC1(O)COC2CC1C2,0.2985 | |
| C#CC1COC11CCC1,0.2818 | |
| OCC12C3NC1C(=O)C23,0.2205 | |
| CNC1=CC(=N)C=NN1,0.1678 | |
| c1ncnc(n1)C(=N)N,0.1732 | |
| CCN(CC(=O)N)C=O,0.2445 | |
| c1c(c(n[nH]1)N)NC=O,0.2171 | |
| CC12C3C4C5C(C15)C2C34,0.3232 | |
| OC12CC1CC=CC=C2,0.1852 | |
| c1c(non1)C2(CC2)O,0.2268 | |
| NC1=CC(=O)C2OCC12,0.1923 | |
| C1CC1C(=O)CC#N,0.2365 | |
| Cc1cc2ccoc2o1,0.2199 | |
| CC(O)CC1COC1=O,0.2809 | |
| CC(=O)C12OC3C1CC23,0.2156 | |
| CCC1(CN1C)C=O,0.215 | |
| ON=C1CC(C1)C=O,0.2228 | |
| CC12OC3C(OC1=N)C23,0.2441 | |
| CCC1(C)OC(=O)C1O,0.2656 | |
| O=CCC1(CO1)C1CO1,0.2216 | |
| NC1=NC2CC2(N1)C#N,0.2433 | |
| COC1CC2CCC12,0.3198 | |
| CC1(CC1)C#CCO,0.2704 | |
| OC1C2N3CC1C23C#N,0.2633 | |
| O=C1CCC11CC1C#C,0.2106 | |
| CCC1CC1(O)CC=O,0.2187 | |
| c1c(c[nH]c1NC=O)O,0.1849 | |
| CC1(CCC(=O)NC1)C,0.2664 | |
| c1coc(n1)CC2CC2,0.2436 | |
| CCc1cncc(=O)[nH]1,0.1693 | |
| CCC1(O)C(C)CC1O,0.2985 | |
| COC(=O)c1ccn[nH]1,0.2177 | |
| OCCC1CC(O)CO1,0.3133 | |
| CCCCCCNC=O,0.2834 | |
| CC1(O)COC(=O)C1=O,0.1665 | |
| O=C1CC23CC12C=CC3,0.2192 | |
| CCC12NC1CC21CC1,0.2969 | |
| OC12C3CN3C3C1CC23,0.2996 | |
| C1C(CC1=O)C#CC=O,0.1929 | |
| CCC1COC2CC2C1,0.3009 | |
| CC(C#C)C1=NOC=N1,0.2425 | |
| CNc1cnc(cn1)F,0.1678 | |
| FC(F)(F)C1CC2NC12,0.3098 | |
| C1CC1C1CC2CC1C2,0.3554 | |
| OC12CC1(C#N)C1NC21,0.2676 | |
| CC1C2NC1(C#N)C2O,0.267 | |
| C1CC12CC(C2)(C#N)N,0.2928 | |
| N=C1C=C(NC=N1)C#N,0.1606 | |
| c1c(nn[nH]1)OC2CC2,0.2224 | |
| CC12CC3OC3(C)C1O2,0.3324 | |
| CC(=O)C1C2NC(=O)C12,0.2085 | |
| CC1OCC1OCC#C,0.2745 | |
| N#CC12CN1CC21CO1,0.2542 | |
| CC1(C2CO2)C2CC1C2,0.351 | |
| Cc1coc(n1)N(C)C,0.2274 | |
| O=CCC1OC1C#C,0.223 | |
| CC(C)C1C2OC(=O)C12,0.276 | |
| CC1(O)C2C3CC3C12C,0.2753 | |
| CC1COC(C)C1C,0.3138 | |
| CC12C3C4C(C4C1=O)N23,0.2095 | |
| CC(O)CCN(C)C=O,0.2721 | |
| CC12CC1(OC=N2)C#C,0.2484 | |
| Cn1ccc(c1)CC=O,0.1991 | |
| C(CC#N)CNCC#N,0.2737 | |
| O=CNC12CCC1CC2,0.2715 | |
| CC(CO)C12CCC1N2,0.3157 | |
| O=C1CC=C2CCC2O1,0.2442 | |
| C(N1CC1)C12CC(C1)O2,0.3246 | |
| CN=c1[nH]cc(o1)C#N,0.1734 | |
| COCCNCC#N,0.271 | |
| CCCN(C)C(=N)C#N,0.1972 | |
| CC1CC=CCCCO1,0.2524 | |
| CC(O)C12CC(C1)C2,0.3293 | |
| CC12CC1C1OC21,0.293 | |
| O=CC1C=CC2CC12,0.2162 | |
| CCC(N)(C[NH3+])C([O-])=O,0.2722 | |
| C#CCN1CC(C1)C=O,0.2108 | |
| CC1=CC2NC2C11CC1,0.2354 | |
| CN1CC1(CO)C#C,0.2704 | |
| Cc1cc(on1)NC=O,0.2114 | |
| C(=N)(C(F)(F)F)N,0.2653 | |
| CCC(=O)COC(=O)N,0.2353 | |
| CCN1CC1C#CC#N,0.2034 | |
| CC1C2CC3OC3C12C,0.328 | |
| C1NC1C#CC1CN1,0.2546 | |
| COc1nc(no1)N,0.2483 | |
| OCC1OC(C=C1)C#N,0.2435 | |
| CC1C=CC2OC2C=C1,0.2273 | |
| O=CC1(OC1C#C)C=O,0.1881 | |
| CN1CC11C=CC2OC12,0.2143 | |
| CCN(C)C(CN)C#N,0.2655 | |
| OC12CCC1CN1CC21,0.3067 | |
| CC1=CCC2C3OC2C13,0.2469 | |
| CC12OCC1NC2=N,0.2546 | |
| CCC1(C)CCOC1=N,0.2872 | |
| CC(CO)C1C2CC1O2,0.305 | |
| CC1(CO)CC(=O)N1,0.2762 | |
| NC1C2CC2OC1=O,0.246 | |
| CC(=O)C(C)(C=O)C=O,0.1886 | |
| c1c2c([nH]n1)CC(=O)O2,0.2154 | |
| COCCC1CC1C#C,0.2912 | |
| OC1(CNC1C=O)C#N,0.2043 | |
| CC(C)C1COCOC1,0.3324 | |
| Cc1cc([nH]c1)C2CC2,0.2328 | |
| O=C1CNCC11CN1,0.1915 | |
| CC1(C)CC2NC1C2=O,0.232 | |
| C#CC1OCC(O1)C#N,0.2865 | |
| CC12C(O)C1CC21CN1,0.2928 | |
| OC1(CN2CC12)C1CO1,0.2895 | |
| OCC1CCC11CCO1,0.31 | |
| CCC1C(C)C1NC=O,0.2711 | |
| CC1COC2C3CC3C12,0.3133 | |
| c1c(c2c([nH]1)[nH]nn2)O,0.1982 | |
| CC1C2C3CCC1C23O,0.3076 | |
| C1C2C=CC3CC=CC123,0.2258 | |
| CC(O)C1C2C(C)CN12,0.2957 | |
| CC12CCC3C1C2C3=O,0.2344 | |
| CC1CC2CC1(CO)C2,0.3394 | |
| COCCc1cc[nH]n1,0.2657 | |
| NC(=O)C12CC(O1)C2=O,0.2343 | |
| CC(C)(C#N)NC,0.2745 | |
| C1CC1C(CO)(CO)O,0.298 | |
| CCC1COCCOC1,0.323 | |
| CCCC1(O)C2CCC12,0.3131 | |
| CCC1(CC1)C#CC,0.287 | |
| O=CCCC1OC1C#N,0.2284 | |
| C#CC12CCC1CCC2,0.2977 | |
| O=C1OC2CC3OC2C13,0.2517 | |
| CC1=CC2OC1C2(C)O,0.2352 | |
| O=C1COC(O1)C#N,0.277 | |
| CC1OC1(C)C1CCO1,0.315 | |
| CC1(C)COC(=N)C1,0.2863 | |
| O=C1C2CC3CC2CC13,0.2282 | |
| CN(CCC([O-])=O)C=[NH2+],0.2378 | |
| CC1CC2C3OC2C3C1,0.298 | |
| O1C2C3C4C5C4C(C23)C15,0.3028 | |
| O=C1OC23CC2(CC3)O1,0.2843 | |
| C1C2C3C4C=CC(C13)C24,0.2472 | |
| CC1=CC2C3C2C(=O)N13,0.1991 | |
| C1NC23COC2=NCC13,0.2316 | |
| CCC1(O)CC1(C)C#N,0.3092 | |
| COC1COC(=O)C1O,0.2612 | |
| CCC#CCC(=NO)C,0.2549 | |
| NC1=COC(=N)N1C=O,0.1875 | |
| CC1C2CC1(C)C2=O,0.2476 | |
| C1C2OC3CC3C12,0.3135 | |
| CC1(O)C2CN2C1=N,0.2467 | |
| OC1CC2C3CN3C2C1,0.2842 | |
| OCC1CC2(O)C(O)C12,0.3019 | |
| CC(=O)C(C=O)(C=O)O,0.1952 | |
| Cc1n[nH]c2n1nnn2,0.2218 | |
| COC1CC1(C)CCO,0.313 | |
| O=CN1C2COC(=O)C12,0.2402 | |
| CC1C2NC2C2NC12C,0.2863 | |
| C(=O)c1c(c(on1)N)N,0.1409 | |
| c1c2c([nH]n1)nco2,0.2145 | |
| CC12CN1CC(=C2)C#C,0.191 | |
| CC1CCOC1(C)C#N,0.2956 | |
| CCC12CCC1OC2C,0.3045 | |
| CC(C)OC(=O)CN,0.262 | |
| OC12CC1C=CC21CO1,0.225 | |
| CC12CC(=O)C1CC=C2,0.2197 | |
| OC1=CN=C(F)OC1=N,0.1799 | |
| CN1CC23COC2C1C3,0.258 | |
| CNC(CO)(C#N)C#N,0.2568 | |
| CCOC1(COC1)CO,0.3125 | |
| c1c(n[nH]c(=O)n1)CO,0.1693 | |
| COC1(CO)CC1C#N,0.2869 | |
| C(=O)n1nc(nn1)O,0.1951 | |
| CC1(CCC1O)C=O,0.2231 | |
| C1OC1C12NC1C1OC21,0.2682 | |
| NC1=CC(=N)OC(O)=N1,0.1856 | |
| CCC(O)C1(CC1)C#N,0.3035 | |
| CCOCC(O)CCO,0.3264 | |
| CCC12OCC1NC2=O,0.249 | |
| C#CCCOC(=O)CO,0.2838 | |
| CC(C)C(O)C1OC1C,0.3216 | |
| CCc1c(con1)NC,0.2107 | |
| COC(C)C1(C)CN1C,0.2973 | |
| CC1(C)OC2C1NC2=N,0.2533 | |
| CC#CC1OC(C)C1=O,0.2069 | |
| COCCNC=O,0.283 | |
| C1NC11C=C2CC3C2C13,0.1739 | |
| OC1CC1C1(CO1)C#C,0.2522 | |
| CC#CC1=CC2CC1C2,0.189 | |
| CC#CC12CNC1CN2,0.2541 | |
| COC1CCOC2CC12,0.321 | |
| CNC1C(NC1=N)C#N,0.2436 | |
| CC12CC3(C)CC1C2C3,0.3332 | |
| OCC12CCC1COC2,0.3151 | |
| Cc1cc(ccn1)OC,0.2379 | |
| c1nc(c(=O)on1)F,0.1796 | |
| CC(C)C(CO)C1CO1,0.3237 | |
| OC1CC2C3CC(=C1)C23,0.216 | |
| CC1=C(N=NO1)C1CN1,0.1995 | |
| Cn1cnn2c1nnn2,0.2354 | |
| CC1CC2(O1)C1CC2O1,0.3128 | |
| Cc1cc2n(c1)CC=C2,0.1729 | |
| CCC(=O)CCNC=O,0.2322 | |
| C1C2CN1C1=CNC=C21,0.2576 | |
| CC1OC1CC1(C)CC1,0.3311 | |
| O=CCC12CC1CCC2,0.2231 | |
| CCC1CCC1C(C)=O,0.2272 | |
| OC12C3CCC1OC23,0.2916 | |
| CC12CN1C(CO)C2O,0.2944 | |
| CC1CC1NC(N)=O,0.2952 | |
| O=C(C#C)C1(CN1)C#N,0.1963 | |
| CCCc1cn[nH]c1C,0.2504 | |
| CNc1cnc(nn1)O,0.1521 | |
| OCC1OCCC1=O,0.215 | |
| CC12CC(O)C3OC1C23,0.3005 | |
| Cc1c([nH]nc1NC)O,0.235 | |
| CC1OC(=N)OC1C,0.308 | |
| C#CC1(CO1)C1CC1,0.2851 | |
| O=C1CC23COCC12N3,0.2181 | |
| C1OC1C12CCC1CC2,0.3417 | |
| O=C1C2CCC3CN2C13,0.2056 | |
| OCC(=N[O-])C1CC[NH2+]1,0.1188 | |
| c1[nH]c(c(n1)N)CCO,0.2187 | |
| NC(C1CC1)C(F)(F)F,0.3386 | |
| c1cnc([nH]1)OCC=O,0.1785 | |
| COC1OCC=CC1=O,0.1807 | |
| Cn1ccc(c1O)N,0.2337 | |
| c1c2c(c[nH]1)C=CC2,0.2005 | |
| CC12CC3C1C2(C)C3=O,0.2448 | |
| CC1(C#C)C2OC2C1=O,0.2029 | |
| CNc1c(n[nH]c1O)N,0.2542 | |
| CC1CC2C(=O)CC12O,0.2194 | |
| COCc1conc1O,0.2536 | |
| OC1(CCC=C1)C1CO1,0.2551 | |
| N=C1OCC2OC2C=C1,0.2013 | |
| CC(=NO)C#CCC#N,0.2041 | |
| c1cnc(c(n1)CO)F,0.1983 | |
| NC(=O)N1CC1CCO,0.2632 | |
| CCC1(COC1)NC=O,0.2588 | |
| CC1=CC(=O)C2NC12,0.1804 | |
| CC1CC11CC=CC1C,0.263 | |
| C(=O)c1nc(on1)C=O,0.1708 | |
| CCC#CC1CCCC1,0.2967 | |
| CCC1=CC2CC1(C)C2,0.2336 | |
| CN(C=O)C(=N)N1CC1,0.2358 | |
| CCC12C3CC1C(=O)N23,0.2498 | |
| CC1CNC=CC1=NO,0.1792 | |
| OC1C2COC2CC1=O,0.2195 | |
| Cc1c(n(cn1)C=O)O,0.1741 | |
| O=CC1C2C3CC1CN23,0.2131 | |
| N=C1NC(=O)C2CCC12,0.2472 | |
| CC(CC1CN1C)C#C,0.278 | |
| COC1(CCOC1)C=O,0.2093 | |
| CC1(C)C2NC1C21CO1,0.3131 | |
| Cc1ccc(cc1)C=O,0.1927 | |
| NC12CC1(NC2=N)C#N,0.2265 | |
| CC1OCC(=O)C2CC12,0.2162 | |
| OCC1NCCOC1=N,0.2475 | |
| c1c(nc([nH]1)N)O,0.2281 | |
| CC1CC2(CN2)C1(C)O,0.3089 | |
| CC1(C)CC=CC1C#C,0.2601 | |
| CC12CN(C1)C2C1CO1,0.3035 | |
| O=C1C2C3C1CN23,0.228 | |
| c1c(c(ncn1)F)C#N,0.207 | |
| CC(=O)C1(CC(=O)C1)O,0.2195 | |
| COCCC(C)C1CC1,0.3382 | |
| N=C1OC(=O)OC=C1,0.2155 | |
| N=C1OCC2=C1C=NN2,0.2364 | |
| CCNC(=O)C(C)C#C,0.2722 | |
| c1cc(cnc1)N2CC2,0.2 | |
| CC1(O)CC2OC1C=C2,0.2529 | |
| CC#CC1(CC1)C#C,0.2621 | |
| C1C2OC=NC3CC2C13,0.2563 | |
| CC1CC1C1CCC=C1,0.2631 | |
| OC1(CC11CCN1)C#N,0.2393 | |
| c1c[nH]c(cc1=O)O,0.2052 | |
| CC1NC1CC#CC=O,0.2008 | |
| CCCOCC(C)C#C,0.313 | |
| CC1(O)C2C3CC3(O)C12,0.311 | |
| OC1C2C3(CC3)CC12O,0.3042 | |
| OCC1C(O)COC1=O,0.2631 | |
| CCC12COC1C2O,0.2904 | |
| c1cc(c(c(c1)O)O)N,0.2193 | |
| CC1=C(OC=N)C=NN1,0.2374 | |
| Cc1cnc(o1)C#N,0.2001 | |
| C1C2(CO1)C(=O)C=CN2,0.1849 | |
| Cn1ncc(n1)OC,0.2287 | |
| CC(O)COCC#N,0.2752 | |
| CC12OC1C1CCC2C1,0.3412 | |
| OC(C=O)C1=CC=NO1,0.215 | |
| C1CC2C1C21CCCC1,0.3332 | |
| O=C1CC=C2CCCC12,0.2247 | |
| NC=[NH+]C1=NC(O)=N[N-]1,0.1131 | |
| CC(C)n1ccc(n1)N,0.2302 | |
| CC(C)(CCC#C)OC,0.3109 | |
| CC12CCC1(CC=O)N2,0.2005 | |
| c1cc([nH]c1)OCC#N,0.2025 | |
| CC(O)(C#C)C1CC1,0.2989 | |
| COC(CO)CC(C)=O,0.2283 | |
| CC1OC1(C)C(=O)C=O,0.1484 | |
| CC1N=COC(=O)C1C,0.2482 | |
| Cn1nc(c(n1)N)N,0.2075 | |
| N=COC1CC(=O)CO1,0.2224 | |
| CCCCOC(=O)C#N,0.2469 | |
| CC1CC(C=O)C1=NO,0.218 | |
| CC1=CC2OC2C1C=O,0.2097 | |
| C1OC2CC3CC12CO3,0.3195 | |
| C1CC=C(C1)C#N,0.2206 | |
| CC(=O)C(=O)C#N,0.1501 | |
| Cc1coc(c1C=O)C,0.1842 | |
| CCC(C)C1OC1C=O,0.2164 | |
| CC1CCC=CC1(C)O,0.2582 | |
| CN=c1cnoc(n1)F,0.195 | |
| CC1CC=C(C)C11CC1,0.2465 | |
| C1OC11CCC11CO1,0.3056 | |
| CN1CC(CCO)C1=O,0.2781 | |
| CC1OC1C(C)(C)O,0.3142 | |
| CC1OC(CC#N)C1C,0.2944 | |
| CC12CNC1(C#N)C2N,0.2287 | |
| OC1CC2C3CC2(O)C13,0.3142 | |
| ON=C1CCC(O)C1O,0.244 | |
| CC1OC(=O)C1(C)O,0.2628 | |
| OC1C2C3CN2C13,0.2943 | |
| CCC(C#C)C(C)CO,0.3084 | |
| NC1=NC(O)=NC(=N)O1,0.2089 | |
| CN=C1C=CNC(F)=C1,0.1796 | |
| C1CC2(O1)C1CC2OC1,0.3041 | |
| CC12CC3OC1C3C2O,0.2996 | |
| CC(=O)OC(=N)CCO,0.2713 | |
| C1C=CC2N=COC12,0.2557 | |
| CC12C3CC1CC2C3,0.3369 | |
| Cc1c(c[nH]c1N)N,0.231 | |
| CC1(CC1(C)C=O)C=O,0.2004 | |
| C1CC1C1COCCO1,0.3235 | |
| C1CC2CC3NC3C2O1,0.2937 | |
| OCC(=O)CC1CCO1,0.2194 | |
| Cc1coc(=O)[nH]1,0.2418 | |
| OCC1(O)C2OC(=O)C12,0.2579 | |
| CC1(NC1CO)C#N,0.2787 | |
| C1COc2c1oc(=O)[nH]2,0.2294 | |
| Cc1c(cnnc1N)O,0.1953 | |
| CC1NC1(C)C(=O)C#C,0.1878 | |
| CCN=c1[nH]cc(o1)O,0.2318 | |
| CC(C=O)C1(CO1)C#N,0.2233 | |
| COC(C)C(C)CCO,0.3281 | |
| O=C1NC(C#C)C2CC12,0.2674 | |
| CCCCC1CC1C=O,0.2286 | |
| CC12OCC3CC1(O)C23,0.2891 | |
| Cn1cccc1CC#N,0.2346 | |
| CC(C)C(C#N)N(C)C,0.2625 | |
| N=COC(CC=O)C#C,0.2219 | |
| N=C1CC(=O)C(N1)C#N,0.2018 | |
| N1C=CC=CC=CC=C1,0.1678 | |
| CC1N=COCC2NC12,0.2636 | |
| CC(=O)OCCCCO,0.2849 | |
| C1C=CCOCC1=O,0.2177 | |
| CC1COC1=NCCO,0.2633 | |
| CC(C)(O)C1CCC1=O,0.2179 | |
| O=CN1CC2C3CC2C13,0.2682 | |
| CC(O)C1=NC=CN1C,0.2386 | |
| CC1NCC(=O)N2CC12,0.2314 | |
| C1CN1C1COC=NC1,0.2704 | |
| COCC12CCC1(C)N2,0.2873 | |
| Cc1coc(n1)CN,0.2424 | |
| OC12CC1CC(=O)C2,0.2225 | |
| C1C2C3C4C1C=CC2N34,0.2318 | |
| COC1C2CCC=CC12,0.241 | |
| C1CN(C(=O)CN1)C=O,0.1955 | |
| NC(=O)C(C=O)N1CC1,0.2152 | |
| CCC1(CC1C)C#N,0.3159 | |
| CC1=CCCN1C(=O)C,0.2111 | |
| CC(C)(C)c1cnoc1,0.246 | |
| c12c(nc([nH]1)O)nn[nH]2,0.2156 | |
| OCC1CC=CC2CC12,0.2472 | |
| OC1CC11OC(=N)C=C1,0.1922 | |
| CCOC(=N)CC,0.2956 | |
| CC1OC2CCC2=C1,0.2362 | |
| C1OC11COCC2NC12,0.3064 | |
| CC#CCC#N,0.2899 | |
| OC1COC(=O)NC1=O,0.2522 | |
| C(C(=O)C(=O)C(=N)N)O,0.1742 | |
| C1CC23C1CC1C2CN31,0.303 | |
| C1CC1c2nc(on2)N,0.2408 | |
| CCc1cnn(n1)CC,0.2483 | |
| C#CCOC1CC1C#N,0.2826 | |
| FC1=COC(=N)N=C1F,0.1685 | |
| CNC(CO)C(=N)OC,0.2343 | |
| CCC1CCOC2CC12,0.319 | |
| CC(=O)c1cn(cn1)C,0.2059 | |
| Cc1cnc(nc1)F,0.2132 | |
| O=C1OCC2OC3C2C13,0.2584 | |
| C#CC1(CNC1)C#N,0.2556 | |
| CC1=C(O)C(=N)NC=N1,0.1793 | |
| O=CCC1C2CCCC12,0.2255 | |
| CC(OC(N)=O)C1CN1,0.2936 | |
| OC1CCOCC=CC1,0.2485 | |
| COCC1OC(=N)C1N,0.2691 | |
| CN1CC1CNC(N)=O,0.2792 | |
| CC1C2OC2CCC1=O,0.2279 | |
| N#CC12C3C4C1CC2N34,0.2559 | |
| CC1OCC=CC1C#C,0.2551 | |
| C1C2C3C4CC=C3C1N24,0.1681 | |
| CC1(O)CC(O)C1C#C,0.2961 | |
| OC1=NN2C3CC3C2=N1,0.2142 | |
| Cc1c([nH]nc1OC)O,0.2553 | |
| CN=c1oc(no1)C=O,0.1553 | |
| C#CC1CCCOC=N1,0.2603 | |
| COC1(C)C(C)CC1=O,0.1986 | |
| COC(CO)C(=O)OC,0.2645 | |
| COC1C2CC1C2C#C,0.2919 | |
| Cc1c(nc(o1)O)NC,0.217 | |
| O=C1NCC2CN=CN12,0.2459 | |
| CC1NC11CNC1C=O,0.2059 | |
| CC12COC1(C)CO2,0.3071 | |
| CC12CC1C(C)(O)C2O,0.3097 | |
| CCC1N2CC2(C)C1=O,0.2175 | |
| CC1(C)OCC2OCC12,0.3157 | |
| OC(CNC=O)C=O,0.2065 | |
| CCC12NC1CC2(C)O,0.2956 | |
| C#CC1=NCCCCO1,0.2156 | |
| NC1(CC1)C1(CO1)C#N,0.2515 | |
| CC1(C#N)C2NC(=O)C12,0.2375 | |
| ON=C1C2COCC1N2,0.25 | |
| COc1cnc(o1)C=O,0.1667 | |
| C1OC2C=CCC=CC12,0.2303 | |
| C#CC#CCOCC=O,0.2189 | |
| CC1CCC(C)(O1)C=O,0.212 | |
| CC1CCC2(O)CC12O,0.2929 | |
| CC12CC3(C)C1CC23O,0.3177 | |
| CC1OC2C(C)(C)C12O,0.2817 | |
| CCC1(COC1)C(C)C,0.313 | |
| OCC1COC1C1CN1,0.3098 | |
| CCC1COCO1,0.34 | |
| CNC(CO)(C=O)C#N,0.22 | |
| O=CC1CCCC11CN1,0.2199 | |
| CN1CC1CC(C)(C)O,0.2815 | |
| COC1OC(C)C2NC12,0.3143 | |
| OC12CCC1OC21CC1,0.2983 | |
| CCC(CC1CO1)C#N,0.3093 | |
| CC12CC(O)C1C(=O)C2,0.2177 | |
| OCC1COC2CCC12,0.311 | |
| CC(C)C1(CC1)C1OC1,0.3413 | |
| CC(=O)C12CC(N1)C=C2,0.2178 | |
| OC1C2C3OC3(C#N)C12,0.2708 | |
| CN=C1N2CC2C11CN1,0.241 | |
| O=CC1N=COC11CC1,0.2046 | |
| OC12C=CCC1OC2=N,0.2504 | |
| CC(=O)C1CC1CC#C,0.2282 | |
| CC12CCC1=CC(=O)N2,0.2119 | |
| CC1(O)CC1C1CCC1,0.3201 | |
| C1C2(CO1)COC2=O,0.2595 | |
| ON=C1CC2C(O)C12,0.2438 | |
| CC12CC1C=CC(=O)N2,0.2033 | |
| C1CC2OCCCC2=C1,0.2484 | |
| O=C1CC2CC2N1,0.266 | |
| C1CC(=NO)C(=C1)C#N,0.176 | |
| O=C1NC2CCCCC12,0.2741 | |
| Cc1c2c(c[nH]1)onn2,0.1687 | |
| OCC1CCC(CO)O1,0.3201 | |
| CC1NC(C#C)C1=NO,0.2353 | |
| CCC1(O)CC1C=O,0.226 | |
| CC1(CO1)C1=NON=N1,0.2108 | |
| CC1(C)C2N1C1CC21O,0.2768 | |
| CCC(O)(CC#N)C#C,0.2928 | |
| OC1CCC2=C1C=NO2,0.2387 | |
| OCC1CC2C3CC1C23,0.3284 | |
| O=CN1CC2CC(=O)C12,0.1954 | |
| N=C1C=CNC=NC1=N,0.1829 | |
| C1C(CC1=O)C(=O)N,0.2273 | |
| CCNC1C2NC2C1=O,0.1984 | |
| COCC1OC(=N)C1C,0.2874 | |
| O=CC12COC1CO2,0.2061 | |
| C1NC11CN2CC3C2C13,0.2994 | |
| O=CC1(CC2NC12)C=O,0.1945 | |
| CN1CC(C1)C#CC=O,0.1688 | |
| CCC1NC1(CO)C=O,0.2218 | |
| C1NC2C3OC12C1NC31,0.2894 | |
| c1c(onn1)CN2CC2,0.2251 | |
| CNC(=O)NCC1CC1,0.3035 | |
| CN=C1OC(=O)CC1N,0.2451 | |
| CC1C2CC3N2CC13O,0.2939 | |
| CC1OC2CC12O,0.3012 | |
| NC1=NC2CC2CC1=O,0.1592 | |
| OCC1NC11CC(=O)C1,0.2165 | |
| CC1COC2CC(=O)C12,0.2099 | |
| c1c(nno1)C2COC2,0.2149 | |
| CCC(=O)c1cnon1,0.1947 | |
| NC1(C([NH3+])C1O)C([O-])=O,0.2682 | |
| OC1CC1C1=CC=CN1,0.2363 | |
| CC(=NO)C(C)(C)C#N,0.2519 | |
| C1OC2OC3C4NC13C24,0.3 | |
| C#CC1=CCCC=CC1,0.2106 | |
| OC1CC=CC=CC1,0.1909 | |
| OCC1(OC1C#C)C=O,0.2054 | |
| CC1NC(=O)C1N(C)C,0.2496 | |
| c1c(c(no1)C#N)C=O,0.1985 | |
| CC(=O)NC1CN2CC12,0.2687 | |
| CC12CCOC(=O)C1N2,0.2534 | |
| CCCC(=O)CCC=O,0.2279 | |
| OCCC1CC2OC2C1,0.3364 | |
| CC(=N)Nc1ncco1,0.2188 | |
| N#CC#CCC1CO1,0.2403 | |
| c1c(=O)ncoc1F,0.2113 | |
| CC12COC1(C)C(=N)O2,0.2663 | |
| CCC(=O)CC(=O)C,0.2095 | |
| CC1(O)C2OCCOC12,0.2992 | |
| C1NC11C2COC1C=C2,0.2344 | |
| CC1(CO)CCC2CC12,0.3221 | |
| O=COC1CC2NC2C1,0.2636 | |
| CCC(C)OC,0.3341 | |
| CC(O)C1=NC(C)=CN1,0.2468 | |
| CC12NC1C(N)=CC2=O,0.1922 | |
| CC12CC(=CC1N2)C#N,0.1943 | |
| CC12C(O)C1OC2=N,0.2634 | |
| O=C1CC2OC3(CC3)C12,0.2098 | |
| c1c(nc([nH]1)CC#N)O,0.2227 | |
| OC1CC2C3N2C1C3=O,0.2249 | |
| CC1CC(O1)C1CCC1,0.3243 | |
| CCOC12CCC1CC2,0.319 | |
| CN1CC1(C)C1CCO1,0.3032 | |
| CN1CC1C1=CNC=C1,0.2401 | |
| OCC1C(OC1=O)C#N,0.2727 | |
| CC1CC(CO)NC1=O,0.2735 | |
| OC1CCC11CC=CC1,0.2647 | |
| CC(C)OCC1CC1,0.3328 | |
| CCC1C2CN2C1C#N,0.2627 | |
| C1C2C1C1C2C1N1CC1,0.2866 | |
| C1CC11OC2C3CN3C12,0.279 | |
| OC12CC3CCC1C2O3,0.2893 | |
| CC1CC2(CCC12)C#N,0.3038 | |
| CCC1(C)N=CNC1=O,0.2294 | |
| CC1COC1=NCC#N,0.2768 | |
| C(C#CCO)C#CC=O,0.1974 | |
| CC1C2OC(C)(C#N)C12,0.2637 | |
| O=C1NCCCC11CN1,0.2661 | |
| OC12CC3C4CN3C1C24,0.293 | |
| C1NC11CCC=CC=C1,0.1824 | |
| C1COC(=O)C=CC=C1,0.1796 | |
| CC(=O)Oc1ncno1,0.2612 | |
| CCC1CC2C1OC2=N,0.2844 | |
| CCCC1CCNC1=O,0.2693 | |
| CN1C(=N)CCCC1=O,0.242 | |
| CN=C1CC2CCC2O1,0.2736 | |
| CC1C2C3CN2C1C3=O,0.2062 | |
| CCN1CCC1C#N,0.2538 | |
| CCc1c(onn1)N,0.2085 | |
| CC1=CC(=NO1)C1CN1,0.2266 | |
| OC1CCOC2CC2C1,0.3149 | |
| C1C2NC1C21CN=CO1,0.2556 | |
| CC(O)CC1=NON=N1,0.217 | |
| CC(O)C1=NC(C)CO1,0.2695 | |
| CC(CO)C1(CO)CN1,0.3032 | |
| CNC(=O)C(C)C(C)C,0.2781 | |
| NC(=O)OC1CCC1=O,0.2182 | |
| O=C1CC2CCC=CC12,0.2093 | |
| OC1CC2=CCC(O)C12,0.2488 | |
| OCCCC12CCC1O2,0.3223 | |
| CN(C)C(=O)OCC#C,0.2684 | |
| c1c(nnn1C=O)C#N,0.2007 | |
| CC1(CC(N)=O)CCO1,0.2682 | |
| CC12C3C(CN13)OC2=O,0.2537 | |
| CCCC1C(C)C1C#C,0.2875 | |
| Cc1c(c(no1)N)NC,0.2349 | |
| COC1CC2CC(C2)O1,0.3386 | |
| OCC12OCC1CC2=O,0.1974 | |
| CC(=O)CC=O,0.2124 | |
| ON=C1CC2OC1C2O,0.2461 | |
| CCC12CC1C1(C)NC21,0.2814 | |
| OCCC12C3CN1CC23,0.3024 | |
| CC1CN=C(CC#C)O1,0.2659 | |
| OC1CC2(CC2)CC1O,0.3151 | |
| CC12CC1C(C2)NC=O,0.2766 | |
| CCC1C(=O)CC1(C)C,0.2203 | |
| OC12CC1CNC2C#N,0.2699 | |
| CC(O)C1C2C3CC1N23,0.3013 | |
| OC1(CC1C#C)C1CN1,0.2649 | |
| CCC#CC1CO1,0.2735 | |
| CNC(=O)CC#C,0.2772 | |
| O=C1CC2OCC2=C1,0.1907 | |
| C1CC1C1CC2OC2C1,0.3446 | |
| OCC1C2CC3C2C13O,0.2835 | |
| CC1OC2C(OC=O)C12,0.2631 | |
| N#CC1(CCC1)C1CN1,0.2854 | |
| Cc1c(c(c[nH]1)N)C#C,0.1999 | |
| CC1=NCC(CO1)C#C,0.2664 | |
| CC1C2(C)CCCC12C,0.3235 | |
| COC1(C)C(C)C1C#N,0.2881 | |
| CN=c1cncccn1,0.1602 | |
| CC(=O)C12CC(C1)C2O,0.2201 | |
| C#CC12CC3OCC1C23,0.2733 | |
| C1CC1C1C2CC1C=C2,0.2403 | |
| OC(C#N)C1COC=N1,0.264 | |
| CC1(O)C2OC1C2C#N,0.2817 | |
| C#CCc1c[nH]nn1,0.2518 | |
| CCC1(C)CC(C)C1O,0.3095 | |
| N1C2C1C1OC1C1OC21,0.3067 | |
| OCC1COC1C#C,0.271 | |
| CCC1COC(=N)C1=O,0.186 | |
| CC1C2C3C1C(C#C)N23,0.2654 | |
| COC1CC=CC1,0.2682 | |
| N1=CC2=C(N3CC2C3)O1,0.2218 | |
| c1cc([nH]c1N2CC2)O,0.2286 | |
| CC1CC11CCC(C)=C1,0.2423 | |
| NC=[NH+]CC(C=O)=N[O-],0.1599 | |
| OC1C(CC=O)C1C#C,0.2227 | |
| O=C1CC2CC1C2C#C,0.2238 | |
| CN1N=NOC(=O)C1=N,0.2012 | |
| OC1CCC=CCC1=O,0.218 | |
| CC1CC2C1C2(C)C#C,0.2915 | |
| CC1(C)C2C3CN2C13C,0.3074 | |
| CNC(=O)CCN1CC1,0.2646 | |
| CC1CCC11CC1CO,0.331 | |
| CC1N2CC1(O)C2C=O,0.2156 | |
| CCC(C)OC(=N)CO,0.2926 | |
| CC1COC(=N)C(=N)O1,0.2178 | |
| N#CC1CNC1C1CO1,0.2671 | |
| CC1C=C(C)CN1C=O,0.2453 | |
| CC1C2C3NC3C(C)N12,0.2788 | |
| COCC1CC(C)C1O,0.3108 | |
| CCN1CCOC(=N)C1,0.2498 | |
| CC12C3C4C3C1(O)C24,0.2889 | |
| CC(N)C(=O)OCC#N,0.2473 | |
| CNC(=O)C1(CC1)O,0.272 | |
| CNC(=O)c1ccoc1,0.2206 | |
| CC1(CC2CN2C1)C=O,0.2131 | |
| C1Cn2c1nc(c2O)O,0.2049 | |
| CCC1COC2C(O)C12,0.3099 | |
| CCNC(C)C(=O)C#N,0.1614 | |
| C#CC12CC1C1CCC21,0.2571 | |
| OCC1CCC11CC1O,0.3214 | |
| O=CNC1C2CC=CC12,0.2322 | |
| O=C1CN2C1CNC2=O,0.2136 | |
| C1C2C3C1OCCN23,0.3056 | |
| CC1CCOC11CC1,0.3063 | |
| NC1(CC2CC1C2)C#N,0.2998 | |
| CC1C2C3CN2C1C3O,0.2974 | |
| CCNC1(CCC1)C#N,0.2664 | |
| CC12COC3C(CC13)C2,0.3161 | |
| CC(CC=O)C1CCO1,0.2283 | |
| N=C1OCCCOCO1,0.2902 | |
| CCCCN1CC(=O)C1,0.2064 | |
| CC1NC11COC1=N,0.2686 | |
| C1CC(=NC2CC2)OC1,0.254 | |
| CC1N2C(=O)C=CC12C,0.1949 | |
| CCC1CC2(CO2)C1,0.3341 | |
| CC1CC(C#C)C1=NO,0.2464 | |
| CC1(CC#C)CC=CC1,0.2636 | |
| OC(C#C)C(C=O)C#C,0.2174 | |
| CC1C2C=CC3N2C13C,0.211 | |
| COCC(C=O)C(C)O,0.2178 | |
| CNC(=O)C1(CN1)C#C,0.2612 | |
| C#CC1CC2NC12C#C,0.2509 | |
| CC12CC(O1)C(=N)OC2,0.2692 | |
| CCC(CC)CC(=O)C,0.2341 | |
| C1CC2C1C1CC=CC21,0.2575 | |
| N=C1OCCOCCO1,0.2861 | |
| CC1(CO)CC2NC2C1,0.3052 | |
| CC1CN1C(N)=O,0.2879 | |
| C(CC(=O)N)COC=O,0.2674 | |
| [NH3+]C(CO)C(O)C([O-])=O,0.2649 | |
| CC1(CC(O)C1)C1CO1,0.3305 | |
| CCc1ccc(o1)CC,0.2276 | |
| CC1OC23CC(C2)C13C,0.2969 | |
| CC#CC1C2C3C1CN23,0.2812 | |
| c1cncnc1C#N,0.1918 | |
| CCN=c1[nH]c(no1)C,0.2235 | |
| CC(C)(CCCC#C)O,0.3108 | |
| CC1C2CC1C(CO)C2,0.34 | |
| C#Cc1conc1C#N,0.2014 | |
| CC1=CC(=O)NC1=O,0.179 | |
| N#CC1C2OCC3C2N13,0.2598 | |
| OC1=CC(=N)C(O)=NN1,0.1791 | |
| CC1OC11C(O)CC1O,0.2952 | |
| O=CC1CC2(CN2)C=C1,0.2077 | |
| CCOC1(CC1)C,0.3337 | |
| CC1CCC2=COC=C12,0.2346 | |
| CC12CNC1=CC(=O)C2,0.2044 | |
| CCOC12CC1CC2,0.3382 | |
| CCC(C)C1CC2OC12,0.3266 | |
| CCC12CN(C1)CCO2,0.2853 | |
| OC1C=C2CC3C1C23,0.1806 | |
| c1c2c(on1)CCC2=O,0.2134 | |
| CC1CC(N=CO1)C#C,0.2675 | |
| Cc1c([nH]cc1N)C,0.2267 | |
| CC1CN1C(=O)CC#N,0.2478 | |
| CC1(C2(CC2)CCO1)C,0.3186 | |
| CC1CC1CNC=O,0.2803 | |
| C1C2C3C4C5C4C(C23)C15,0.3202 | |
| CC(O)C1=NC=CN=N1,0.1648 | |
| C1CN(C1=O)C(=O)N,0.2498 | |
| CC1=CC(CC1)C1CC1,0.2584 | |
| CCC(O)CCN1CC1,0.3021 | |
| OC1C=CC2=NOC=C12,0.2101 | |
| CC1=C(N)ON=NC1=O,0.1987 | |
| CN1CC(=O)C1C1CC1,0.2073 | |
| N#CC1OC11C2CC1O2,0.2499 | |
| CC1C2CC(=O)C(C)C12,0.2234 | |
| OC1CCC1CC1CC1,0.3255 | |
| CC1(CNCC(=O)O1)C,0.2422 | |
| C#CCCCCCO,0.3166 | |
| C#CC1CN2C=CN=C12,0.2495 | |
| CC1OCC(CO1)C#N,0.3029 | |
| CCC1OC2C3CC1C23,0.3127 | |
| c1cncnc1N(=O)=O,0.1776 | |
| c1nc(on1)NCCO,0.2399 | |
| CNCC#N,0.2698 | |
| C1CN2C1CC21COC1,0.2761 | |
| CC1CCC1C(C)(C)O,0.3185 | |
| CC(=O)C(=O)C#CC=O,0.1508 | |
| N#CC1C2CC=CC12,0.247 | |
| O=C1CC2CCNC2=C1,0.209 | |
| O=C1CC(CCO1)C#N,0.2655 | |
| COC12CC(C1)C2,0.3441 | |
| C#CC(=N)NC(=N)C#N,0.1911 | |
| CCC1CC1(CC)OC,0.3243 | |
| OCCC1CC=CCO1,0.2674 | |
| COC1(CCC1)CC#C,0.2949 | |
| c1cnc2c(n1)cn[nH]2,0.186 | |
| CC(C)Cn1cccn1,0.2621 | |
| c1c(ocn1)C2CC2,0.23 | |
| CC(=O)CN1C2CC1C2,0.2185 | |
| N=C1NC(CC1=O)C#C,0.18 | |
| OC1CCC1(O)CC=O,0.2184 | |
| OC12CC3OC1C=CC23,0.2439 | |
| CC(C#N)C(C)C#N,0.338 | |
| CC12OC1COC2=O,0.2524 | |
| C1CC1C1CC1N1CC1,0.3132 | |
| CCCC1(C)CC1C#N,0.3105 | |
| OCC12CCC(O1)C2=O,0.23 | |
| O=CC1OC(=O)N2CC12,0.2186 | |
| OC1CC1C1CC=CC1,0.2646 | |
| CCC1(CC1)C(C)C#N,0.3182 | |
| COC(=O)NC(=N)C#C,0.2205 | |
| NC1(CCC2OC12)C#N,0.2886 | |
| CCOCC(C)(N)C#N,0.2875 | |
| CC1C2CC(=O)C1C2O,0.2235 | |
| CCN=C1NC(=O)CO1,0.2425 | |
| C[NH2+]CC1=C([O-])C=NO1,0.2124 | |
| O=CC12C3CC1C(=O)N23,0.2115 | |
| Cc1c(cnn1C)O,0.2297 | |
| N#CC1CCN2CCC12,0.2618 | |
| O=CC1C(C#C)C2CN12,0.2122 | |
| CCN1C(=O)CN=C1N,0.2335 | |
| O=C1NC2CC2C2NC12,0.2513 | |
| CC1C2C=CC(=O)N12,0.1952 | |
| CC1(NCC1=NO)C=O,0.1949 | |
| O=CC1CC2OCC=C12,0.2068 | |
| CC(OC=O)C1COC1,0.2607 | |
| NC(=O)C(CC=O)C=O,0.2117 | |
| CCc1conc1NC,0.2294 | |
| c1c(cc(=O)oc1N)N,0.1853 | |
| CC1C(CC11CN1)=NO,0.2456 | |
| CC12OC1CCC2C#N,0.3073 | |
| COCC(O)C(C)C=O,0.2263 | |
| OCC(=O)C1CCC1O,0.2223 | |
| O=CC12CCC(CO1)C2,0.2227 | |
| CC12CC3CN1C2C3O,0.3003 | |
| c1c(c([nH]c1N)O)C=O,0.1754 | |
| OCC1=CC2NC1C2=O,0.2355 | |
| Cc1c(nn(n1)C)C#C,0.2156 | |
| OCC1NC1C1CCC1,0.3165 | |
| CCC(O)C1NC1CC,0.3141 | |
| CC1OCCC1(O)C#C,0.2731 | |
| C1c2c(nn[nH]2)NC=N1,0.2032 | |
| NC1=C(N)C(=O)ON=N1,0.1465 | |
| CC1C2CC1C2(O)CO,0.3074 | |
| CN1C2CC1(C)CC2=O,0.2084 | |
| CC1C2CC=CC2C1=O,0.2052 | |
| C1CC23C4C5C(N24)C35O1,0.2598 | |
| CC1(C)OC2CC1(O)C2,0.3029 | |
| OC12C3OC3C1CC2=O,0.2086 | |
| CN(C)c1n[nH]c(=O)o1,0.2449 | |
| C(C(=O)N)C(=O)NC=N,0.2175 | |
| C1C(CN1C=O)C=O,0.2082 | |
| OC12CC1(OCC2)C#C,0.2606 | |
| O=CC1=CC2OCC1O2,0.184 | |
| CCC1OCC1CCO,0.3161 | |
| CC1(C)CCC2CC2O1,0.311 | |
| CC1CC(C#N)C1(C)O,0.3002 | |
| CC1N(C)C11COC1C,0.2986 | |
| CC(=O)C12CC1C1NC21,0.2063 | |
| CC12CC(C)(C=C1)C2=O,0.2418 | |
| CC12CC3OC(C1)C23O,0.3041 | |
| Cc1cc(c(cn1)O)O,0.2172 | |
| OC1C2C(=O)C1C21CN1,0.2532 | |
| OC12CC3C(NC13)C2=O,0.2037 | |
| CCc1cnc(=O)[nH]n1,0.1701 | |
| CC1(C)C2C3CN2C13,0.3101 | |
| C1CN(C=N1)C(=O)N,0.2308 | |
| C1C(=O)C=C(C1=O)C=O,0.1283 | |
| OC1CC1(O)C(F)(F)F,0.3001 | |
| COC1CCC=C1C#N,0.2134 | |
| C1CC12COCC23CC3,0.3172 | |
| CN1CC11CCC1C#N,0.2744 | |
| N#CC12CC(O1)C=C2,0.236 | |
| CC(=O)NCC(=O)C#N,0.1629 | |
| C1C2CCC=C3CCC123,0.236 | |
| OC1C2CC(=O)C1O2,0.2113 | |
| OCC1CNCC(=O)C1,0.1968 | |
| COC(C)C#CC=O,0.2052 | |
| OCC12CC1CC1CC21,0.3131 | |
| CC1(CO)CC(CO)C1,0.3321 | |
| CC1CC2C3OC2(C)C13,0.2996 | |
| CCC(=NO)CCOC,0.2532 | |
| CC1CC(CO)CCO1,0.3183 | |
| OC1C2OCOC1C2=O,0.1888 | |
| CC12CCC3(CN3)C1O2,0.3196 | |
| CCc1coc(c1O)C,0.2242 | |
| CC1C2OC1(C)C(C)=C2,0.2353 | |
| CC(=O)NCC1COC1,0.2739 | |
| CC1OCC=C1C#N,0.2055 | |
| NC1=NCC2OC2C1O,0.2477 | |
| CC12OC1C1OCC=C21,0.2278 | |
| COc1c(nc[nH]1)OC,0.2185 | |
| OCC1(CC2CN12)C#N,0.271 | |
| CCC(O)C1(C)CN1C,0.289 | |
| OC(CC#C)C=O,0.2247 | |
| CC1COCC1C=O,0.2202 | |
| CNc1cc(cnc1)O,0.1926 | |
| O=CC1C=CC2NC12,0.2087 | |
| C(CCC=O)CCC=O,0.2249 | |
| COCCCN1CC1,0.3196 | |
| OCC1CC=CC(O)C1,0.2577 | |
| CC1NC(=O)OC1C#C,0.278 | |
| CC1C2C(C)C1(C)C2C,0.3622 | |
| C1C2OC3CC12OCC3,0.3029 | |
| CC1C(C)C1CCO,0.3371 | |
| CCC1C(O)C11COC1,0.2995 | |
| CC1OC1C12CC1OC2,0.3032 | |
| O=CC12OCC3C1OC23,0.2059 | |
| c1c(c[nH]c1C=O)CO,0.1812 | |
| NC12C(O)CC1OC2=O,0.2432 | |
| c1c(=O)c(n[nH]c1N)N,0.1865 | |
| c1c2c([nH]c1O)OCC2,0.2268 | |
| OCCOC1C2CC1O2,0.3109 | |
| CC(O)C1=C(O)NC=N1,0.2373 | |
| N#CC1OC2C3OC3C12,0.2725 | |
| CCC1CCC1C#C,0.3021 | |
| CC(=O)C12NC3C1NC23,0.2111 | |
| CN1CC1(CCO)C#N,0.2753 | |
| CC1C2CC1C2(C)CO,0.335 | |
| CC(C)(C)CC1CCC1,0.3518 | |
| CC12C=CC3(O)CN1C23,0.2225 | |
| CC1OCC(C)(C)C1C,0.3096 | |
| COCCC#CCC#N,0.2801 | |
| CN(C)CC(=O)CC#N,0.2027 | |
| Cc1c(nno1)C(=O)C,0.2054 | |
| CN1C2C1C1C2C1(C)O,0.2696 | |
| N#CC12CN3CC1C2C3,0.2909 | |
| CC(C)C1NC1C=O,0.2213 | |
| C#CCCN=C(C=O)N,0.183 | |
| COC12COC1CCC2,0.3176 | |
| CC1N=C2CCN2C1=N,0.2232 | |
| COC1=COC(=N)N=C1,0.1505 | |
| CN1CC2=CC(O)CC12,0.2262 | |
| CC12CC(C)(CCC1)O2,0.3129 | |
| CN=C1OCCC1C#N,0.2625 | |
| CC(O)C1=COC=C1O,0.2347 | |
| CC1CN2C3C(O)C2C13,0.328 | |
| O=CC1OC1C(=O)C#N,0.1617 | |
| CC(C)OC1CC(O)C1,0.3205 | |
| CCC1(C)C2NC2C1=O,0.2142 | |
| CC#Cc1nc(co1)N,0.1751 | |
| CC(C#C)C12CC1OC2,0.281 | |
| CC1OC2(CC12)C(N)=O,0.2583 | |
| CC1C2CC3C(O2)C13O,0.2912 | |
| c1c(c(c(o1)N)N)C=O,0.1633 | |
| CCC#CC(=NO)C,0.2031 | |
| OC1CC=C2CCC12,0.2471 | |
| O=C1OC2CC1(C2)C#C,0.266 | |
| CC1=NN(C=O)C(=N)N1,0.1977 | |
| O=CCN1CC2NC2C1,0.199 | |
| N=C1NC(=O)NC2CC12,0.2523 | |
| CC12C3C1C1CC3C21,0.3294 | |
| C1C2COC3CCC12O3,0.3204 | |
| CCc1conc1OC,0.2511 | |
| CN=C1C=C(CCO1)N,0.197 | |
| O=C1COCCC11CN1,0.2113 | |
| CC(C)C1CC(C1)C#N,0.3328 | |
| CC1C2COC3CN2C13,0.2938 | |
| NC(C#N)C1(O)CC1O,0.2857 | |
| CC1OC(C=O)C1(C)C,0.2118 | |
| C1NC23COC12C1NC31,0.2598 | |
| N=C1OC2C3CCC2C13,0.2797 | |
| CC1CC2=CCC(=O)N12,0.2075 | |
| CCC1C=C2CC3C2N13,0.1665 | |
| O=CNC1C2CC1O2,0.2714 | |
| CC1CCCC2CC1C2,0.3562 | |
| OCC12OC1C(O)C2=O,0.1943 | |
| O=C1C2CC3C2C=CC13,0.2004 | |
| CCC1=C(C)C2CC1C2,0.232 | |
| CC1(CN1)C(CO)CO,0.3061 | |
| C1COCOCCC1=O,0.2229 | |
| CCC12CC3OC1C2O3,0.325 | |
| OC1(C2CN2)C2CCC12,0.2907 | |
| c1c2c(on1)CCO2,0.2043 | |
| OC1C2C3C4CCC13N24,0.2953 | |
| OC1CC11OCOC1=O,0.2485 | |
| CCOc1c[nH]nc1C,0.2371 | |
| CC1=CC2CCC2OC1,0.2545 | |
| CC1CCC(C)OCO1,0.3318 | |
| CC1CCOC1C#N,0.2955 | |
| OCC12NC1CC2C#C,0.2867 | |
| CC1CC2C1OCC2O,0.314 | |
| C1CCC(=CC1)C2CC2,0.2542 | |
| [NH3+]C1(CCC=C1)C([O-])=O,0.2349 | |
| O=CC1CC2CNC2=N1,0.2102 | |
| C1CCC(=CC1)CO,0.2614 | |
| OC(C#N)C1=CN=NN1,0.244 | |
| CCC1C(CC)C1CO,0.3219 | |
| c1c(=O)c(coc1N)N,0.1893 | |
| C1CN1CC(=O)C(=N)N,0.1806 | |
| C1CC2CC3OC(C2)C13,0.3063 | |
| CC(O)C(C#N)C1CO1,0.3055 | |
| CNc1c(ocn1)C=O,0.1691 | |
| CC1CCCCC1CO,0.3398 | |
| CC(C)c1cncn1C,0.2467 | |
| CCOc1nc(co1)N,0.2288 | |
| O=C(C#C)C1COC1=O,0.2016 | |
| CC1C2(C)CCC12C#N,0.2779 | |
| C1C(=O)CC12CO2,0.2171 | |
| CC1(OC2CC12)C1CO1,0.3147 | |
| CNC1CCOC1=O,0.245 | |
| CN=C1NC=NCC1O,0.225 | |
| OCC12COCCC1O2,0.329 | |
| [NH3+]C1CC2=CC(=O)O[C-]12,0.1783 | |
| CC(O)C#CCC1CC1,0.2899 | |
| O=C1CC2CN2C=C1,0.1846 | |
| CC1CNC(=NC1)C#N,0.2077 | |
| CC(=O)n1ccnc1O,0.1734 | |
| c1cnc2cocc2n1,0.1437 | |
| CC1CC2OC(=O)C12O,0.2622 | |
| CNC(=O)c1ccc[nH]1,0.2054 | |
| CC1(C)C2COC1OC2,0.3257 | |
| CC(OC=O)C1CO1,0.2773 | |
| CC1CC2C1OCC2=O,0.2142 | |
| COC1CCCC(=N)O1,0.2889 | |
| CC1C2CC1(O)CC=C2,0.2531 | |
| CCc1c(n[nH]c1O)N,0.2418 | |
| CC12C3OC1(C)COC23,0.2879 | |
| OC1CC(O)C1O,0.2998 | |
| CC1=CCC=CC=C1C,0.189 | |
| N#CC1CCCC1C#N,0.332 | |
| CC1CCC2NC(=O)C12,0.2763 | |
| CC1CNC(=O)C1C#N,0.2617 | |
| CCC#CCC=O,0.219 | |
| O=C1CC2CC1(O2)C#N,0.2137 | |
| OC1(COC2CC12)C=O,0.2041 | |
| Cc1ncn(n1)CC#N,0.2571 | |
| CCC1(NC1(C)C)C#N,0.2792 | |
| CCC1=NCC(OC)O1,0.2807 | |
| OC1C2OC2C1(O)C#N,0.2709 | |
| c1nc(n(n1)C=O)N,0.199 | |
| CC(=NO)C(O)CC#N,0.2523 | |
| OC1C2OCC1(O)CO2,0.3083 | |
| OC1C(=O)CCC11CC1,0.2217 | |
| O=C1C2CC3NC3C1N2,0.2354 | |
| CC1CC2CCOC1O2,0.3249 | |
| ON=C1C2CC1OCO2,0.2446 | |
| Cc1c(=O)[nH]c(cn1)N,0.1662 | |
| CC(=O)C1OC11COC1,0.2212 | |
| CC1(NC1C1CO1)C#C,0.2723 | |
| CC(=O)CC1(COC1)O,0.2135 | |
| Cc1cn(cc1C=O)C,0.1936 | |
| CCCC1(C)CC1O,0.333 | |
| CC(C)OCCCC#N,0.2989 | |
| CC1CN(C=O)C1=N,0.2293 | |
| CN1C(=N)OC(C)=C1O,0.2205 | |
| COCC1(CN1)C#N,0.2883 | |
| CC1(CN(C1=O)C=O)C,0.2168 | |
| OCCCC(CO)C#N,0.3002 | |
| CC1OC11CC2C(O)C12,0.3121 | |
| CC1CC(O)C1C(N)=O,0.2606 | |
| NC(=O)N1CC2OC2C1,0.2952 | |
| CC1(O)CCC1C#N,0.3042 | |
| C1OC23CC(C2)CC13,0.3242 | |
| CN1CC2OCC12C#C,0.235 | |
| NC1COCOC1C#N,0.2615 | |
| c1cc(oc1)C2CCC2,0.23 | |
| CN=C1NC2(C)CC2O1,0.2697 | |
| C1C2C3C4CC(C1O4)N23,0.3219 | |
| CC(C=O)C1C(C)C1O,0.2014 | |
| NC1CC1(OC=O)C#N,0.2347 | |
| c1cc(=O)oc(c1O)O,0.1532 | |
| CCC12OC1CC2=NO,0.2494 | |
| C1CN(C(=N1)C=O)C=O,0.1884 | |
| CC1COCC(=O)CN1,0.1992 | |
| CC1C2CC1C(=O)CO2,0.2277 | |
| CN=c1cc(nc[nH]1)F,0.1738 | |
| CC1C2CC(C2O)C1O,0.3153 | |
| CC(C)(C)OC(=O)C#C,0.2337 | |
| C[NH2+]CC[N-]C(=O)C#N,0.1334 | |
| CCCOC(CO)C#N,0.2984 | |
| CC1C(C)C(=O)OC1=N,0.2624 | |
| C1OC23CCC4C2N4C13,0.2944 | |
| CC1OC11C2CC1C2=O,0.2509 | |
| OCC1OC2C1CC2=O,0.1999 | |
| CC12CCC1COC2,0.3307 | |
| Cc1nc(c(n1C)O)N,0.2307 | |
| CC(CO)C1=NC=NN1,0.2663 | |
| c1c(c2n(n1)CC=C2)O,0.175 | |
| CC1C(O)CN2CC12C,0.2845 | |
| CC1CC1C1=CN=NN1,0.245 | |
| Cc1cccnc(=O)n1,0.1609 | |
| COC(=N)N1C=CC=N1,0.2364 | |
| c1n[nH]c(=O)n1C=O,0.1999 | |
| CC(C(O)C#N)C(C)=O,0.2293 | |
| CC1OC2CC2OC1=N,0.2693 | |
| CN1CCc2c1coc2,0.2135 | |
| CCOC(=O)CC#CC,0.2589 | |
| CC12C3C1C1(C)C2C31C,0.3001 | |
| CC1C2NC(C#C)C12O,0.2502 | |
| COc1cc(on1)OC,0.2499 | |
| OC12C3C1N1C3C=CC21,0.2113 | |
| NC1C(C#N)C1N1CC1,0.2692 | |
| CC12CC1C1=CCCC21,0.2404 | |
| CC12CC3C(CCC1)C23,0.3295 | |
| CC1(C(C(O1)(C)C)O)C,0.3008 | |
| CC#CC1CC1C(C)O,0.2837 | |
| CN1CC(C#N)C1C#C,0.2503 | |
| CC12OCC(O1)C1CC21,0.3356 | |
| CC(=NCC#C)NC=O,0.2302 | |
| CC(=O)c1ccncc1,0.1843 | |
| CCC1(NCC=C1)C#N,0.2313 | |
| O=CC1=CC2C3OC1C23,0.1801 | |
| CCC12CC(C1)C2,0.3778 | |
| CC1NC(C=O)=NC1C,0.1645 | |
| CC12CC3(C)C(CC13)O2,0.3292 | |
| C1C2C3C4COCC13C24,0.3376 | |
| CC(O)C1CC1C1CO1,0.3302 | |
| CCC#CC(=O)C1CC1,0.2066 | |
| OC12CCC(O)(C1)C=C2,0.2595 | |
| CCC1(C)C2CC1C2C,0.3659 | |
| N=C1COCOCCO1,0.2711 | |
| O=CN1CC=CC1C#C,0.2413 | |
| CC1CN2CC(O)C2=N1,0.2421 | |
| CC(C)C1CC1C(N)=O,0.2676 | |
| CC(O)C12OC3C1NC23,0.29 | |
| C#CCC12CC(CC1)O2,0.2955 | |
| C#CC1CCC2CC12,0.3108 | |
| COCCC(=O)CC#N,0.2288 | |
| ON=C1CC2OC2C1=O,0.1671 | |
| CC12C3CC1C3C2C=O,0.2181 | |
| CC#CC1(O)COC1=O,0.2423 | |
| CCC1OC(C)C1O,0.302 | |
| CCN=C1CN=CN1,0.2204 | |
| CC1C2CC1(O)C2(C)O,0.3139 | |
| C(C=O)C#CC(=O)N,0.2172 | |
| CC(C)N1CC1C(N)=O,0.2386 | |
| CC1CC2=CC(C)CC12,0.2453 | |
| OC1C2CC1(C2)OC=N,0.2806 | |
| COCc1c[nH]nc1O,0.2479 | |
| N=COC1CC1C#C,0.2647 | |
| CC12C3C1C1C3C21CO,0.279 | |
| OCC12CC1(O)C1OC21,0.3048 | |
| O=CC#CC1OCC1=O,0.1966 | |
| C1OC23C4C5C(C12)C3N45,0.2832 | |
| C1CC2(C1)COCOC2,0.3357 | |
| OC1C2CCCCC12,0.3099 | |
| CC1CC2CC1C2CO,0.3385 | |
| C(C=O)OCC#CCO,0.2282 | |
| COC1C2C3CC3(C)C12,0.3352 | |
| CNC(=O)C(C)CC#N,0.2742 | |
| O=CN1C2CC3OC3C12,0.2635 | |
| CC1CC1C1CC=CC1,0.2647 | |
| N=C1OC2CC=CC2=C1,0.1789 | |
| O=C1CNCC2CN12,0.2237 | |
| CCCC(C)CC#C,0.3137 | |
| CC1(C)CC2C1OC2=N,0.2844 | |
| CC(O)C(=N)N(C)C=O,0.2375 | |
| COC(=O)N1CCN=C1,0.2357 | |
| CC12CC3C(C=O)C1N23,0.2092 | |
| c1cnn2c(n1)cnn2,0.1591 | |
| CN1C(C#C)C(O)C1=O,0.2548 | |
| CC1C(O)C11CCC=C1,0.2444 | |
| COC1C2C(O)C2C1=O,0.2108 | |
| C1OCC23CN=CN2C13,0.2379 | |
| COCC1(C)CN2CC12,0.3108 | |
| O=C1COCC(C1)C#C,0.2103 | |
| CC#CCC1(CO1)C=O,0.2098 | |
| CC1=NC(=CN1)C1CN1,0.2319 | |
| CN=C1CN=C(N1)OC,0.2354 | |
| C1CC1(C=O)NCC#N,0.2169 | |
| CC12OC(=N)C3C1CC23,0.275 | |
| O=CC1C2CC3(CC3)C12,0.2175 | |
| O=C1CC23CC12NC=N3,0.2146 | |
| c1c(nc(o1)N)OC=O,0.2141 | |
| OC1CC23CC=CC12O3,0.2311 | |
| CC1NC1COC=O,0.2765 | |
| ON=C1C2CC1C=CC2,0.2447 | |
| OC1C(O)C2(CO2)C1O,0.2778 | |
| CCC1(C)OC2CC12O,0.2974 | |
| C1CC2C3C4CC3C24C1,0.3449 | |
| OC12CC(C=C1)C2C#C,0.2358 | |
| OC1CC11CC(O)C1,0.305 | |
| CCOC1=NCC2NC12,0.2642 | |
| OCC1C=CCOC=N1,0.2491 | |
| OCC1(O)C2C3OC2C13,0.2814 | |
| C#CCNC(=O)CC=O,0.2226 | |
| CN(C)C(=O)CNC=O,0.2589 | |
| C1C(CC1=O)C=O,0.226 | |
| CC1CC2C3CC2C13O,0.326 | |
| C(C(=O)N(C=O)C=O)N,0.2077 | |
| CCC1(C)CC2CC12C,0.3236 | |
| CCC1(CC1)C(O)C#N,0.3067 | |
| CC(O)C#CC(C)=O,0.2083 | |
| C#CCNC(C#C)C#N,0.2558 | |
| C(COC=O)C#CC=O,0.2042 | |
| CC(C)C(C)C1CO1,0.3439 | |
| CCC1COCCC1C,0.3169 | |
| C#CC1OC2(CC12)C#N,0.2412 | |
| O=CC#CC1CNC1=O,0.1968 | |
| C1OC2CCOC1C=C2,0.2413 | |
| CC(O)CCOC(C)=O,0.2848 | |
| CN1C2C1C1(C)OCC21,0.2869 | |
| CC1C(OC1=O)C(N)=O,0.2578 | |
| CCc1c([nH]c(n1)O)N,0.2463 | |
| FC1=NC(=N)C=CO1,0.2132 | |
| CC1(O)CC2N=COC12,0.2622 | |
| C(#N)C(=O)C(F)(F)F,0.2058 | |
| NC(=O)C1CCC2NC12,0.2704 | |
| CC(C)(C)CC(O)C#C,0.2951 | |
| CC(CO)C1(C)CC1O,0.3194 | |
| CC(CO)C(O)C=O,0.2244 | |
| CCOc1c(nc[nH]1)C,0.243 | |
| CCC(O)C(F)(F)F,0.3599 | |
| CCC1CCC1C(C)O,0.3226 | |
| CC1COCC=C1,0.2649 | |
| OC1C=CC2(O)CCC12,0.249 | |
| c1nc2c(o1)OCCN2,0.2085 | |
| COC(C)CN1CC1,0.3253 | |
| OC1C2NCC(=O)OC12,0.2411 | |
| CC(O)C1(CO)CCC1,0.3225 | |
| C1CC(C1)(CCCO)O,0.3268 | |
| C1CN1CC#CC=O,0.1928 | |
| c1(c(n[nH]n1)N)C(=N)N,0.2003 | |
| CC1NC1C1CC(=O)N1,0.2829 | |
| CC(C)C(C)(C=O)C=O,0.1935 | |
| N=C1NC(CO1)C#N,0.2566 | |
| Cn1c2c(nn1)OCO2,0.2082 | |
| O=C(CC1CO1)C1CN1,0.228 | |
| C1CC11OCCC11CN1,0.3 | |
| CC1=Cn2c(cnn2)C1,0.2082 | |
| CC(C)CC1(CC1)C,0.3385 | |
| N=C1N(CC11CN1)C=O,0.2254 | |
| O=C1COCCC2CN12,0.2369 | |
| OC1CC(=O)N2CCC12,0.2577 | |
| CC#CC(O)CO,0.2787 | |
| CN1C2C1C1(CO1)C2O,0.3039 | |
| CN1C(=N)CC=CC1=O,0.1956 | |
| CC1=NC(C=O)C(=O)N1,0.2136 | |
| CC1CC2(CN2)C1C=O,0.2114 | |
| COCC(C)(CO)C#N,0.3063 | |
| OCC12COCC1C2O,0.3103 | |
| N#CC1=CCC2NC2C1,0.2201 | |
| COC1(C)CNC1C#N,0.2637 | |
| CC1(O)C=CC(O)C1O,0.2528 | |
| CCC12CC3N1CC23C,0.3142 | |
| O=CCC12C3CC1CN23,0.2122 | |
| CC(=O)OC(C=O)C#C,0.2243 | |
| OCC1C2CC1(O)CC2,0.3243 | |
| O=C1CC2(CCN12)C#N,0.2392 | |
| O=CNCC1CC2NC12,0.2635 | |
| OC1C(OC=O)C1C=O,0.2124 | |
| Cc1c(cc([nH]1)O)OC,0.2264 | |
| CC1C2CCC(O2)C1O,0.3056 | |
| CC1OC23CC(C2O)C13,0.3007 | |
| CC(O)C1=CCC2CC12,0.2455 | |
| COC(C)C(O)C=O,0.2302 | |
| CC(O)C1=NC=CC=C1,0.2155 | |
| OC1C(O)C11OCC1O,0.2684 | |
| CC1(CCCN1)C#N,0.2834 | |
| COC(C)C(C)CC#N,0.3003 | |
| CC(C)CCCC(C)C,0.3778 | |
| CNc1c(nc([nH]1)O)O,0.2382 | |
| Cc1cc(c(=O)on1)N,0.1752 | |
| CC1(O)C2OC1C2(C)O,0.307 | |
| CC1(C)C2CC(=O)C12O,0.2271 | |
| CC1=CC2CC1CC2=O,0.2058 | |
| c1nc2c(o1)CCC2,0.2312 | |
| OC1C2OC1C1CC2C1,0.3168 | |
| CC1OCCCC2OC12,0.3287 | |
| COC1C2C3OCC1C23,0.3032 | |
| CN1C2C1C1CC2C1O,0.293 | |
| C1C2C3CC(C4OC34)N12,0.3123 | |
| COC(=O)C(=O)OC,0.2106 | |
| O=COC1OCC2OC12,0.2795 | |
| CC(O)CCC(=O)C#N,0.2017 | |
| O=C1C2C3OC1COC23,0.2076 | |
| OC1CC2COCC2=C1,0.2486 | |
| CN1C(CC=O)C1C#N,0.2171 | |
| CN=COC(C)C1CN1,0.2646 | |
| CC1CC1(N)C(N)C#N,0.2693 | |
| CC1(CC(C1)C#C)C#C,0.2868 | |
| OC(COCC=O)C#N,0.2294 | |
| OC1COC(=O)C2NC12,0.2525 | |
| CC1OC2=NCCCC12,0.2697 | |
| CC1OC(CO)C1C=O,0.2116 | |
| OC1=CNC(=N)O1,0.2344 | |
| c1c[nH]nc1NC(=O)N,0.2368 | |
| C#Cc1c(cco1)C=O,0.1704 | |
| NC(=O)C1(CO1)C#N,0.252 | |
| CC1OCC(O1)C1CC1,0.3385 | |
| CC1CC=CCO1,0.2671 | |
| N=COCC12CN(C1)C2,0.2515 | |
| OC12CCC1(O)C=CC2,0.2611 | |
| CC1=NNC(=O)NC1=N,0.1963 | |
| c1coc(=O)c(=O)cn1,0.1508 | |
| CCC12CC3C1C2C3C,0.3295 | |
| CCCOCCC#N,0.3054 | |
| OC1CC(C#C)C11CO1,0.2876 | |
| CCOCC1NC1C,0.3246 | |
| OC1CC23CC4C2C1C34,0.3343 | |
| CC(C)c1cc([nH]c1)O,0.2439 | |
| OC1C2CC(C2)CC1=O,0.2205 | |
| Cc1c(cn2c1CC2)O,0.2271 | |
| ON=C1C2C(O)C1C2O,0.2647 | |
| CC1OC1(C#C)C1CC1,0.2819 | |
| CC(=N)OCCNC=O,0.2807 | |
| Cc1c(n[nH]n1)C(=O)C,0.2033 | |
| CCC(O)C#CCCO,0.2909 | |
| CC12COC3CC1CC23,0.3184 | |
| Cc1cccc(n1)CO,0.2231 | |
| OC12CC1C1(OC21)C=O,0.1991 | |
| CC1N=CN(C=N)C1=N,0.2136 | |
| CCCC(=O)C#CC#N,0.1854 | |
| CC(O)C1COCCO1,0.317 | |
| CC(=NO)C(C)(O)CO,0.246 | |
| CCC1(C)C(C)N1C,0.2886 | |
| CC12CC(C)(C)C1O2,0.3332 | |
| COC1C2NC2C2OC12,0.2922 | |
| CC12CC3C1C3(O)C2O,0.3105 | |
| CCC(=O)NC(=O)CO,0.225 | |
| c1cc2n(c1N)CCO2,0.2282 | |
| CCN1CCC1CC#N,0.2594 | |
| O=CC(OC1CC1)C#C,0.216 | |
| CC1CC(CC=O)C=C1,0.2232 | |
| CCC1CC=CC1C,0.2637 | |
| OC1C2CCC(=O)OC12,0.2689 | |
| CC1CC(C)C1NC=O,0.2761 | |
| Cc1c(nc([nH]1)OC)O,0.2314 | |
| CC1CC2(CO2)C1O,0.3209 | |
| OC12CC3CN(C1)C23,0.2746 | |
| O=C1CCC2CCC=C12,0.182 | |
| CC1OC2CC2C1=NO,0.2353 | |
| C1C2CC3C4C2N4CC13,0.3149 | |
| OC(C=O)C12CC(C1)O2,0.2061 | |
| CC(O)C1(CO1)C1CC1,0.3202 | |
| CC1CC(C=O)C1O,0.213 | |
| CC12C3OC(C)(C13)C2=O,0.2248 | |
| CC1C(O)CCCC1O,0.2988 | |
| CCC#CC(C)CO,0.3022 | |
| CC12OC3CC1(O)C23C,0.2766 | |
| CC1CC(O)C(C)CO1,0.3231 | |
| CC12C3C4C1OCC2N34,0.3095 | |
| CC1(CN1)C1=CN=NO1,0.2235 | |
| CC1(CCO1)C(O)C#C,0.2897 | |
| O=C1CC2C3CCN3C12,0.1793 | |
| OC12CC3C1NC23C=O,0.2115 | |
| CCCCCC1CCO1,0.3293 | |
| O=C1CCCC1C#N,0.2175 | |
| C(=O)n1nc(c(n1)O)N,0.1828 | |
| CC1C2C3N(C)C2C13C,0.2912 | |
| CN1CC1(C#C)C(C)=O,0.2102 | |
| CN1CC11C2CC1(C)O2,0.3171 | |
| OC1COCC2CC12O,0.3076 | |
| O=C1CC2C3C1CN23,0.2185 | |
| CC1CC2(CC(=O)C2)O1,0.2132 | |
| CC1=CCC=CCC=C1,0.1919 | |
| CC12COC1(CO2)C#C,0.2541 | |
| CC1C2CC1(O)C2C#N,0.3018 | |
| CCCC(=O)C(O)C#C,0.2262 | |
| CC(C#C)(C#C)NC=O,0.2658 | |
| CC(CCO)C(N)=O,0.2761 | |
| CC1C2C=CCCC12O,0.2447 | |
| CC1NC11CCC1C#C,0.278 | |
| C1C2OC1C21CC=CC1,0.2616 | |
| O=C1NC23CC12C=CC3,0.2387 | |
| CC1C2CC2C1OC=N,0.2804 | |
| CC1(OCC11CO1)C=O,0.2109 | |
| CC1CC(C1)NC=O,0.2797 | |
| CC1C2CCCC1(C)O2,0.3111 | |
| OC1C(O)C11CNC1=O,0.2688 | |
| C1OC1C12CC1CC2,0.3278 | |
| CCNc1c(n[nH]n1)C,0.2159 | |
| CC1(C)OC(C#N)C1N,0.2594 | |
| N#CCC1COC=N1,0.2709 | |
| C1C(CO1)(CC=O)C=O,0.2213 | |
| O=C1OC2C=CCNC12,0.2231 | |
| CC(CC1CO1)C(C)=O,0.2302 | |
| C1CC(=NO)C2(C1)CC2,0.2372 | |
| CCC1=CCC2(O)CC12,0.2447 | |
| N#CC1CCC(C1)C#N,0.3364 | |
| CC(=O)C12CC1CC2=O,0.217 | |
| CC1OC2(C)COC1C2,0.3242 | |
| O=C1C2OC2CC1C#N,0.2089 | |
| C1C2(COCO1)CO2,0.3314 | |
| c1cc([nH]c1N)OC=O,0.1931 | |
| CN1C2CC1C(=O)C2,0.2093 | |
| Cc1cc([nH]c1CO)O,0.2261 | |
| CCCC1(C)CN1C,0.2989 | |
| CCCC(C)C#CCO,0.276 | |
| CC(O)C1=NCC(C)O1,0.2739 | |
| NC1=C(O)C=CC(=N)O1,0.1548 | |
| CC1OCC2N(C)C12C,0.2994 | |
| C1CN2C3COCC1C23,0.3044 | |
| OCC1CN(C=O)C1=N,0.2273 | |
| c1c2c(on1)NC(=O)C2,0.209 | |
| CC12C3CC1(C)OC23,0.3121 | |
| N=C1OCC2C3OC1C23,0.2593 | |
| C1CC2C1C1OCC=C21,0.2292 | |
| CC1C=CC2NC2C1C,0.2438 | |
| CN(C)C(=O)NC=N,0.2501 | |
| COC1CNC11COC1,0.292 | |
| c1c(n[nH]n1)C#N,0.2411 | |
| C#CCCCC#CC#N,0.2331 | |
| CCc1cnc(nn1)N,0.1651 | |
| CC1=CCc2c1cn[nH]2,0.2057 | |
| CN=C1CNCC(=O)N1,0.2173 | |
| O=CCC1CC1C#C,0.2219 | |
| CC1(C)C2C(=O)CC12C,0.2289 | |
| O=C1CC2CN2C(=O)C1,0.2192 | |
| CC#CCC1OC1C=O,0.2116 | |
| COCC(C)C(N)C#N,0.2827 | |
| NC(C#C)C1(CN1)C#N,0.2757 | |
| OCCC(=O)C1CC1O,0.2192 | |
| CC1CC(C=O)C(=O)O1,0.2242 | |
| CC1CC(O1)=NCCO,0.2637 | |
| O=C1OC2CCC1O2,0.2676 | |
| CC1C2OCC12NC=O,0.252 | |
| OCC12OC1CNC2=O,0.2503 | |
| C1CC12CC=CC23CC3,0.2446 | |
| Cc1coc(c1O)OC,0.2227 | |
| CC1CC2OCOC2=N1,0.2719 | |
| CCC1CC(C#N)C1O,0.2981 | |
| O=CCC1=CCC2CC12,0.2006 | |
| CC12NC1(CO)CC2=O,0.2213 | |
| CC1OCCC1(C)C=O,0.2216 | |
| O=C1NC(CC#N)CO1,0.2892 | |
| CC#CC(C)(O)C(C)O,0.2863 | |
| OC(C=O)C(=O)C1CN1,0.1974 | |
| CC(=O)C1C2CC1C2O,0.2252 | |
| COCC(C=O)C(C)=O,0.2048 | |
| CN1CC1C1=CON=C1,0.2157 | |
| CC(O)C1(CN1C)C#C,0.2698 | |
| CC(C#C)C(=O)C1CO1,0.2117 | |
| c1cc(n(c1)C(=O)N)N,0.1761 | |
| C1C2CC1C=CC=C2,0.1793 | |
| CC(C)CCC(C)O,0.3344 | |
| Cn1c(cnc1N)C#N,0.1985 | |
| CCC(=O)NC(=O)N,0.2434 | |
| Cc1c(n(c(n1)O)C)C,0.2436 | |
| CC1CC2C3CC3CC12,0.3254 | |
| N=C1OC2(CC1C2)C#C,0.2749 | |
| CC1=CCOC2CC12,0.2466 | |
| CCOC1CC(C1)=NO,0.2486 | |
| N=COCC#CCC=O,0.2227 | |
| COC12COC(C1)OC2,0.3192 | |
| CCC1(C)C2OC=NC12,0.2509 | |
| CC1C(O)CC1CC#C,0.313 | |
| CNc1c(cccn1)N,0.1919 | |
| CC12CC(C=C1)C2C#C,0.2357 | |
| CC1CC(C)C(C)=C1,0.2581 | |
| C#CC1=CCNC(=O)N1,0.188 | |
| FC1=C(F)C(=N)NN=C1,0.1653 | |
| N=C1COC2CC3C2N13,0.2494 | |
| N#CC1CC2CCN1C2,0.2667 | |
| N#CC1C2C(CN12)C#N,0.2684 | |
| C(=O)C#CC#CC#N,0.1661 | |
| O=C1NC2(CC2)C2NC12,0.2503 | |
| OC1C2COC12CC#C,0.2792 | |
| CCCC(OCC)C#C,0.3012 | |
| CCC1=CC(O)CCC1,0.2508 | |
| CC#CC1OC1C#N,0.2545 | |
| O=C1C2NC2C11CCC1,0.2147 | |
| Cc1cnc(nc1)OC,0.2048 | |
| NC1C(C#N)C1C#N,0.2532 | |
| CC1CCOC(C)(C)C1,0.3206 | |
| CC(O)C(O)C1CC1C,0.3113 | |
| CCN=C1CC(CC)O1,0.2776 | |
| CC1OC2C3NC3C12,0.2958 | |
| O=CNC(CC#N)C#C,0.2702 | |
| c1nc(no1)OCC=O,0.2304 | |
| COc1ccc(nc1)F,0.1994 | |
| OC1C2CC2(O)C11CO1,0.312 | |
| CC#CC1(COC1)C#N,0.2755 | |
| C#CCc1c(nco1)N,0.2076 | |
| CCC1C2NC2C2NC12,0.2868 | |
| CC12OC1C1OC21C,0.2946 | |
| OCC1OCOC2CC12,0.3345 | |
| CC12CC3C(C1O)C23O,0.3031 | |
| OC1C2OC(=O)C1C=C2,0.2266 | |
| CC(C)(C#N)C1(CC1)O,0.3036 | |
| CN1C2CC2(O)C1C#N,0.2369 | |
| CC12CC=CC(O1)C2O,0.2396 | |
| CC(C)C12CC1C(C)C2,0.3256 | |
| CCC1(C)CC2NC12,0.3124 | |
| OC1C2OCCC12O,0.3041 | |
| CC1(CC#CC=O)CO1,0.2049 | |
| OC12CC1(O)C(=O)OC2,0.2548 | |
| OCC1C2N1CC2=O,0.2201 | |
| CC1OCCCC1CO,0.3157 | |
| CC12NC1C1N=COC21,0.2603 | |
| CC1NC11COC1CO,0.2963 | |
| O=COCC1C2CN1C2,0.2569 | |
| CC(C)(C)CC#N,0.3453 | |
| OC1C=CC(O)C11CN1,0.2325 | |
| CN1CC(N)C1C#N,0.2544 | |
| NC1=C(OC=N)N=CO1,0.2056 | |
| CC#CC(=O)C,0.2082 | |
| CCOCC1CN1CC,0.2971 | |
| CC1CN2C1C=CC2=O,0.2059 | |
| CCCC1CC1(C)C=O,0.2271 | |
| CC1CC(O)C1(C)C#C,0.293 | |
| CCCOCCC=O,0.2283 | |
| c1c(coc1N)CO,0.2234 | |
| CC(O)(C#N)C(O)C#N,0.2875 | |
| CCN=C1NC2CC12O,0.2332 | |
| O=CCC1(CC#C)CN1,0.215 | |
| OCCC1C2C3C1CN23,0.3112 | |
| c1[nH]c2c(n1)COC2=O,0.2192 | |
| C(C#CC=O)C#CC=O,0.2035 | |
| CCc1cnc(=O)on1,0.1671 | |
| OC12CN3CC1OCC23,0.2948 | |
| OC(CC1CCO1)C#C,0.2758 | |
| CC1CC2C(CO)CC12,0.3335 | |
| [O-]C(=O)C12CN1C(=[NH2+])C2,0.1376 | |
| C1C=C(COC1=O)C=O,0.1955 | |
| OCC12OCC1C2C#N,0.284 | |
| C1NC11C2NC1C1OC21,0.2973 | |
| C1OC2C3CC(O3)C=C12,0.2272 | |
| CN=C1OCCNC1C,0.2537 | |
| CCC(O)C1CC1O,0.3129 | |
| C1CC1NC2=NCCO2,0.2788 | |
| C(=N)NC(=N)C(=O)N,0.2077 | |
| c1cnoc1C2(CC2)O,0.231 | |
| COC(C)CC1CC1C,0.3333 | |
| CCC12CC(C)(C1)C=C2,0.2376 | |
| c1c(c([nH]c(=O)n1)N)F,0.1715 | |
| NC12C3CC1OC2=NC3,0.2059 | |
| CC1CC(C)(C#N)C1=O,0.2146 | |
| CCC1CC2=NC=CN12,0.2555 | |
| CC12C3CC1CC23C#C,0.2682 | |
| CCC1OC2CC1C2=O,0.2074 | |
| OC1(C=O)C2CC1C2=O,0.1958 | |
| C1C2OC11CC3NC3C21,0.2944 | |
| OCC1C2OCC12C#N,0.2697 | |
| CC1(O)C2OC2C11CN1,0.2995 | |
| COC1C2CC2C1C=O,0.2151 | |
| c1c(nc2n1C=CC2)O,0.1777 | |
| CC1C2OC1C2(N)C#N,0.2801 | |
| CC1(O)CCC1C=O,0.2198 | |
| CCC1(NC1CO)C=O,0.2265 | |
| C1C2CC3CC(CN12)O3,0.2947 | |
| C1C2CC3(COC=N3)C12,0.2659 | |
| OC1C2OC2CNC1=O,0.2777 | |
| Cc1coc(=O)c(n1)N,0.1634 | |
| CN1CC2(O)CC(=O)C12,0.1952 | |
| Cn1c(cnn1)C#N,0.2234 | |
| CC#Cc1nnn(n1)C,0.218 | |
| CCC(C)(C#N)C#N,0.325 | |
| CCC1C2C3C1C2C3=O,0.2482 | |
| CCCCC1(CO1)C#N,0.3017 | |
| CC1C2C3C=CC1C23C,0.2349 | |
| CC12COCC3CC1C23,0.3248 | |
| C(C#CCO)C(=O)C#N,0.1755 | |
| CC(=O)C1C2C3CN2C13,0.2139 | |
| COc1c(cn[nH]1)C=O,0.2093 | |
| CCC1NC(C=C1)C#N,0.2343 | |
| CN=CN1CCNC1=O,0.2417 | |
| C1COC(=N1)C#N,0.2192 | |
| CC(C)C1CCC1C#N,0.329 | |
| c1c(c(n[nH]1)O)N,0.2228 | |
| CC(C#N)C1NC1C#C,0.2852 | |
| COC12CC1(C)C(C)C2,0.3304 | |
| CC12CC(C1CO)C2=O,0.2483 | |
| CC1CCCCC1(C)C,0.3587 | |
| COC12CC1CC21CC1,0.3255 | |
| CC12CC1C1OC2C1=O,0.2389 | |
| c1c(=O)cc(oc1F)F,0.211 | |
| CC1CN=C2C(O)CN12,0.2404 | |
| OC1C2(O)CNC12C#C,0.2368 | |
| C1CC2(O1)C1CC2O1,0.3109 | |
| CC1=CCc2c1cc[nH]2,0.1961 | |
| CC(CO)CC(O)C=O,0.2316 | |
| O=C1C2NC2C1C1CN1,0.2089 | |
| c1c(c(no1)O)OC=O,0.2415 | |
| CC1(C)NC1(C)CO,0.2967 | |
| CC1=CCCCC1=NO,0.1976 | |
| CC#CC(N)(C#C)C#N,0.2539 | |
| CC(O)C(C)C(C)C#C,0.3089 | |
| Cc1c([nH]nc1OC)N,0.2441 | |
| c1cn(cc1N)C=O,0.1714 | |
| CC1(CC(O1)C#N)C#C,0.2688 | |
| CC1CC(=O)C1OC=O,0.2118 | |
| C1C2CC3C4CC2C1C34,0.3363 | |
| OC1CNC1(C=O)C=O,0.188 | |
| CCC12CC(C)=CC1N2,0.231 | |
| CCC1(CN1)C(O)C=O,0.2182 | |
| COCCCN=COC,0.2716 | |
| OC1C2CCC1C(=O)N2,0.2692 | |
| C(C=O)C(=O)CNC=O,0.2049 | |
| CCC1(CC1)CC(C)C,0.337 | |
| OC1CC2CC2C2OC12,0.3293 | |
| CC(C#N)N1CC1C=O,0.2026 | |
| CC12CC1OC21CC1O,0.286 | |
| N=C1C=NC(=O)OC=N1,0.1971 | |
| OCC1CCC1(O)C=O,0.2105 | |
| CCC(=O)C1CNC1=O,0.2282 | |
| O=CCOC(=O)C1CN1,0.2297 | |
| C(#N)c1c(n[nH]n1)C#N,0.2332 | |
| CCC1(C)C(CO)N1C,0.2811 | |
| COc1cc(cnc1)F,0.2099 | |
| CCN=C1OC2C(O)C12,0.2594 | |
| CC1=CCC(C1)(C)C,0.2603 | |
| CC1C(OC=N)C1C=O,0.2206 | |
| CC(C)c1ccc([nH]1)N,0.2301 | |
| CC1(CC2(O1)CCC2)C,0.311 | |
| O=C1NC2C1CC21CN1,0.2687 | |
| C1CC1C(=O)C(=O)C#N,0.1501 | |
| O=C1COC=NC1C#C,0.1986 | |
| CC(=O)CCC=O,0.2285 | |
| CCCN=c1ocno1,0.2311 | |
| CC1CC2OC12C1CN1,0.3081 | |
| CC1(CCOC1)C(N)=O,0.2735 | |
| CCNc1coc(=O)[nH]1,0.2367 | |
| CCOCC(=O)OCC,0.2789 | |
| O=C1CCOC2CCC12,0.2177 | |
| CCCC(O)CC#CC,0.2938 | |
| CC1CC2(CC12C)C#N,0.2815 | |
| OC12CC1(CCC2)C#N,0.2771 | |
| CCC12CN(C1)C2,0.3015 | |
| CC1C(O)CC1(C)CO,0.316 | |
| OC1C2NC1(C=C2)C#C,0.2304 | |
| OC1CCC1OC=O,0.2715 | |
| C(=O)c1c(n[nH]n1)N,0.1827 | |
| CN=C1OCC1CCO,0.2783 | |
| CC1OC(=O)C2(N)CC12,0.2564 | |
| CC1C=CC2OC12C,0.2452 | |
| COCC1CCC1=NO,0.2434 | |
| CNc1nc(on1)CO,0.2228 | |
| CCOC12CC(C1)C2=O,0.2367 | |
| CC(=N)OC(=O)C(C)=O,0.1809 | |
| CC(=O)N(C=O)C=O,0.2125 | |
| Cc1c(c(n[nH]1)C)O,0.2315 | |
| CC(CO)C1CC1(C)O,0.3234 | |
| CCC1OCOCC1C,0.339 | |
| NC1(CNC1=[NH2+])C([O-])=O,0.2256 | |
| OCC1OC1(C=O)C#C,0.2108 | |
| NC(=O)C1C=CCC1O,0.2432 | |
| C#CC1OC2C3CC1C23,0.2694 | |
| NC1=NNC(=N)C=C1F,0.1504 | |
| O=C1CNC2C3CN3C12,0.198 | |
| CC(=O)C1(O)CC1(C)C,0.2203 | |
| O=CC1CC2C3CC2C13,0.2261 | |
| OC1COCC1CC#N,0.2936 | |
| C1CC1C1=CCC2OC12,0.2322 | |
| CC1(C)CCC(CO)C1,0.3409 | |
| CC1C2OCC1(C)C2=O,0.206 | |
| CC12CC1OCCCC2,0.3169 | |
| CC1=CC(=N)NC1=O,0.1913 | |
| O=C1CC2(CCN12)C#C,0.2375 | |
| C#CCn1cc(cn1)O,0.2296 | |
| [NH3+]CC1(CN1)C([O-])=O,0.2669 | |
| CC1CC(CO)(C1)C#N,0.3031 | |
| CC12CC1CC(=O)C2,0.2234 | |
| CC1C2C3C2C1C3C,0.3412 | |
| OC12COC1C(=O)CC2,0.2016 | |
| N=C1NCC(=O)C1C#N,0.1995 | |
| c1cnc-2nccoc12,0.1426 | |
| CCC(OC)C=O,0.2135 | |
| OC12COC1C1OC1C2,0.3004 | |
| C#CCCC1=NCCO1,0.271 | |
| CCC(C#C)C1(C)CC1,0.311 | |
| CC1=CCOC1C1CC1,0.2497 | |
| N=C1C=NOC(=N1)C#N,0.1901 | |
| OC1C2OC2(C=O)C1=O,0.1865 | |
| CCC1COC(C1)C=O,0.2156 | |
| CC1CN1C1CC1C#N,0.2509 | |
| CN(C)C1(CCC1)C#N,0.2629 | |
| CC1CC2=CCCC2O1,0.2545 | |
| CC1OC(=O)C1N,0.2499 | |
| CC(=O)C(=O)CC#C,0.1558 | |
| N=C1OC(=O)NCC=C1,0.215 | |
| CCOC1CC2CC12,0.3284 | |
| C(C#CCO)NC=O,0.2715 | |
| CC(=NO)COCC#C,0.248 | |
| CNc1c(con1)N,0.2252 | |
| N#CC1CC2(CN2)CO1,0.2781 | |
| O=CC(=O)C1CC(=O)O1,0.1527 | |
| O=C1NC2C(OC12)C#C,0.2429 | |
| COc1nc(on1)CO,0.2458 | |
| O=C1C=CCNC1C#N,0.1805 | |
| COC1C=CC2NC12C,0.2314 | |
| CC1OC(C)C(O1)C#C,0.2876 | |
| CCC1C(C)CC1(C)C,0.3439 | |
| OC1C2C(C#N)N2C1=O,0.22 | |
| CC1CNC=CC(=O)C1,0.1837 | |
| CN1C2COCC2C1=O,0.2747 | |
| CC(O)C(=O)C1NC1C,0.2238 | |
| c1c([nH]nn1)NCC=O,0.1815 | |
| OCC1C=CC(O)C1=O,0.2212 | |
| CC1C2N3CC3C12C,0.2844 | |
| CC(C)c1ccccc1,0.2402 | |
| O=CC12CC1NC(=O)C2,0.2185 | |
| c1c(c(=O)ocn1)F,0.1916 | |
| Cc1c(=O)ccoc1O,0.2027 | |
| COC1OC2CC1(C)C2,0.3404 | |
| CN1CC12COCOC2,0.3088 | |
| CNC1=NC(CO)CO1,0.269 | |
| CC1(CC(=O)CO1)C=O,0.2079 | |
| O=C1CC2C1CC21CO1,0.2185 | |
| C1C2OC3=NCCCC123,0.2705 | |
| CCc1c([nH]nn1)N,0.2304 | |
| O=C1C2C3CC1C23C#N,0.2376 | |
| CC12CC3(CCC13)CO2,0.2972 | |
| CCc1c(c(co1)C)N,0.2198 | |
| NC1=NC2C(N1)C2C#N,0.2531 | |
| CCC(C)C(=O)C#C,0.2043 | |
| CCCC12CN3CC1C23,0.3002 | |
| CC(CC(O)C#N)=NO,0.2465 | |
| C(C#CC(C=O)C=O)O,0.2059 | |
| CCC1C2CC3C2N13,0.3274 | |
| CN1C2C3OC3C1C2=O,0.219 | |
| O=C1NCC1C#C,0.2697 | |
| c1cnc(c(c1F)N)O,0.202 | |
| OC1CN2CC2C1=O,0.2062 | |
| CC(O)CC1C2COC12,0.3037 | |
| OC1C2C3N2C1C31CN1,0.2952 | |
| Cn1ncc(n1)NC=O,0.2213 | |
| C1CC1OC1C2CC1C2,0.3352 | |
| CNc1ccc(o1)NC,0.2127 | |
| OCCC1=CCCC1O,0.257 | |
| C#CC12CC(C1)C=C2,0.2394 | |
| [NH3+]CC1=C([O-])C=CO1,0.1712 | |
| CC1OC(CC1O)C#N,0.2876 | |
| OC1CC11CCN2CC12,0.3004 | |
| CC(O)C(O)COC=O,0.2799 | |
| C(C(=O)N)NC(=N)C#N,0.1862 | |
| CC(=O)C1(C)OC1(C)C,0.2201 | |
| N#CC1CC2CC2O1,0.2746 | |
| CC12CCCC1C1OC21,0.3339 | |
| C1N2C3CC4CC2C13C4,0.291 | |
| CC1COC2=C1ON=N2,0.1837 | |
| OC1CC(O)C1CC#C,0.3029 | |
| COCC1CC2(C)CN12,0.3131 | |
| c1c(c2c([nH]1)COC2)O,0.233 | |
| C1CC12CN(C2)CC#N,0.2569 | |
| OC12CC3CC1CC2C3,0.3212 | |
| CC12CCC1C1(CC1)O2,0.2989 | |
| CN(C)c1coc(n1)O,0.2221 | |
| N#CC1=C2CCC2OC1,0.1995 | |
| OC(C=O)C1CC1,0.229 | |
| COC1CN=C(N)C1O,0.254 | |
| CCC#CC,0.3033 | |
| N=C1OCCN1CC#N,0.2618 | |
| CC1CC(=O)C2CCC12,0.2164 | |
| CCN=COCCOC,0.2759 | |
| CC1OC(=O)C=CC=C1,0.1767 | |
| OCC1(CC(=O)O1)C#N,0.2806 | |
| N#CCNC1CC=CC1,0.257 | |
| c1cc(=O)nc(nc1)N,0.157 | |
| C#Cc1c(nc([nH]1)O)O,0.1982 | |
| CC1CC2CC(O)C12,0.314 | |
| O=C1NCC23CC12CC3,0.2557 | |
| C1N2C3C4C5C2C13CN45,0.2953 | |
| CC1CN1C1CC1(C)C,0.3104 | |
| CNC1CC(=O)OC1=N,0.2291 | |
| NC1=NOC=NC1=N,0.1923 | |
| CCc1cnoc1N,0.2244 | |
| CC1CCOC=NC1,0.2601 | |
| CC#CC1C2CC3C2N13,0.2679 | |
| CC1C2CC11OC=NC21,0.2602 | |
| CC#CC1C2C3OC1C23,0.2727 | |
| OC1C2NC1C(O)C2O,0.2838 | |
| OCCC(C=O)C1CO1,0.2196 | |
| N=C1CC(=O)C=CCO1,0.1894 | |
| O=C1NC23COC2CC13,0.2629 | |
| OC1C2C3C4N2C1C34O,0.2833 | |
| CCOC1CCC1CO,0.3216 | |
| C1CC1CCOCCO,0.344 | |
| CNc1cnc(cn1)F,0.1678 | |
| O=C1CC2CC3C(C2)C13,0.2239 | |
| CC1C2C(CC1O)N2C,0.2875 | |
| O=C1CC2CN12,0.2378 | |
| C#CC1C2NC1C21NC1,0.2848 | |
| CNc1cc(c[nH]1)O,0.2271 | |
| CC1(O)C2CC2(O)C1=O,0.2296 | |
| OCCC1CC2COC12,0.3133 | |
| Cc1cnnn1CC#C,0.2485 | |
| c1nc(n(n1)C=O)C=O,0.1796 | |
| CC(CO)OC(C)C#N,0.2852 | |
| C(CCCO)CCC#N,0.3068 | |
| Cc1coc2c1onc2,0.204 | |
| CC(CO)C(C)C#N,0.3096 | |
| COCC1(C)CC(=O)N1,0.2823 | |
| CCNC(=O)OC=N,0.2717 | |
| Cc1c[nH]cc1NC,0.2304 | |
| O=C1C2C3CC2OC1C3,0.2018 | |
| CN=C1C(=O)OCO1,0.2188 | |
| Cc1c(cn[nH]1)OC,0.227 | |
| CC(C)COCCC=O,0.2284 | |
| Cc1cnc2n1nco2,0.2031 | |
| C1C(=CC(=O)CN1)N,0.1936 | |
| CCN1CC(=N)OC1=O,0.258 | |
| CC(=O)c1nnon1,0.1862 | |
| OC12C=CC(C=C1)C2=O,0.2437 | |
| CC12C3C4OC(CN13)C24,0.2886 | |
| CCC12CC1C1OC1C2,0.3301 | |
| COCC(CC#C)OC,0.2967 | |
| c1c(oc(n1)CO)C#N,0.208 | |
| CC12CC=CC1O2,0.2467 | |
| C1CC1OC=NCC#N,0.2675 | |
| C1OC2C3C4CC(C12)N34,0.3042 | |
| CCNc1[nH]c(cn1)O,0.2343 | |
| C1C2CN1C1=C2NC=N1,0.2229 | |
| NC(=O)C(O)CC#N,0.2728 | |
| CCCOC1CC(C)C1,0.3296 | |
| CC(CO)C1CC2OC12,0.3288 | |
| CC1CC(CCO)O1,0.3237 | |
| CCN(C=O)C(=O)C=O,0.1577 | |
| CC(CC=O)C#N,0.2271 | |
| c1c(c(nc(n1)N)F)F,0.194 | |
| CC1C=CC(O)C1=NO,0.2375 | |
| OCC(=O)C1(CN1)C#C,0.2209 | |
| CC1(C)NC11CC2NC12,0.3008 | |
| CC1C2CN1C21CC1O,0.2936 | |
| c1c(c([nH]c1O)O)N,0.2208 | |
| CCC(O)C(O)COC,0.3294 | |
| CC1(C)CC1(CO)C#C,0.2892 | |
| O=CC12OC1C1COC21,0.2055 | |
| CC1=CC2(CC2)C(=O)C1,0.2148 | |
| CCOCC1(CN1)C#N,0.2869 | |
| CCN=C1OC=CN=C1,0.16 | |
| c1cnc2c[nH]cc2n1,0.1507 | |
| C1NC1C#CC1COC1,0.2702 | |
| OC12CC(C1C#C)C2=O,0.2365 | |
| CCCC1N=COC1C,0.268 | |
| OC12CN3C4C3C1OC24,0.304 | |
| CN1CC1C1CC(O)C1,0.2997 | |
| CC1=CC2OC2COC1,0.2418 | |
| NC1(CO)CC1(N)C#N,0.2661 | |
| CC(O)C(=O)C(N)=N,0.1917 | |
| O=C1NCC2C3NC3C12,0.2606 | |
| CC1=CC2(CC1N2)C=O,0.2041 | |
| CC12CCOC(=O)C1O2,0.2493 | |
| CC1C(C2CCC2)N1C,0.2859 | |
| CC1C2C=CC(=O)C12O,0.1821 | |
| CC(O)C1C2CN1C2,0.3145 | |
| CC1(COC(N)=N1)C#C,0.2691 | |
| OC12C3C1C1C3C21C#C,0.2439 | |
| OCC(O)CCCC=O,0.2281 | |
| CC1CC11CCC2CC12,0.3256 | |
| O=C1CN2CC3CC3C12,0.2019 | |
| C#CC1OC2CC1CO2,0.2836 | |
| COc1cc(no1)CO,0.2343 | |
| CCC1OCC1C,0.3249 | |
| CC1C2(C)CCC12CO,0.3038 | |
| C1C2C3OCC3CCN12,0.2897 | |
| C1OC1C12CC1OC2,0.3021 | |
| CC1(CC(O)C#N)CC1,0.2918 | |
| OC1C2OCC3CN3C12,0.2641 | |
| O=C1C2CCCCC1N2,0.2219 | |
| CC1CC2C(CC12)C#N,0.316 | |
| CC1=CCCOC1(C)C,0.2624 | |
| CC12C3OC1CC23C=O,0.2167 | |
| CCOCC1CC(=O)O1,0.2814 | |
| OCCN1CC1CC=O,0.2143 | |
| N=COCC1CC(=O)C1,0.2227 | |
| CN=C1NCC(O)C1=O,0.1767 | |
| Cn1cc(nc1N)C=O,0.1884 | |
| CCCC1(CO)NC1C,0.3051 | |
| OC12CC3CCC1C23O,0.3001 | |
| CN1CC2OC(=N)C12,0.2431 | |
| N=C1OCC2OCC12,0.2778 | |
| CC1CN(CC#N)C1C,0.2598 | |
| NC(=[NH2+])OCC([O-])=O,0.1389 | |
| C1C2C3CC=CC1OC23,0.2369 | |
| CCc1cocc1OC,0.2362 | |
| O=C1C2C3C(N13)C21CO1,0.25 | |
| c1cocc(c1=O)C=O,0.1689 | |
| CC12CC1CC(=N)OC2,0.2823 | |
| Cc1c[nH]c(c1N)O,0.2411 | |
| C(=O)C(=N)N(C=N)C=N,0.1813 | |
| C#CCC1CC=CCO1,0.2673 | |
| CC12CC(=O)C1O2,0.2164 | |
| CC1OCCC1NC=O,0.2757 | |
| OC(C#N)C1CC1O,0.2471 | |
| NC12COC1C2(O)C#N,0.2534 | |
| C1C2CC1OCCCO2,0.3023 | |
| C1C=CCC1=NO,0.2457 | |
| CC12CN1C(C)(C)C2O,0.2903 | |
| CCC1CC=CC11CO1,0.251 | |
| CC1(CC(=O)C1)C#N,0.2227 | |
| O=CCC(OC=O)C#N,0.2221 | |
| OC1=NC(=N)OC(F)=N1,0.2192 | |
| CC(C)(C)CCCO,0.3366 | |
| CCOC1C2OC1C2O,0.2949 | |
| CCN(C)c1ccno1,0.2176 | |
| CN1C2CC1(C#N)C2O,0.2324 | |
| CCC(C)COC,0.3367 | |
| O=COC(CC#N)C#C,0.2787 | |
| CC1CCC2C(O)C2O1,0.3056 | |
| CC12C3CN1C3CC2=O,0.2165 | |
| CC(=O)C1NCC1C#N,0.2193 | |
| CC(=O)C(=N)OCC=O,0.1951 | |
| CC1=CC2OC2C11CO1,0.2324 | |
| COCC1(CC1)OC,0.3351 | |
| Cc1cncc(n1)CO,0.1959 | |
| CC1CC(C#C)C1CO,0.2901 | |
| C1C2C3CC1CC23,0.3554 | |
| OC12COC1COC2=N,0.2689 | |
| OCC1COC(=N)C=C1,0.2162 | |
| CCC1COC(C)C1C,0.3148 | |
| CC1=CN=C2C(O)CN12,0.2383 | |
| CCCc1ccc([nH]1)O,0.2349 | |
| N#CC1=CC2C3NC1C23,0.1883 | |
| CC1OC1C1(CO1)C#N,0.2813 | |
| CC(C)(C=O)C(=O)C#C,0.1821 | |
| CC1OCC23CC12CC3,0.3089 | |
| CC1C(CC1=O)C1CC1,0.2202 | |
| C#CC12NC1CCC=C2,0.2344 | |
| CCCc1nccn1C,0.2452 | |
| CNC(=NC)C(=O)OC,0.1976 | |
| CC1CCC(C)C2CC12,0.3387 | |
| OCC(=O)OC(=N)C#N,0.2033 | |
| CCC1C(C)CC=C1C,0.2573 | |
| CN1CC2CC12C(C)=O,0.2044 | |
| CCC(CO)N(C)C=O,0.2694 | |
| CN(C)c1cc(n[nH]1)N,0.2362 | |
| CCOCCCCO,0.3289 | |
| C1OCC23NC12C1NC31,0.3085 | |
| CC1OCCC1C=O,0.2229 | |
| OCC#CC(=O)C1CN1,0.1961 | |
| COCC(C)CC(C)O,0.3214 | |
| CC1OC(C)C1NC=O,0.2744 | |
| O=CC12CCC3C1OC23,0.2045 | |
| C1C(=O)CN1C(=O)C=O,0.1727 | |
| CC1C2CN1C2C=O,0.2026 | |
| OC1C[NH+]2C=CC(=O)[C-]12,0.1493 | |
| CC12C(O)C1OC2C#C,0.2422 | |
| CCCC12NC1C1NC21,0.2692 | |
| C#CC(CCC#N)C#N,0.2922 | |
| CN1CC2OC(=O)C12C,0.2316 | |
| CN1CC23OC(C2O)C13,0.2616 | |
| C1CC1C1OC1C1CO1,0.3358 | |
| COC(C)C(C)(N)C#N,0.293 | |
| CC1C(OC1=O)C#C,0.2753 | |
| CN1C2C3CC2(C)C13,0.2971 | |
| CC#CC1C(O)CC1=O,0.2088 | |
| CC1CCCC(C)(O)C1,0.3278 | |
| COC1OCC=C1C,0.2611 | |
| CC(C)(C#N)C(=O)N,0.278 | |
| CCCC(O)C1(C)CO1,0.3452 | |
| C#CCN=c1[nH]cco1,0.2211 | |
| O=CNC1CC1C#C,0.2673 | |
| COC(=O)C(O)C=O,0.2226 | |
| [NH3+]CC1=NNC=C1[O-],0.2255 | |
| C1C=C2C3C4C3N1C24,0.1587 | |
| c1c-2n[nH]nnc2cn1,0.1295 | |
| CCOC1COCC1=O,0.1966 | |
| Cc1nccn1C=O,0.1904 | |
| O=C1C2CN2CC11CO1,0.202 | |
| CC1=CC2CC3C1C23O,0.2381 | |
| CN=c1ccncnc1,0.1657 | |
| C1CC11OCC2OCC12,0.319 | |
| CCCC(C)(O)CC,0.3233 | |
| CC12NC1C(O)CC2O,0.3081 | |
| C1CC11CC2CCC1C2,0.3418 | |
| CNc1cc[nH]c1C=O,0.1642 | |
| O=C1CC2CC1(N2)C#N,0.2216 | |
| C1CC11N2C3CC=C1C23,0.1693 | |
| CC1C2C3CC4C1C2C34,0.3234 | |
| C(=O)(C(=O)NC(=O)N)N,0.1965 | |
| c1ccc2c(c1)nco2,0.213 | |
| COC=NC1CC1(C)O,0.2471 | |
| O=C1OCC=CC1C#C,0.2471 | |
| CC12CCC(O)C1O2,0.3275 | |
| COC1(C)CC2OCC12,0.3138 | |
| OC1C(O)C2C1C1CN21,0.2658 | |
| COC1(C)CC1(N)C#N,0.2732 | |
| O=C1OC2CC(=O)NC12,0.2489 | |
| CCCCC1(CN1)C=O,0.2234 | |
| Cc1c(cncn1)O,0.2103 | |
| CNc1c([nH]nn1)O,0.2386 | |
| CC1NC(=O)CC(C)=C1,0.2525 | |
| N#CC1CN1,0.2851 | |
| NC(=O)C1CC2CCN12,0.2332 | |
| CC(C)(O)C(O)CC#C,0.2983 | |
| C1OC23CC4(OCC24)C13,0.2314 | |
| CC(CO)C(=N)NC=O,0.2295 | |
| CC12CCC3C1N3C2=O,0.2352 | |
| C#Cc1c(non1)C#N,0.2043 | |
| C#CC1CCC(O1)C#C,0.2845 | |
| OC12CCC(CC1)C2=O,0.2238 | |
| CC#CC1C(CO)N1C,0.2533 | |
| C1COC2(O1)CC=CC2,0.2683 | |
| OC(COC1CC1)C=O,0.2099 | |
| COC1CC2OCC1O2,0.33 | |
| COCCc1[nH]ccn1,0.2521 | |
| O=C1C2OC1C(=C2)C#N,0.2086 | |
| CCC1C(C)C1C1CC1,0.3218 | |
| CN=COCC1(C)CO1,0.2732 | |
| N=C1OC2(CCC12)C#N,0.2723 | |
| Cc1ccnn1CC#N,0.2471 | |
| CC1(C)OC(=N)C2CC12,0.2782 | |
| C1c2c(onc2N)CN1,0.2301 | |
| CN1C2C3CC2C13C,0.3022 | |
| CC1C(C)C1C(=O)C=O,0.1553 | |
| NC1=NCC2OC12C#C,0.2275 | |
| O=C1OCCC2NC12,0.2496 | |
| CC1C2NC2C1C1CO1,0.307 | |
| CC(O)C12NC1C1NC21,0.2582 | |
| C(C#N)N=c1[nH]nn[nH]1,0.2061 | |
| CC(=O)C1CC1C(N)=O,0.2025 | |
| OCC1OCC1C1CO1,0.3099 | |
| CC1(CO)CN1CCO,0.3014 | |
| CC#CC(C)(O)C1CO1,0.2851 | |
| O=C1CC2NCC(=O)C12,0.1825 | |
| OC12CC(C=C1)C2C=O,0.2084 | |
| NC(=O)C1C2OC(=N)C12,0.2406 | |
| CC12CC(C1C#C)C2=O,0.2459 | |
| C#CC(CN)(C#N)C#N,0.2592 | |
| C1C2C1C1OC3CC2C13,0.3085 | |
| CC(C#N)C1(O)CC1C,0.3076 | |
| CC12CC1(O)C(=O)C=C2,0.1841 | |
| C1C2CCC=CC=CC12,0.2018 | |
| c1c([nH]c(=O)o1)CC=O,0.1775 | |
| CC1=CC(O)C(=O)NC1,0.2513 | |
| CC#CC12CC(C1)C2O,0.2802 | |
| CCC(=O)CCCC#C,0.2349 | |
| c1c(cn[nH]1)N2CC2,0.2273 | |
| CC1=CC(C)(C)C(O)C1,0.2587 | |
| C1C2C3C4C5OC13C5N24,0.2618 | |
| CCc1[nH]cc(n1)O,0.228 | |
| CCCC1COC(=N)O1,0.3094 | |
| CCC#CC1NC1C=O,0.2139 | |
| C(C=O)C(CO)CO,0.225 | |
| COC1C2NC2C1C,0.3017 | |
| CCC1CC(C)=CC1O,0.2571 | |
| CCC1(CO)C2CCN12,0.3143 | |
| CN1C(CO)C1CC#N,0.2644 | |
| CCCC(COC)C#C,0.3079 | |
| CC1N2C(=N)CC12C#N,0.239 | |
| CN=C1C=NOC(N)=N1,0.187 | |
| CC(C)(O)C1CCC=C1,0.258 | |
| CCC1OC11CC2OC12,0.327 | |
| Cn1c(nnc1O)O,0.2706 | |
| CC(=O)NC1COC1=O,0.2607 | |
| CCOC1CC1C(C)=O,0.2325 | |
| CC12CN1C1C(CO)C21,0.2849 | |
| CC(C)(C)C(CO)C#N,0.3081 | |
| CC1OC1C1=NNC=C1,0.2497 | |
| O=CN1C(CC1=O)C#C,0.2201 | |
| CCC(O)(COC)C#N,0.312 | |
| CC12CC1C1C(O)C21C,0.2737 | |
| CC1C2C=CC(CO)C12,0.2443 | |
| CC12CC3C1OC3(C)C2,0.3243 | |
| N#CCC1CC=CCO1,0.2676 | |
| NC1=NC(=[NH2+])[N-]C=C1O,0.1877 | |
| C1OC11CNC11COC1,0.2984 | |
| CCOc1c[nH]cc1N,0.2321 | |
| CC12CC1(C)C(O)C2,0.3139 | |
| C#Cc1cc(=O)nc[nH]1,0.1749 | |
| CC(C)n1cc(cn1)N,0.2235 | |
| C1CC2(CC2)C=C1C#N,0.204 | |
| Cc1nc(c(o1)N)OC,0.2109 | |
| OC1=CC(=N)N=CN1,0.1919 | |
| CC12CC3C(C1)C23C#C,0.259 | |
| Cc1c(ncn1C)NC,0.2095 | |
| C(c1[nH]c(=O)[nH]n1)O,0.2307 | |
| C1CN1C2(COC2)C=O,0.1918 | |
| C1CC2C3CC=CC23C1,0.2385 | |
| CN=C(C#C)N(C)C=O,0.2033 | |
| ON=C1C2CC3CC1N23,0.2242 | |
| CCCCc1cnc[nH]1,0.2485 | |
| N=C1NCC(=O)C11CO1,0.1887 | |
| CN(C)c1c(cn[nH]1)N,0.2198 | |
| OC1CC1C1COC1=O,0.2315 | |
| CC12CC1NC(=N2)C#N,0.1975 | |
| C1NC11CC2(CO2)C=C1,0.225 | |
| CC1COC1(C)C1CO1,0.3213 | |
| CC1CC1(CCO)C#N,0.3007 | |
| CC12CC1COC2=N,0.2811 | |
| CC12CC(=O)N1C2C#C,0.2298 | |
| OCC(COC=O)C#N,0.2838 | |
| CNC12CC1(O)CC2=O,0.2086 | |
| CC1(CCC1)OCC#C,0.287 | |
| C#CCn1cc[nH]c1=O,0.2293 | |
| CC1OC2(CC12C)C#C,0.2442 | |
| CC1CC2(C)CC1C2=O,0.2277 | |
| N#CC1C2CC1C2=O,0.252 | |
| CCCOCC1CCC1,0.3393 | |
| CC1=CC(NC1)C#N,0.2381 | |
| NC(=O)C(OC=N)C=O,0.2104 | |
| CC#CCC#CCC=O,0.2174 | |
| CCC1(CO1)C1(C)CN1,0.3213 | |
| CC#CCC1CC(C)O1,0.2928 | |
| C1OC2C3NC4C3NC124,0.27 | |
| CNC(=O)C1CC(O)C1,0.2553 | |
| OC12CC(C1)C1CC21,0.3218 | |
| CN(CC1CN1)C(C)=O,0.2681 | |
| CC1OC1C1CC1C#C,0.2887 | |
| CCC1OC(=O)C=C1N,0.2226 | |
| CC(O)C(C=O)C(C)O,0.216 | |
| CC#CC(=NO)COC,0.2073 | |
| N=C1N=NON=C1C#N,0.1721 | |
| COCC(=O)C1CO1,0.2097 | |
| ON=C1CC(C1)C1CO1,0.2504 | |
| OCC(O)C(CO)CO,0.2987 | |
| O=C1C=CC2CC12C#N,0.1882 | |
| CCC12CC(N1)C2=NO,0.2641 | |
| CC1CC2C=CC1C=C2,0.238 | |
| CCC1OC2(CC2)C1O,0.2969 | |
| N=C1OCC2=C1C=NO2,0.2245 | |
| c1c(n2c(n1)[nH]nn2)N,0.1903 | |
| CC12CCC1(CO2)C=O,0.2126 | |
| Cc1c(c(no1)N)OC,0.2391 | |
| OC1CC1C1CCC1O,0.3176 | |
| O=C1CC2CC2N=CO1,0.2336 | |
| CC12OC(=N)C3CC1C23,0.2692 | |
| NC1(CNCC=C1)C#N,0.2239 | |
| c1c(n[nH]n1)C=O,0.198 | |
| CCC(NC=[NH2+])C([O-])=O,0.2574 | |
| C1OC2C3COCC1C23,0.3005 | |
| c1c(nco1)NC=N,0.214 | |
| O=C1COCC2(CN2)C1,0.213 | |
| CC1(CN1)C1=COC=N1,0.2372 | |
| CCC1NC1(C)C(C)O,0.3072 | |
| O=CC12C3C1C1CC3C21,0.2176 | |
| CCC1OCCC1C,0.3218 | |
| OCC1(C#N)C2COC12,0.2799 | |
| CC1CC2(C1)C1COC21,0.3046 | |
| CC(O)C#CCNC=O,0.2718 | |
| CN=C1C(=O)CC=CN1,0.1588 | |
| OC12C3C1N1CC2(O)C31,0.2694 | |
| CC1(COC(=O)N1)C,0.3136 | |
| CC1=CC(C)(CC1)C#N,0.2553 | |
| C(=N)N(C=N)C(=N)C#N,0.1944 | |
| CN1C=CN(C=O)C1=N,0.1697 | |
| CC1NC11CC(O)C1,0.3118 | |
| OC1C2C3C1C=CC23O,0.2317 | |
| CN1C(=O)C2(C)CC12C,0.2457 | |
| OC1=CNC=NC1=N,0.1891 | |
| CCC1(C)CCC=C1,0.2625 | |
| CC(C=O)C1=NOC=C1,0.2187 | |
| CCc1ncc(o1)OC,0.2292 | |
| CC(O)C1OCC1C=O,0.2239 | |
| CCN(C)C1COC1=N,0.2392 | |
| CC1CC23CC4N2CC134,0.2538 | |
| O=CN1C2CC1C2C#C,0.2508 | |
| O=CC1C2C3OC2C13,0.219 | |
| CC12CN1C=NC2C#C,0.2437 | |
| O=C1CC2NC11CNC21,0.2205 | |
| CC1(O)CC1C(N)C#N,0.2828 | |
| CC1=C(C#C)C2NC2C1,0.1995 | |
| CC1(CN=C(N)O1)C#C,0.2522 | |
| CC12CCC=C1CC2O,0.2408 | |
| CC(C=O)(C#N)C(N)=O,0.217 | |
| O=C1CNC2CC12C#C,0.1962 | |
| OC1CNC11CCC1=O,0.1985 | |
| NC(=O)CC1CC(=N)O1,0.262 | |
| CC12OCC1(O)CC=C2,0.2507 | |
| C1c2c(non2)N=CO1,0.2075 | |
| CCC12CC(O)C1N2,0.3144 | |
| CCC1(C)OCC1(C)C,0.3139 | |
| CCOC1(C)CC1OC,0.3174 | |
| [NH3+][C-]1C=CC2=C1N=NO2,0.154 | |
| C1CC=C(C1)CN2CC2,0.2552 | |
| c1c([nH]nc1N)CCO,0.2318 | |
| C1CCNC(=O)NC1,0.2949 | |
| CC(C)C(O)CCC#N,0.3215 | |
| CCOC(C)CC1CO1,0.3302 | |
| C1OC2C3C4COC3C124,0.2975 | |
| COCC(C)CCC#C,0.312 | |
| CCCN1CC1COC,0.2971 | |
| CC1OC1(C=O)C(N)=O,0.1983 | |
| Cc1c[nH]c(c1C#N)N,0.2104 | |
| C1C2OC1C13CN(C1)C23,0.2761 | |
| CCOC1C2CC=CC12,0.2417 | |
| OCC12CN1C1(CC1)C2,0.2979 | |
| CC(=O)c1conc1N,0.1808 | |
| CCN1CC(C)C1C=O,0.196 | |
| CC(C)(CO)C#C,0.3127 | |
| c1cnc(cc1N)C#N,0.1956 | |
| OC1CN2C1=NCC2=O,0.2252 | |
| CC1=CCC2OC12CO,0.2455 | |
| C1C2CCCOCC12,0.3282 | |
| O=C1C2C3OC4C3C1C24,0.2309 | |
| CC12CC=C3C4C1N4C23,0.1605 | |
| CCC(C)C(C#N)C#N,0.3241 | |
| CC1OC2C1C2(O)C#N,0.2627 | |
| CC12CC(O)C3CC1C23,0.3218 | |
| COCC12CC1OCC2,0.3122 | |
| CC1C2CC(C2)OC1=O,0.268 | |
| CC1(C)OC(C=O)C=C1,0.2028 | |
| CC(=O)C1C2NC1C2=O,0.2261 | |
| CNC1C(C)NC1C#N,0.248 | |
| CC1C2NC(CO)=NC12,0.2384 | |
| O=CCC1CN1C=O,0.2191 | |
| COCC(=O)OC(C)=N,0.2583 | |
| OC12CC(C1)CC21CC1,0.3181 | |
| c1c2c([nH]n1)nc[nH]2,0.2184 | |
| CN=C1C=NN(C)C=N1,0.1733 | |
| CC(O)(CCC#C)C#N,0.2828 | |
| CC12CC3CC1OC3O2,0.3464 | |
| CC(C)(C)C1CC1C=O,0.2261 | |
| COc1cnccc1O,0.2217 | |
| C1CCC2(C1)CCCC2,0.3628 | |
| C1C2C3C4C5CC14C2N35,0.283 | |
| C(C(=O)N)C(=O)NC=O,0.2064 | |
| CC1C2C3CN(C23)C1=O,0.2295 | |
| COCC12NC1CC2C,0.2955 | |
| CC1CC2C(O1)C2(C)C,0.3103 | |
| COC(C)CC(C)C#N,0.3075 | |
| CN1C(=O)CN=C1N,0.2336 | |
| OC1CC11CN2CC12,0.2965 | |
| CC(OCC#N)C#C,0.2734 | |
| Cn1ccc(n1)OC=O,0.2411 | |
| c1coc2c1C(=O)C=C2,0.1258 | |
| CC1C2C3C(C#C)C1N23,0.2857 | |
| CCCC1CCN=CO1,0.2732 | |
| COC(C)C1C(O)C1O,0.2923 | |
| CCC12C3C4C(C13)N24,0.281 | |
| CCC(C)C(O)C(N)=O,0.2756 | |
| CC1C2CC2N1C(C)=O,0.2586 | |
| OCC(CO)C(O)C#C,0.2721 | |
| C1OC23C4CC2OC13C4,0.2748 | |
| CC1CC(C#N)C1=NO,0.2456 | |
| CCCN=C(C(=O)N)N,0.2136 | |
| CC1=C(N)C(=N)OC=N1,0.1639 | |
| CCC1N2CCC12CO,0.3094 | |
| C(c1c(c(no1)N)N)O,0.2134 | |
| CNCC(C=O)C#N,0.1874 | |
| OC1CC1(O)CN1CC1,0.3059 | |
| CC(C)OC(C)(C)C#C,0.2928 | |
| C#CC1C2C3C4C2C1N34,0.2769 | |
| CC(=NO)C(C)(C)CO,0.2529 | |
| CC1(C)NC1C(=O)CO,0.2238 | |
| CCCC1CC1CC=O,0.2256 | |
| CC1(CNC1=O)OC=O,0.264 | |
| OCC1N=COC1C#N,0.255 | |
| CC1CC(C)C1C1CO1,0.3353 | |
| CC(O)C(=O)C1CC1O,0.216 | |
| CNC1=CC(=O)C2CC12,0.1954 | |
| Cc1cc(cnc1F)F,0.2125 | |
| c1nc(no1)C#CC#N,0.2004 | |
| CC1(CN1CC#N)C,0.2755 | |
| CNC(=O)C(C)C#N,0.278 | |
| c1c-2cncc2nc[nH]1,0.1375 | |
| OC(C#N)C12CC1CC2,0.2845 | |
| OC12CC3(OC1C23)C#N,0.238 | |
| C1Oc2c(oc(n2)N)O1,0.1928 | |
| CCC1CC2NC2C1O,0.3058 | |
| C#CC1=CC(=O)CNC1,0.1589 | |
| OC1C2N3CC1C23C=O,0.2182 | |
| C#CC1C2OC1C21CC1,0.2798 | |
| C1C(=O)CC1(C=O)C=O,0.2168 | |
| CN1C=NC(=N)N=C1F,0.1995 | |
| CC1CC(=O)C1CCO,0.2196 | |
| CCC#CCCC1CO1,0.2996 | |
| Cn1c(cccc1=O)O,0.1794 | |
| CC1=NC=C(N)C(=N)O1,0.1662 | |
| C1C(N=CN1)(C=O)C=O,0.1732 | |
| C1C2CCOC3CN1C23,0.274 | |
| CC(C)C(=O)N,0.278 | |
| CC12CC1(CO2)C#C,0.2604 | |
| CC1C2CC2(C)NC1=O,0.2618 | |
| CC1C2C3CC1C(C)N23,0.3215 | |
| CC1C2OC1(C)C2(C)C,0.316 | |
| COCC(C)C#N,0.3096 | |
| CC(NC(=O)C=O)C#C,0.1745 | |
| OCC1CC2(CN12)C=O,0.2141 | |
| CC1=CC(F)=NOC1=N,0.1677 | |
| CC(C)C1CC(CO)O1,0.313 | |
| CC12OC1C1C2OC1=O,0.2683 | |
| CN1C=NC(=N)C(C)=C1,0.1897 | |
| C1CC1OCCC#N,0.2959 | |
| CCc1c(nnn1C)O,0.2209 | |
| C1CC(C1)C(F)(F)F,0.3994 | |
| CC(CC1OC1C)C=O,0.2295 | |
| CCN1C2COC2C1=O,0.2489 | |
| c1nnn(n1)CCO,0.2625 | |
| O=C1N2CC2CC2CN12,0.2655 | |
| O=C1NC2CN3CC3C12,0.2521 | |
| CC1C2CC(C)(O2)C1O,0.3221 | |
| COC1(CC1)C1NC1,0.3199 | |
| CC(C)C1CC(C)C1=O,0.2175 | |
| C1CC23C1(CC2)CC3,0.293 | |
| CC1OC1C1(CC1)C#C,0.2881 | |
| COC(=O)C(=O)NC=N,0.1854 | |
| COCC1(CC1O)C=O,0.2267 | |
| C(CCC#N)CCO,0.3089 | |
| CCC1COC(=O)OC1,0.3193 | |
| C(CC(F)(F)F)C(=O)N,0.2814 | |
| CC(CO)OCCC#C,0.3095 | |
| CC1C2C3CC3C1C2C,0.334 | |
| C1CC(=CCC=C1)C#N,0.214 | |
| OCC1CC2(O)CC1C2,0.3264 | |
| C#CC12CC3C1C=CC23,0.2187 | |
| CC(C#C)(C#C)OC=O,0.2634 | |
| CNc1c(cno1)C=O,0.1955 | |
| O=CC1OC2COC1C2,0.2198 | |
| c1c[nH]c2c1COC2=O,0.2124 | |
| c1c(oc(=O)n1C=O)O,0.1913 | |
| CC1=C(CC=CCC1)C,0.2401 | |
| O=C1NC=NC2CC2O1,0.2359 | |
| OC1C2C1C(=O)NC2=N,0.2377 | |
| c1c2c(co1)OC=NC2,0.2267 | |
| CC1(NCC1O)C#N,0.2768 | |
| CC12C3CC(CC1=O)C23,0.2227 | |
| CC1(C=O)C2CC1O2,0.207 | |
| CC12CCC1(O)C1CC21,0.3112 | |
| CC(C)c1cnc([nH]1)O,0.2465 | |
| C1C2OC3CCCC2C13,0.3154 | |
| CC12COC(C1)C(=N)O2,0.2728 | |
| NC1=CC=C(F)OC1=N,0.1588 | |
| O=C1C2CCC(O2)C1=O,0.1381 | |
| NC1=[NH+]CC(C1)C([O-])=O,0.2644 | |
| c1c(oc(=O)o1)N=CN,0.1906 | |
| NC(=O)C1N=CN2CC12,0.2258 | |
| OC1C2NC(=O)C12C=O,0.2116 | |
| O=CC1C2C3C2N2C3C12,0.2137 | |
| C#CC1CCCOCC1,0.3005 | |
| CC1OC11C=CC2CC12,0.2384 | |
| CCCN1CC12COC2,0.3038 | |
| CC1C2OCOC(=N)C12,0.2684 | |
| CC(C)(CC=O)OC,0.2231 | |
| C1C2CN1CCOC=N2,0.2077 | |
| Cc1[nH]c(c(n1)O)C#N,0.2012 | |
| CCOc1cc(no1)C,0.2405 | |
| O=CCCC1(CO1)C=O,0.204 | |
| C1CC(C1)COCCO,0.3409 | |
| N#CC1NCC=CC=C1,0.1894 | |
| O=CN1CC2CCC2C1,0.2687 | |
| CC(=O)OCCOC,0.2798 | |
| O=CC(=O)C1COCO1,0.1467 | |
| O=CC1(C#N)C2CCN12,0.2072 | |
| CCOC(C)C(=O)CO,0.2342 | |
| CCOc1c[nH]cc1C,0.2424 | |
| C#CC1CCC1N1CC1,0.2806 | |
| CC(O)(C=O)C1CC1,0.2152 | |
| COCC12CC1N=CO2,0.2592 | |
| OC1(CC1)C1CCCO1,0.3198 | |
| N=C1OCC2=C1N=NO2,0.1681 | |
| CC(CC#N)OCC#C,0.2884 | |
| c1c[nH]c(c1C=O)C#N,0.1833 | |
| COCCC1CCC1,0.3373 | |
| CC(O)C12CC(O)C1N2,0.3121 | |
| CN=C1C(=NO)C=CN1,0.1442 | |
| c1c(non1)CO,0.2448 | |
| CCC1CC2(CN2)C=C1,0.2438 | |
| COC1C(C)CC1C=O,0.2202 | |
| C1CC1OC1OCC=C1,0.2588 | |
| COC1CC2(OC12)C#N,0.2658 | |
| CC1COC1=NCC=O,0.2241 | |
| O=COCC12CN(C1)C2,0.242 | |
| CCC1(C)C2CCC12C,0.3219 | |
| OC1CNCC1=O,0.2002 | |
| OC1COCC1C=O,0.2237 | |
| CN1C(C#N)C(N)C1=N,0.2492 | |
| Cc1ccn(c1C=O)C,0.1827 | |
| OC1CCC2CC1(O)C2,0.3082 | |
| CC1NC2CC2(O)C1=O,0.1907 | |
| N=C1OC2COCCC12,0.2802 | |
| c1nc2n(n1)CC(=O)O2,0.2214 | |
| CCC(OC(C)=N)C=O,0.2266 | |
| Cc1cc(c(=O)[nH]c1)N,0.1688 | |
| O=C1C2N3CC1C23C#N,0.2234 | |
| C(CO)C=O,0.225 | |
| C(CC(=N)NC=O)C#N,0.233 | |
| OC1CC2CC11OCC21,0.2863 | |
| CC1CC2CC(C)C1C2,0.3472 | |
| CN=c1oc(no1)N,0.2523 | |
| CC1CNC(=O)N1,0.3078 | |
| N#CC1C2CCC1C2=O,0.2296 | |
| C1CC2C1C1CCC21,0.3211 | |
| OCC12CC=CC1N2,0.2351 | |
| CC#CC1CC2COC12,0.2811 | |
| OCC1CCC(O1)C#N,0.2808 | |
| C1CC2COCC(C1)O2,0.3055 | |
| C1CC23C4OC12C1C4N31,0.2725 | |
| CC#Cc1c[nH]c(n1)C,0.2154 | |
| CC(CC[NH3+])CC([O-])=O,0.2744 | |
| N#CC12C3C4C1N4C23,0.2397 | |
| CN=C1NC(C)C(=O)N1,0.2236 | |
| CC(C)c1nnn(n1)C,0.2565 | |
| CC#CC1C2CC1C2,0.2892 | |
| O=C1CC2(C1)C1CC2O1,0.2141 | |
| CC12CC3C1OCCN23,0.302 | |
| N#CC#CC1CCO1,0.2209 | |
| CC#CC12OCC1C2C,0.2433 | |
| CC1CC2C3OC3C12O,0.3118 | |
| C#CCC(=O)C1(CC1)O,0.2238 | |
| C1C(=NO)CN1CC=O,0.2058 | |
| C1OCC2OC2C=C1,0.2399 | |
| CC1C2CC2C(O)C1C,0.3157 | |
| N#CC12OC3CC1C2O3,0.267 | |
| CC1C=CC2(C)C(O)C12,0.2279 | |
| CCOc1cc[nH]c1N,0.231 | |
| CC12CC3(CCC3)C1N2,0.3287 | |
| CC1CC11CN2CC12,0.3055 | |
| CC1N=C(C)OC1CO,0.2652 | |
| Cc1c(c(on1)C=O)N,0.1693 | |
| O=C1NCC2CC12C#C,0.2612 | |
| CC12C3C1C1(C)CC3C21,0.3239 | |
| CC(C)C12CCC1C2C,0.3192 | |
| N=C1CC=CC(O1)C=O,0.2069 | |
| CC1CC(C)C(O1)C#N,0.2906 | |
| C1C2OC11C3NC3CC21,0.2869 | |
| CCN(C=O)C(C)C#N,0.2719 | |
| c1cocc1NC=O,0.2155 | |
| OC1CC(CC1O)C#C,0.3013 | |
| CC1C(C)C1C=O,0.2255 | |
| OC(CC=O)C(O)C#N,0.2289 | |
| C#Cc1cnnn1C=O,0.184 | |
| COC12CC1(C)CC2O,0.3218 | |
| CC(=O)C12CC(C1)O2,0.223 | |
| OCC1(OC1C=O)C=O,0.1979 | |
| Cc1c[nH]c(c1CO)C,0.2331 | |
| CNC(=O)CC(=O)OC,0.2418 | |
| CC1OC1C1C2CC1C2,0.3501 | |
| CC(C)C(O)C1CC1O,0.3114 | |
| OC1C2NC(C=C2)C1=O,0.1925 | |
| C1C2C3OC22C=CC1C32,0.2246 | |
| CC1CC1C1(O)COC1,0.3097 | |
| CC(O)CC1C(C)C1O,0.3122 | |
| c1c([nH]cn1)NC=O,0.2053 | |
| CC1(CNC=[NH+]1)C([O-])=O,0.2388 | |
| OC12C3C1C1=CC3C2=C1,0.1523 | |
| COCCC(C)(O)CO,0.3049 | |
| CC#CC1CNCC1=O,0.1974 | |
| C1CC1CN2CC2,0.322 | |
| CCn1c(cnc1O)N,0.2446 | |
| COc1c[nH]nc1OC,0.2303 | |
| CC1(O)CC(=O)CC1O,0.222 | |
| C#CC1=CC(=O)CC1=O,0.1485 | |
| C1CC2CCC1OCO2,0.3167 | |
| CC1COC(OC1)C#N,0.299 | |
| OCC(=O)C(O)CC#C,0.2171 | |
| O=CC#CC(=O)C1CN1,0.1853 | |
| CC1(O)C(O)C1C(N)=O,0.2475 | |
| O=C1C=CC(C#C)C1=O,0.137 | |
| CC1C(N2CC2)C1(C)O,0.3118 | |
| OC12CC3(C1)OC=NC23,0.258 | |
| CC1C2C3OC2C13C#C,0.2654 | |
| C(=Nc1nnon1)N,0.1938 | |
| CN1CC1CC1CCC1,0.3016 | |
| CC1C(C#C)C1(C)C#N,0.2693 | |
| CCc1cc([nH]n1)O,0.258 | |
| CCC(O)CC(=N)OC,0.2782 | |
| C(#N)C(=O)C(=N)N,0.1654 | |
| OC1C2CC3OC1OC23,0.3304 | |
| O=COC1CNCCO1,0.2329 | |
| N=C1OC=NC(=O)C=N1,0.1754 | |
| COCC1C(O)C1C#N,0.2831 | |
| CC1(C)C2CC(C=O)N12,0.2058 | |
| COC12CC(C1)C21CC1,0.3439 | |
| O1C=NC2=C1ON=N2,0.148 | |
| CC1OCC11OC1C#N,0.2557 | |
| OC1COC2(CC12)C#C,0.26 | |
| N=C1NC(=NO1)C1CC1,0.2245 | |
| CC(C)NC(=O)C1CN1,0.2707 | |
| Cc1c[nH]c(n1)OC,0.251 | |
| CN=C1C(C)CN1C=O,0.2251 | |
| CC1=CCOCC1(C)O,0.2565 | |
| C#CC1CC2=NCCN12,0.2446 | |
| Cc1cc(on1)CC#N,0.2482 | |
| O=C1OCC(O1)C1CN1,0.2954 | |
| OC1CC2CCOC12,0.3043 | |
| O=C1OCC2CC12,0.2731 | |
| C1C2CC3C4C1C2N34,0.3021 | |
| C1CC11OC2=NCCC12,0.2611 | |
| CN(CC=O)CC#C,0.2049 | |
| CN=C1OC2C3CC3C12,0.2726 | |
| O=CCC1OC11COC1,0.2233 | |
| CCCNc1ccco1,0.2186 | |
| CC([NH3+])C1=CC(=O)O[CH-]1,0.2283 | |
| CC1(CN1)C1(C)CO1,0.316 | |
| CC12OC1CC2C1CO1,0.3256 | |
| N#CCC1CC2CN2C1,0.2682 | |
| O=CN1C2CC1C2C#N,0.2482 | |
| OC1C2CCCC12O,0.3094 | |
| NC(=O)C12CC(N1)C2=O,0.2371 | |
| c1c(c(cnc1F)O)O,0.2138 | |
| CCC1CC1N(C)C=O,0.2643 | |
| CC1CC1C1=CN=CN1,0.2436 | |
| OC1C2CC3OC3C12O,0.2954 | |
| O1C2C1C1C3C4C2C1N34,0.3195 | |
| CC(C#N)N1C=CN=N1,0.2542 | |
| CC1CNC2=C1C=CN2,0.2246 | |
| CCc1nc(co1)OC,0.2158 | |
| CCC12NC3(C)C1OC23,0.2932 | |
| N=COC1(CNC1)C#N,0.2479 | |
| Cc1ccccc(=O)n1,0.1692 | |
| CC1(OC(=O)C=C1)C#C,0.2216 | |
| O=C1CNC1C#CC#C,0.1995 | |
| CC12C3C4C5C(C1N34)N25,0.2623 | |
| C#CC#CC1=CCOC1,0.1752 | |
| C1OC2=NC3C4NC13C24,0.1573 | |
| CC(C=O)C1(C)COC1,0.2125 | |
| CC1COCOC11CC1,0.3334 | |
| CC1(C)CC(O)CCO1,0.3236 | |
| OCC1OC(C=O)C=C1,0.2001 | |
| CNC(=N)C(=O)C=O,0.1165 | |
| CC(O)C1NC11COC1,0.3021 | |
| OC1CC2CCC1C2=O,0.2232 | |
| CC(C=O)C(=O)CC=O,0.2141 | |
| CC(C(O)C#N)N1CC1,0.2783 | |
| CC1C2C1C1(C)NC21C,0.2746 | |
| ON=C1CN2CC(O)C12,0.218 | |
| CC1CC11CC=CC1,0.2639 | |
| CC1(OCCCO1)C#C,0.298 | |
| COCCCC(=O)CO,0.2356 | |
| CN(C)c1c[nH]cc1N,0.2304 | |
| CCOCC(CO)CO,0.3142 | |
| CC1OC1CN1CC1,0.3247 | |
| C1COC(=O)OC=N1,0.258 | |
| O=CC1NC(=O)NC=C1,0.1829 | |
| C#CC1CCC11CN1,0.2789 | |
| CN1CC2(O)CC2C1=O,0.2621 | |
| CC1C2CC1(O)C2(C)C,0.3253 | |
| CCC1CN2N=CN=C12,0.2728 | |
| CC1(O)CC(=O)C1C#C,0.2137 | |
| Cn1c2c(nn1)ocn2,0.21 | |
| CC12CC(CC1)C2C#N,0.3225 | |
| CC1N2C3CC2(C3)C1=O,0.1911 | |
| OC1=NC(=N)C=CN1,0.1987 | |
| CCCOC(=O)CN,0.2622 | |
| CCC(C)C(O)CC=O,0.2316 | |
| CC1(C)C2(O)COC12C,0.2782 | |
| CCC1(O)C(O)C1C=O,0.2197 | |
| OC1CC1C1(CO1)C=O,0.1986 | |
| OC1=C2CCN2C(=O)N1,0.223 | |
| CC#CC1C2N1CC2=O,0.2121 | |
| CCNC1(CNC1)C#N,0.263 | |
| CC1CC(C1)C1CC1O,0.3303 | |
| CC1C(C)C2OCOC12,0.3118 | |
| CC1C(O)C=CC1(C)O,0.2552 | |
| OCC12CC3C(C1)C3C2,0.3298 | |
| CC1(CN=CO1)C1CC1,0.2729 | |
| O=C1OCOC2CNC12,0.2362 | |
| CNC(=O)C1NC1C,0.2644 | |
| CCNc1ccn(n1)C,0.2206 | |
| OC(CC1CC1)C=O,0.2274 | |
| CCC1(O)C(C)CC1=O,0.2175 | |
| CC1C2CCC(=O)CC12,0.224 | |
| CC1=C(CC(=O)N1)C#C,0.1825 | |
| ON=C1CC2OC12C#C,0.2363 | |
| CCc1ccc2n1CC2,0.2416 | |
| C#CC1=CC=CCOC1,0.1603 | |
| N=C1CC2N=COC2O1,0.2697 | |
| C#CC1CCC1C#N,0.289 | |
| CCOC12CC1(O)CC2,0.2998 | |
| CC12OC1CC(=O)C=C2,0.1819 | |
| C1C2CC34CC1C23CO4,0.2876 | |
| OC1C2N3CC3C12C=O,0.2051 | |
| CC(CO)(CO)OC=N,0.277 | |
| CNC1(CCC1=O)C#N,0.2033 | |
| c1c(nc(nc1F)F)N,0.2323 | |
| c1c2c(on1)OCOC2,0.233 | |
| CC12C3CC1N=COC23,0.2597 | |
| OC1C2C3C2C1C3C=O,0.226 | |
| Cc1cc2c([nH]1)CCN2,0.2079 | |
| OC12CC3OC1C23C#C,0.251 | |
| NC1=[NH+]C(=N)C(F)=N[N-]1,0.1813 | |
| c1conc1C2(CC2)O,0.2425 | |
| CCC(O)CC(F)(F)F,0.3374 | |
| CC1CN1CC#CCO,0.256 | |
| N=C1NC=NC1CC=O,0.2179 | |
| O=CC1CC2OC(=O)C12,0.2268 | |
| Cc1c2c(on1)C=CC2,0.1883 | |
| CC1CC2(C)CC12C=O,0.2173 | |
| CC#Cc1c(nc[nH]1)C,0.203 | |
| CC1CC2(CC2(C)O)O1,0.2966 | |
| CC1C(CC=O)C1(C)C,0.2245 | |
| N=C(OC=O)C1CCC1,0.2455 | |
| NC(=O)C1C2CC2C1O,0.2663 | |
| COCC1OCC2CC12,0.3359 | |
| CCC(CC)CC1CC1,0.3595 | |
| CC1OC2COC1(C)C2,0.3189 | |
| OC12C3OCC1COC23,0.2879 | |
| CCNc1c(nco1)N,0.2127 | |
| CC1C2NC2(C)C1CO,0.289 | |
| COC12CCC1OCC2,0.3181 | |
| CC(CO)CC1CO1,0.3395 | |
| C1C2C3C4C1C1C2C3N41,0.2704 | |
| c1c(nc(cn1)N)C#N,0.1712 | |
| CCC12CC(CO1)C2=O,0.2067 | |
| CC1(CC=CCC1=O)C,0.2237 | |
| [NH3+]CCCOCC([O-])=O,0.2457 | |
| COC1C=CC(=O)C1C,0.1883 | |
| Cc1c(cc[nH]c1=O)F,0.1854 | |
| CCCC(C)CC=O,0.228 | |
| CC12CC(=O)C1OCO2,0.1932 | |
| CCC1(O)CC2NC12C,0.2904 | |
| OCC(C#N)C1CN1,0.2769 | |
| C#CC1C2C3CC2C13,0.3009 | |
| CN1C2CC1C2OC=O,0.2213 | |
| CN=C(c1cocn1)N,0.2041 | |
| CC(C#N)C1COC1=O,0.279 | |
| C1C2C3CC1COC23,0.2986 | |
| CCC12CCC1C1CC21,0.3145 | |
| CC1CC(C=O)C1(C)O,0.2192 | |
| c1cc(oc1CCO)N,0.218 | |
| Cc1c[nH]cc(c1=O)O,0.1895 | |
| C1OC1C#CC1CO1,0.2561 | |
| C1C2C3OCC(C=C3)N12,0.2229 | |
| CC(C)(C)C1CCCO1,0.3147 | |
| CC1OCCCC(=O)O1,0.2721 | |
| CC1CC2CC12C#N,0.2875 | |
| C1C2CC1N=COC2,0.2687 | |
| CC1CC([NH3+])(C1)C([O-])=O,0.2694 | |
| CC1C(CO)C2CC12C,0.3176 | |
| N=C1OC(=O)C=C1,0.1939 | |
| CC1OC1C(CO)C#C,0.2982 | |
| CC1CC2C1C1CC21O,0.3109 | |
| CC1OC2C3CC3C2=C1,0.2316 | |
| CC(CNC=O)C1CC1,0.2794 | |
| OC12CC1C(C=C2)C#C,0.2467 | |
| CCC12CC(C1)(C2)OC,0.3335 | |
| CN=C(C=O)NC1CC1,0.1609 | |
| c1cncc2c1non2,0.1638 | |
| CCC1N2CC2C11CC1,0.3066 | |
| CC1=C(C(=O)OC1)C#C,0.197 | |
| c1c2c(coc2[nH]n1)N,0.2159 | |
| CC1CN2C(C3CO3)C12,0.3052 | |
| C1OC1C12CN(C1)C2,0.3143 | |
| C#CC12CC3C(O1)C3O2,0.2709 | |
| CC1C2OC2C1(O)C=O,0.2116 | |
| OCC1(CCO1)C=O,0.21 | |
| NC(=O)C12CC1C1NC21,0.237 | |
| CC1OCC1COC=N,0.2686 | |
| CC12OC3C1CC23C#N,0.2661 | |
| N#CC1NCCN2CC12,0.2539 | |
| C1CCC(CC1)(C=O)O,0.2307 | |
| NC1=CC(=N)OC1C#C,0.2127 | |
| CC1NC(=O)CC=C1,0.2499 | |
| CCCC(=O)CC(C)O,0.2283 | |
| O=C1CC2(CC1O2)C#N,0.2169 | |
| c1c(nnnn1)C2CC2,0.1683 | |
| CC(C)(C)NC(=O)C#C,0.232 | |
| O=C1NC2CN3C2C13,0.2474 | |
| c1cc([nH]c1)CC(=O)N,0.2119 | |
| CC1OC(=O)C(C)=C1C,0.2315 | |
| C(CC(=O)C#N)C=O,0.1725 | |
| Cc1c(cco1)CO,0.2346 | |
| CC#CCc1nc[nH]n1,0.2488 | |
| CC1(C=CC2CN12)C#N,0.2297 | |
| CC(=O)c1cocn1,0.2034 | |
| OCC1CC(CC#N)O1,0.2878 | |
| Cn1ccc2c1[nH]cc2,0.2242 | |
| C#Cc1conc1CO,0.2181 | |
| CC1CC2(CC2O)C1=O,0.2136 | |
| CC1(CCC1)OC,0.3257 | |
| O=C1OC2CCC1OC2,0.2561 | |
| CC12CC(O)CC1CO2,0.3079 | |
| OCC12OC(=O)C1C2O,0.2737 | |
| CCCC12COC1C2C,0.3023 | |
| C1CC(=O)OC1,0.2795 | |
| CC1CC2=COC=C2O1,0.2266 | |
| CC12OC(C3NC13)C2=O,0.2349 | |
| CC1(CC(C1)COC)C,0.3316 | |
| CC1C2C(=O)CCC12C,0.2229 | |
| C1NC11C2NC2C2OC12,0.2978 | |
| C1CC11C2CC3OC2C13,0.3292 | |
| C#Cc1c(nco1)CO,0.2009 | |
| N1C=CC=CC=CN=C1,0.1803 | |
| Cc1cc(=O)onc1C,0.1839 | |
| CC#CC(C)(C)C,0.3086 | |
| OCC(C#N)C1CC1,0.3071 | |
| CC1CC(C)(O1)C(N)=O,0.265 | |
| CC(C)CC1OCC1=O,0.2243 | |
| CCC1C(C#CC)N1C,0.2552 | |
| OC1COC1CCC#N,0.3012 | |
| O=C1OC=NCC11CO1,0.2316 | |
| CN1CC(O)COC1=O,0.2908 | |
| C1CN1C1C2CC1C2,0.3161 | |
| CCNc1ccc[nH]1,0.2389 | |
| CC1CC=C(C=O)C1=O,0.1616 | |
| CC12C3C1N1C3C21C#C,0.2297 | |
| CC1OC1(C)C#C,0.2868 | |
| CC1N2C=NCC12CO,0.2395 | |
| CC12CC1(O)C(N2)C#C,0.2517 | |
| OC1C23CCOC12CO3,0.2669 | |
| CCC(C)N1CC1CO,0.279 | |
| COc1cc(c[nH]1)O,0.2372 | |
| CC(O)C1CC1CO,0.307 | |
| c1c2n(nn1)C(=O)CC2,0.2116 | |
| CC1CC2(CO2)CC1=O,0.2182 | |
| CN=C1CCC(O1)C=O,0.2096 | |
| CN1CC(OC=O)C1=O,0.2601 | |
| CN(C=N)C(=O)CO,0.2353 | |
| OC(COCC#C)C#N,0.2795 | |
| c1([nH]nc(n1)N(=O)=O)O,0.1963 | |
| C#CC(=O)CC#CCO,0.1891 | |
| CN=c1n(cco1)C=O,0.1874 | |
| CC1(CC1CO)C#N,0.3123 | |
| Cn1cc(c(n1)N)OC,0.2174 | |
| c1c(nc(c(n1)F)N)O,0.1792 | |
| OCC12CC3(O)C(O1)C23,0.2851 | |
| OC1CC2CCC2=C1,0.2457 | |
| C1CC1(C#N)OCC=O,0.2287 | |
| CC1(O)CC(O)C(O)C1,0.2935 | |
| c1cnc(oc1=O)F,0.1994 | |
| CC12CCC1C2(O)C#N,0.2855 | |
| O=C1COC2CNC=C12,0.1761 | |
| CC1C2COC=NC12,0.2537 | |
| CCC12C3OC(C13)C2O,0.3082 | |
| CC#CC(O)C1(C)CN1,0.2657 | |
| CCC(C)CC1(C)CO1,0.3404 | |
| CC1(O)CC(=O)NC=C1,0.211 | |
| C(C(C#N)(C#N)O)N,0.2362 | |
| CC1(O)C2CCC(O)C12,0.3098 | |
| COC(C)CC(C)OC,0.3211 | |
| C#CCC1=CC(=O)NC1,0.2143 | |
| CC1CNC(=O)C=CN1,0.2038 | |
| OC1C2CC2C1C#C,0.2919 | |
| CC#CCC(O)CC=O,0.2201 | |
| COC1(CC2CC12)C#N,0.2906 | |
| CC12C3CN(C13)C21CC1,0.3082 | |
| CNC(=O)CCC#C,0.2752 | |
| CC1NC1C1=CC=NO1,0.2298 | |
| N=C1OCOCC=C1,0.2136 | |
| N=C1OCC2CCOC12,0.2692 | |
| CC(C)C(C)C1CN1C,0.302 | |
| CC1OC(=O)C11CCO1,0.2428 | |
| CC#CC1(CO1)C1CC1,0.2782 | |
| C1CC11C2CC3CC1N23,0.2867 | |
| c1(nc(nc(n1)F)F)N,0.2449 | |
| O=CC1CCC=C1C=O,0.1775 | |
| C#CC1OCOC1C#C,0.2776 | |
| OC1C=CC(=N)OC1=O,0.2135 | |
| C1COC(=O)C(=N1)N,0.1984 | |
| OC1C2CC3OC3C12,0.3025 | |
| C1CC2(CC2)C=C1C=O,0.1883 | |
| O=C1CC2NC3C2NC13,0.2035 | |
| C1C=CC=CCO1,0.1898 | |
| C#CC1OCCC2OC12,0.2885 | |
| CCCCc1ncno1,0.2619 | |
| CCN(CC)C(=O)C#N,0.2179 | |
| CC#CC1NC1CC#N,0.2741 | |
| NC1=C(N=NO1)C1CO1,0.2048 | |
| c1c[nH]nc-2nccc12,0.1515 | |
| COC(=O)C(C)N1CC1,0.2485 | |
| c1cc(nc(c1O)F)F,0.2015 | |
| c1c(c(c([nH]1)CO)O)O,0.2253 | |
| OCC12CN1C1CC1C2,0.2952 | |
| OC1C2CC=CC1C2O,0.2434 | |
| CC1C2CC2CC1=NO,0.2516 | |
| CC1C(O)C11CN=CO1,0.2586 | |
| CC1C(CO)C1N1CC1,0.3045 | |
| COC1C2NC2CC1O,0.3023 | |
| C(CC=O)CC#N,0.2278 | |
| CNc1c(c[nH]n1)CO,0.2317 | |
| CC(C)CCC(O)C#C,0.2979 | |
| C1CC1CNC=O,0.281 | |
| COC1=NC(=N)N=CO1,0.2133 | |
| CC12CCCC1CCC2,0.3673 | |
| OC1C=C(NC1=O)C=O,0.1654 | |
| CC(O)C1(C)CC1O,0.3207 | |
| CC(O)CC(=O)C1CC1,0.2266 | |
| CCN1C2C3NC2C13,0.2831 | |
| CC1CC(=O)C(C1)=NO,0.1663 | |
| CC(C)C1(C)CC1(C)C,0.3248 | |
| CC12OCOC1C2C=O,0.2173 | |
| CC1NC2(CC12C)C#N,0.2402 | |
| CC(O)C12OC1CC2O,0.3229 | |
| CC1=C(CCC1)C(=O)N,0.2163 | |
| C1Cc2c(n[nH]n2)C=C1,0.2011 | |
| OC1CC1(C=O)C1CC1,0.2034 | |
| NC(=O)CC1CC1O,0.2788 | |
| CC1C2C(C)C=CC12C,0.242 | |
| C1CC12C(=O)C=CCN2,0.1701 | |
| CN(C)C(CN)C#N,0.2656 | |
| OC1C2C3C1C2N3C=O,0.2516 | |
| C#CCC1NC1CC#C,0.2973 | |
| OC1CCC(=O)OC1,0.2707 | |
| CC12CC1C1NC1CO2,0.2829 | |
| O=C1CNC11CCC=C1,0.2049 | |
| CN=C1OC(C)C11CO1,0.2607 | |
| NC(=O)C12CC1C(O)C2,0.2634 | |
| C1C2CC=CC12,0.2495 | |
| O=COCC12CC(C1)C2,0.2857 | |
| C#CCC12CC3CC1C23,0.3006 | |
| CCCN=COC(=O)C,0.2422 | |
| NC1=NCC(=NO)C1O,0.2234 | |
| CC12CC3C4C3C1(O)C24,0.2889 | |
| CC12NC1C(C=C2)C#N,0.2417 | |
| C#CC12CC3OC(C1)C23,0.2807 | |
| C1C(COC(=O)O1)C=O,0.2211 | |
| CCOC(C)C(C)=NO,0.2569 | |
| NC1(CCC=CC1)C#N,0.2667 | |
| Cc1cc(=O)[nH]cn1,0.1989 | |
| COC1CC(O)C1C#N,0.2938 | |
| C#CC1C2CCOC12,0.27 | |
| CC1C2OCC12C(N)=O,0.2612 | |
| CC(=O)NC,0.2805 | |
| CC(=O)CC1CCC=C1,0.2248 | |
| CC(NC(=N)C#N)C=O,0.1977 | |
| N=COC1=NC=NN=N1,0.1657 | |
| CC12CC3C1CC23CO,0.3355 | |
| C1C2C1C13CCC1C2O3,0.33 | |
| OC1CCC2OC2C1,0.3345 | |
| C1C2CC1C1=CCCC21,0.2494 | |
| OC12C=CC3NC1C23O,0.2157 | |
| CCCOCC(=O)C#N,0.1974 | |
| CCC1CN=C(O1)C#C,0.2171 | |
| COCC1CC(C)C=C1,0.2622 | |
| CCCOC1CN2CC12,0.3075 | |
| CC12OC1C1N=COC21,0.2699 | |
| N#CCC(C#N)N1CC1,0.27 | |
| CC(C)(C#CC#N)O,0.2377 | |
| c1cc(=O)ncnc1,0.1618 | |
| CCc1c(cc(o1)C)O,0.2155 | |
| CCCn1c(ncn1)N,0.2497 | |
| C1C=CC2CC1N=CO2,0.2475 | |
| OC12CC1OCC21CC1,0.2892 | |
| c1c(ncc(=O)[nH]1)CO,0.1653 | |
| COC(C(C)O)C(N)=O,0.2552 | |
| O=C1OC2C1CC21CN1,0.264 | |
| CC(=N)OC1CC1(C)C,0.2849 | |
| Cn1c(coc1=O)CO,0.2348 | |
| CC1C2C3C(O)C3(C)N12,0.2976 | |
| OCC1(C#C)C2CCN12,0.2692 | |
| C1OC1C12NC1C1CC21,0.2806 | |
| CCCN1CCC1C#N,0.2535 | |
| N#CC1CC11CCC=C1,0.2414 | |
| C1OC1C1=CC=NN1,0.2473 | |
| C1C2N1CC1=C2N=NN1,0.2234 | |
| CN1CC(C)(O)CC1=O,0.2704 | |
| C1C2OC2C2OC1C=C2,0.2538 | |
| C[NH+](C)CCCC([O-])=O,0.2712 | |
| CCC1(O)CC11COC1,0.3004 | |
| CCC1(C)CC2COC12,0.3182 | |
| CC12CC(C1)(C2)C#C,0.3032 | |
| C1C2N1C1COCC=C21,0.2346 | |
| CCC(CN)(NC)C#N,0.2628 | |
| OCC1CN1C1CC1O,0.2785 | |
| CC(NC=O)C(C)=O,0.2204 | |
| OC1=CC=C2C3CC3N12,0.2079 | |
| OCC1CCOC(=N)O1,0.2904 | |
| CC(C#N)(C#N)C(=N)N,0.2578 | |
| CC1C2OC2C11CN1C,0.3087 | |
| c1(nc(on1)N)N,0.2447 | |
| CC1CCC1(C)OC=O,0.2775 | |
| CCC1(C)N2CC1(O)C2,0.3082 | |
| CN1CC1C12CC(C1)O2,0.3068 | |
| ON=C1CN2CC=CC12,0.2221 | |
| OC1CCC1OCC#C,0.2756 | |
| CC(=O)NC1=NCCN1,0.2032 | |
| C#CC1C2NC2C2OC12,0.2947 | |
| CC1C2CC=CCC12C,0.2677 | |
| CC1C(C2CC2O)N1C,0.2809 | |
| CC1N=COCC1(C)C,0.2722 | |
| NC(=O)C1COCCO1,0.2725 | |
| OCC1OC2C3NC3C12,0.292 | |
| CC1(C)OC(=O)C1O,0.2647 | |
| CCCC1=CC(=O)NC1,0.217 | |
| CC1(C)C2COC(=O)C12,0.2702 | |
| CC1(O)C2CC2OC1=O,0.2629 | |
| c1cnn(c1N)CC=O,0.1644 | |
| OC1CCC(O)C1,0.3287 | |
| COC(CC1CN1)=NC,0.2538 | |
| COC1CCOCC=C1,0.25 | |
| CC12OCC3C1OC23,0.3106 | |
| c1coc(n1)OCC#N,0.2366 | |
| OC1CC=C2CCCC12,0.2504 | |
| CC(=O)C(C#N)C#N,0.2264 | |
| OCCC12CC1C(=O)O2,0.2704 | |
| CC1=CC2(NC2C1)C=O,0.2103 | |
| CC(C)NC1COC1=O,0.2412 | |
| c1c(onn1)N=CN,0.1832 | |
| O=C1COCC2OCC12,0.2037 | |
| Cc1c(c(c(o1)N)O)N,0.2138 | |
| OC1C(=O)N2CC12C#N,0.2279 | |
| CC1=NC2CC2(O1)C#C,0.2508 | |
| CN1C(=O)CCOC1=O,0.2506 | |
| C1CN1CCCC=O,0.2193 | |
| CC(=O)N1CC(C1)O,0.2668 | |
| CC(C)C(=O)OCCO,0.2745 | |
| NC1=NC2CCC2O1,0.2761 | |
| CNCc1ncon1,0.2034 | |
| CCOC=NC1CCC1,0.2653 | |
| CNCC(OC=N)C#N,0.2404 | |
| OCC1OC(=N)C1CO,0.2775 | |
| CC(=O)CCC(=O)OC,0.2364 | |
| CC(C)(C)OC1CCC1,0.3135 | |
| CC1OC(=N)CC1=O,0.2167 | |
| N1C2C1C1C3C4C3N1C24,0.2929 | |
| CC1=CC2CC1(CO)C2,0.2376 | |
| N=C1OCC23CCC12N3,0.2463 | |
| CC(CO)(CC=O)C#N,0.2252 | |
| CCC12CC1CC2CO,0.3199 | |
| CC(C)n1cccc1O,0.2408 | |
| OC1CC2C=CCOC12,0.2555 | |
| CCC(C)C1=CNC=C1,0.2504 | |
| C1C2CCC3(CO3)C12,0.3326 | |
| COC1(C)CCC(=O)C1,0.2206 | |
| CC1C(C)C2(O)CN1C2,0.2903 | |
| CC1=NOC(N)=NC1=N,0.1981 | |
| CC1C2C1(C)CC2(C)O,0.3141 | |
| CC12CC3CC1OCC23,0.3228 | |
| OC12C3CC(C13)C2C=O,0.2089 | |
| COC1(CC(C)O)CC1,0.316 | |
| NC1=NON=C1C1CN1,0.2099 | |
| COC1CC2OCOC12,0.3004 | |
| OC1CC2C3C4CC13N24,0.3255 | |
| CCC(NC=O)C1CN1,0.2573 | |
| CC(O)C1OC1(C)C#C,0.2828 | |
| C1CC1(CC#N)CC#N,0.3333 | |
| C#CCCC1(CN1)C#N,0.2888 | |
| N=C1OC2C1C21CCO1,0.2552 | |
| N#CC12CCC1NC2,0.257 | |
| CC1CC2(C)CCC=C12,0.2443 | |
| CNc1ncoc(=O)n1,0.2117 | |
| OCC12CC1(O)CCO2,0.2722 | |
| CCCCCCC1CO1,0.352 | |
| CCOCC(C=O)C#C,0.2219 | |
| OCC1OC11CC2OC12,0.326 | |
| Cn1ccc2c1ocn2,0.2146 | |
| c1c(nc[nH]1)OCCO,0.2298 | |
| Cc1nc(c(o1)C=O)O,0.1856 | |
| CC1CC(O1)C#CC=O,0.2021 | |
| CCC(=O)C=O,0.1571 | |
| CC1OC(=N)OCC1=O,0.207 | |
| c1c(oc(n1)C=O)N,0.1613 | |
| CC1COCC11CN1,0.3158 | |
| NC1=C(O)NN=CC1=N,0.172 | |
| CC12CC1COC1CC21,0.3222 | |
| CC1=CCCCC=C1,0.1929 | |
| CC(C)n1ccc(c1)O,0.2318 | |
| C#CCN1CC1C#N,0.2665 | |
| CC1=NC(CC=O)CO1,0.2225 | |
| C1C23CC=CC12C1NC31,0.2087 | |
| CCC1(COCO1)C#C,0.2912 | |
| CC(C)(COC)NC=O,0.2784 | |
| CC1(CO)NC1(C)CO,0.2964 | |
| CC1C(CC1=O)C(N)=O,0.2256 | |
| CCC1N=COC1C#N,0.2678 | |
| Cc1c(oc(n1)OC)C,0.2388 | |
| CC1=C(N)C(=N)N=NO1,0.1438 | |
| OCCC1CCCC=C1,0.2644 | |
| CC1(C)CC1C#CC#N,0.2239 | |
| CC12CC(C1)C(O)CO2,0.3059 | |
| O=CC1=CC(CC1)C#N,0.1912 | |
| c1c(c(ncn1)O)CO,0.229 | |
| Cc1cc(c(n1C)O)O,0.2239 | |
| Cn1cncnc1=O,0.2025 | |
| O=C1CC2C3CC1OC23,0.2082 | |
| CC1CN2CC12C=O,0.2035 | |
| N=C1NC(NC=O)=NO1,0.1989 | |
| c1c2n(nn1)CCC2,0.2561 | |
| C1CC11C2CC1N1CC21,0.3222 | |
| CC1OC(C)C1C(N)=O,0.2535 | |
| CCCC1CC(O1)C=O,0.2124 | |
| O=C1C2CC1(N2)C#C,0.2407 | |
| CC1=NNC(=N)OC1=O,0.1735 | |
| Cc1cc(c[nH]1)N,0.2239 | |
| CCC(N)C(=O)NC=O,0.2096 | |
| O=CC1CC(CO1)C#N,0.2147 | |
| C1OC2CCC=CC12,0.2578 | |
| c1cnc(nc1C#N)N,0.1734 | |
| OCC1CC=CCC=C1,0.2531 | |
| COc1cnc(nn1)F,0.1704 | |
| CC12NC1CCCC2O,0.313 | |
| C1C2C3CC4(CCC34)N12,0.3012 | |
| OCC1=NNC(=N)N=C1,0.1456 | |
| O=CCC12CC3C(C1)N23,0.2217 | |
| CC1CC(C=C1)C#C,0.2613 | |
| CCNC(=O)C=O,0.1753 | |
| CC1(CO1)C1NC1C#C,0.2756 | |
| CNC(C)(C#N)C(C)O,0.2867 | |
| CC1(CC1C=O)C#N,0.2212 | |
| [O-]C(=O)C12C[NH2+]CC1N2,0.2525 | |
| CCC(CO)CC=O,0.2291 | |
| CCC1=CC(=O)NC1=N,0.188 | |
| CC1C2CC(C)C12C=O,0.2247 | |
| O=C1OC2(CC12)C1CO1,0.2716 | |
| CN1CCCN=C1C=O,0.1653 | |
| CCOc1c(cco1)O,0.2198 | |
| c1cnc([nH]1)CC2CC2,0.2497 | |
| NC12C3OC1C(=N)OC23,0.2367 | |
| CC(N)(C#N)C#CC#N,0.2238 | |
| c1cc2c(nc1)CCO2,0.1981 | |
| C(C=O)NC(=O)NC=O,0.222 | |
| CN1CC(=O)C2(C)CC12,0.2019 | |
| CC1(C)CC2C(C#C)N12,0.2566 | |
| CCCC12CC3C(O1)C23,0.3044 | |
| OCC1(CC=CC1)C#N,0.2666 | |
| CCOc1cnc[nH]1,0.2445 | |
| COc1c(ocn1)C#C,0.1846 | |
| O=C1CC2N3CC2(C3)C1,0.2027 | |
| CC1C2OC11C=CCC21,0.2295 | |
| CNC=[NH+]C1=NC=N[N-]1,0.134 | |
| O=C1NC2C1CC21CO1,0.2699 | |
| CC1C(C)C2C1NC2=O,0.2705 | |
| C1C=C2CC3C4OC13C24,0.1654 | |
| OC1CC2OC2C(=O)C1,0.2155 | |
| C#CC12CC1OC2,0.2644 | |
| COC1CC=CC1(C)C,0.2636 | |
| CC1C(N1C=[NH2+])C([O-])=O,0.2318 | |
| c1cnc([nH]c1=O)C=O,0.1551 | |
| C1CN2CC3OC3C2=N1,0.2236 | |
| NC(=O)C1OC2CC1C2,0.2656 | |
| C#CC#CC(=O)CO,0.1856 | |
| CC1CC(=O)N1C=O,0.2193 | |
| OC(C=O)C1=CCCC1,0.1998 | |
| COCc1conc1N,0.2324 | |
| C(COCC#CC=O)O,0.2053 | |
| CCC(C)C1=NNC=N1,0.2693 | |
| N#CC12CC3C(N1)C23,0.2545 | |
| CNC1C(C)C1(N)C#N,0.2638 | |
| OC1C2CC3(O)CC3C12,0.303 | |
| CC12CCC(O1)C1NC21,0.3066 | |
| CC(=O)OCC(=O)C#C,0.2065 | |
| CC1(C)CC2(CC12)C#C,0.2712 | |
| CC#CC12CN1CC=C2,0.2266 | |
| CN(CCNC=O)C=O,0.2582 | |
| COC(C)C(C)(O)C#C,0.2871 | |
| Cn1c(cnc1CO)O,0.226 | |
| CN1C2C3OC2C(=O)C13,0.1971 | |
| CC1(O)C2COCC1O2,0.307 | |
| CC1C(O)C2OC12C#C,0.2619 | |
| CNC1(CC2OC12)C#N,0.2567 | |
| CC1(C2CCC12)C(N)=O,0.275 | |
| C1NC1C1=NC=NO1,0.241 | |
| CC(=O)C1OC1C1CC1,0.2213 | |
| CCOC(=O)C1(C)CN1,0.2563 | |
| OC1C2C3CC2(C3)C1=O,0.2032 | |
| OCC1CC(=N)N1C=O,0.2278 | |
| CC1(CO)CC=CCO1,0.2677 | |
| CN1CC(=O)NC1=O,0.2472 | |
| OC1COC(=N)C=CC1,0.2128 | |
| O=CC1CN1CCC#C,0.212 | |
| CC12CN1C1C(O)C1C2,0.283 | |
| CC1(CC(C1)(C)CO)C,0.322 | |
| OC1C2CC1(O)C2C#C,0.2984 | |
| CC1(CCC1=O)C#N,0.216 | |
| OC1C2CC1N2C=O,0.2522 | |
| CC12CC3CC(O1)C2O3,0.3244 | |
| CC#CCC(C)CO,0.3006 | |
| OC1(CNC1C#C)C#N,0.2502 | |
| c1nc(on1)C(=O)C#N,0.187 | |
| CCc1c[nH]nc1C=O,0.1981 | |
| OC1CN2CC(=O)C12,0.2014 | |
| CC1(CC2CO2)CC1O,0.3324 | |
| CC1C2CC1COC2,0.3344 | |
| C1C2CCC=CCC12,0.26 | |
| COC12C3C4C1C4(O)C23,0.2932 | |
| CCn1cc(cn1)OC,0.2282 | |
| C1CC1(CC=O)C(=O)N,0.2234 | |
| O=C1CC2C3OC1OC23,0.2013 | |
| OC1=NC(=N)N=C(F)N1,0.2209 | |
| CCC1CC(CO)C1,0.338 | |
| O=C1C2OC1C1CC2O1,0.2474 | |
| CC1C=CC2=C1C=NN2,0.1899 | |
| CCC(C)(C)C1CC1O,0.3262 | |
| OCC1(O)COCC1=O,0.2107 | |
| CC1NC11CCOC1=O,0.263 | |
| CN1CC2CC2(O)C1=O,0.263 | |
| CC1=CC(CC1)OC=O,0.2541 | |
| Cc1ccccn1,0.2276 | |
| CC#CCC(=O)C,0.2282 | |
| ON=C1CC(=O)CC1O,0.2177 | |
| N#CC1C2CC3CC1C23,0.3059 | |
| CC1CC2(C)C(CO)C12,0.3157 | |
| CC1C=CC2(CN12)C#C,0.2283 | |
| COC1C(O)C1OC,0.2863 | |
| CN1CC2NC2C(=O)C1,0.2 | |
| CCCC1CC2OC2C1,0.3439 | |
| C1CC2CN=COC2O1,0.2724 | |
| CCC(CO)OCCO,0.3186 | |
| OC1(CCCNC1)C#N,0.2443 | |
| NC1=CNC(=O)OC1=N,0.1721 | |
| C(N1CC1)C12CN(C1)C2,0.3043 | |
| CC(=O)C1C2C3CC1N23,0.2171 | |
| OCC1=CC=NOC1=N,0.1695 | |
| O=CC1(CCC#N)CN1,0.2235 | |
| CC1CC2C3CC2(O)C13,0.3337 | |
| c1cc(c(nc1)C#N)O,0.1895 | |
| CC12NC1(C#N)C1NC21,0.2703 | |
| OCC1C=CCC1=NO,0.245 | |
| C1C2CC3OCCC1C23,0.3077 | |
| C1CC11OCCC2OC12,0.3307 | |
| C#CCC1(CC1)C#C,0.2881 | |
| CC12C3NC(C1=O)C23O,0.2263 | |
| CC1NC1C(O)CCO,0.3143 | |
| CC(O)C(OC=O)C=O,0.2191 | |
| CC1C(=O)N2CC12C=O,0.1974 | |
| C1OC2C1C21CC2OC12,0.2973 | |
| N=C1CCOCCO1,0.2768 | |
| N=C1OCC2CC3C1N23,0.2548 | |
| c1c(nc2n1CCN2)O,0.2258 | |
| CCc1ccc(=O)[nH]n1,0.1751 | |
| COC(C)=NC1CC1O,0.2453 | |
| CC1C2OCCC12C=O,0.2271 | |
| O=CC1(CN1)C1CN1,0.2037 | |
| O=CC1CC(=O)NC=C1,0.1866 | |
| N#CC1=CC2C3CN2C13,0.1756 | |
| CC1OC1C1OC1(C)C,0.3324 | |
| CN1CC(=O)C1CCO,0.2078 | |
| C#CC12C3CN1CCC23,0.2591 | |
| CCC1OC2CC3C2C13,0.3218 | |
| CC12CN1CC(=O)C2=O,0.1386 | |
| C1C=CNC(=O)NC1=O,0.2267 | |
| COC1(C)CC1(C)C=O,0.2224 | |
| Cn1cc(c(c1)N)C#N,0.1994 | |
| OC12CC1NC(=O)NC2,0.2868 | |
| C1CC1c2c(onn2)N,0.2079 | |
| OC12CN3CC(O)(C1)C23,0.2754 | |
| OC12CN3CC(=O)C1C23,0.2059 | |
| NC1C2(N)CNC12C#N,0.229 | |
| CC12CC1CCC2O,0.3265 | |
| c1ncnc(n1)CC=O,0.1985 | |
| O=CC1C(C#C)C1C#N,0.2185 | |
| COCCC1CC1(C)C,0.3371 | |
| COCC(=NO)C#C,0.209 | |
| OCC12CC1CC21CC1,0.3079 | |
| C(COC(=O)CC=O)O,0.2272 | |
| O=CC1CCNC(=O)N1,0.2018 | |
| CC([NH3+])C(C)(O)C([O-])=O,0.2752 | |
| O=C1NC(=O)C2CCC12,0.236 | |
| COC(C=O)C1CCO1,0.2117 | |
| CC1=C(OC=N)C=NO1,0.2256 | |
| CCC1(O)C2CC1OC2,0.3195 | |
| O=COC1CCNC1=O,0.2563 | |
| CC1C2OCC1(C)C2C,0.3123 | |
| O=CC1NC11CC2CC12,0.2181 | |
| C1C2N1CC21CC2NC12,0.3055 | |
| CC1OC(C)C(CO)=C1,0.2503 | |
| CC1CC2C(C#C)C12,0.2905 | |
| CC1C2C1C(=O)N2C,0.2483 | |
| C#CC12C3CCC1OC23,0.2625 | |
| OCCN1CC2OC2C1,0.3104 | |
| NC(=[NH2+])C1=CN=N[N-]1,0.1814 | |
| COC1CC2(CC2)CO1,0.3457 | |
| CC(=O)C1CC1,0.2339 | |
| c1nc(c(o1)C2CC2)O,0.206 | |
| c1c(nnnn1)C(=N)N,0.1504 | |
| CC1(OCCO1)CCO,0.3321 | |
| COC12CC1N(C)C2C,0.2759 | |
| OC12CC=CC1C2C=O,0.2092 | |
| CC12CC3C(C1)OC23C,0.3148 | |
| C1CC11CC2CC2C=C1,0.241 | |
| Cc1cn(c(=NC)o1)C,0.2117 | |
| CC1(CCC=C1)C#C,0.2611 | |
| CC1OC11C(C)OC1=N,0.271 | |
| OC1=CNN=CC1=N,0.1709 | |
| C1CC1CC(C=O)C=O,0.2016 | |
| OCC1COCC1C#N,0.2986 | |
| CC1CCC2(C)C(O)C12,0.307 | |
| CN1CCCC(=O)C=C1,0.1819 | |
| CC1CC(=NO)C2OC12,0.2441 | |
| CC1=NC(=N)N=CO1,0.2176 | |
| CC1C=C2CCC2C1O,0.2462 | |
| CC1(C#N)C2N1CC2=O,0.2149 | |
| CC1=CCCC1=O,0.198 | |
| C#CCC#CC#CC=O,0.1795 | |
| CC1NC1C1=COC=N1,0.2372 | |
| C[NH2+]CC1=NON=C1[O-],0.2252 | |
| C1C2CC1OCC=CC2,0.2292 | |
| CC1OC(=O)NC1=N,0.2672 | |
| OCC12CC1C(N2)C#N,0.2702 | |
| CC(O)(CC#C)C1CC1,0.3004 | |
| OC1(CC=CC1)C#C,0.2683 | |
| CC12CC1(OC2=O)C#N,0.2568 | |
| CC1C(C)C(C)=CC1=O,0.193 | |
| CC1CC2CC(=O)N12,0.2349 | |
| c1ccocccnc1,0.1866 | |
| C1C2C3C4CCC2C1C34,0.3324 | |
| c1c2c(c([nH]1)O)CCN2,0.228 | |
| C1CC2CCOCCC12,0.3204 | |
| CC(C#N)C1CC1CO,0.3033 | |
| CC(C)(C)C1CC2CC12,0.3208 | |
| NCC(N)(C#N)C(N)=O,0.2471 | |
| CC1OCCC1=NO,0.2487 | |
| N#CC1(CC2CO2)CO1,0.2727 | |
| OC12CC(C1)(C2)C1CO1,0.3387 | |
| CC1C2CC2(C)C2CN12,0.3172 | |
| C1C(CC1=O)C#N,0.2238 | |
| CC1C=C(C=O)C2OC12,0.1882 | |
| c1c(c(c(o1)C#N)N)N,0.1936 | |
| CC1CNC(=O)NC1=N,0.2563 | |
| CC(=NO)C1CC=CC1,0.2528 | |
| C1OC2C3CCCC12O3,0.2738 | |
| CC1CCCCOCC1,0.3223 | |
| CCCC(O)CC(N)=O,0.2714 | |
| C1COCC=C1C(=O)N,0.2183 | |
| COC1CC2OCC12C,0.313 | |
| O=CN1C2CN3CC3C12,0.2285 | |
| OC12C3CC1CCCC23,0.3128 | |
| CCn1cnc(n1)C#N,0.2396 | |
| CC1CC(NC=O)C1C,0.2778 | |
| C1CC23C1C1C2COC31,0.3095 | |
| C1CC23OCC(C=C2)C13,0.2455 | |
| [NH3+]CCC(C#N)C([O-])=O,0.2604 | |
| CC1CC11CCCOC1,0.3247 | |
| Cc1c(c[nH]c1C#N)N,0.1862 | |
| CCC(=O)C(C)CO,0.2306 | |
| CCN1CC1COC,0.2969 | |
| CC1C2N1CC=C2CO,0.234 | |
| O=C(C1CCO1)N1CC1,0.2322 | |
| CC12COC(O1)C(O)C2,0.3174 | |
| CC1C2CN2C1C=O,0.2108 | |
| C#CCn1cncn1,0.2713 | |
| OC1CC=CCCC=C1,0.2469 | |
| CCC1OC2C3CC2C13,0.3333 | |
| OC12C3CC1C3CC2=O,0.2256 | |
| COCC1C2C3OC1C23,0.3062 | |
| Cc1c[nH]c(c1C=O)C,0.1921 | |
| C1CN1c2c(nn[nH]2)O,0.2232 | |
| CC(=O)C(CO)C(=O)C,0.2162 | |
| CC1C2C1C(C#C)C2O,0.2877 | |
| CC(=O)C1(CO)CC1O,0.2196 | |
| Cc1cn(nn1)CC#N,0.2436 | |
| N=COC1CCCOC1,0.2722 | |
| CN1CC1C(F)(F)F,0.3309 | |
| CC12OCC1CC21CO1,0.2981 | |
| CC1OCC1C(N)=O,0.2612 | |
| CC(=NO)C(O)CC#C,0.2515 | |
| CC12OC1CCC21CN1,0.3125 | |
| CC(O)C(OC=O)C#N,0.2743 | |
| C1C2C1C1CC2C2CC12,0.3465 | |
| C1CN=C(C(=O)CN1)N,0.1642 | |
| CN1CC1COC(C)=O,0.244 | |
| O=C1CNC(CO1)C#N,0.2427 | |
| CC(C)C1(C)COC1=N,0.2922 | |
| CC1(CNC1C#C)C#N,0.2607 | |
| COC1C=CC(C)C1=O,0.215 | |
| CC1C2CN2CC1CO,0.2954 | |
| CC1OC(=O)C2OC12C,0.2494 | |
| CCC1CC2CC(C1)O2,0.31 | |
| C1CC2CCC1OC=N2,0.2682 | |
| CC(O)C1(C)CN1,0.2967 | |
| c1cc[nH]c(=O)c(=O)c1,0.1556 | |
| NC1=NCC(=O)C1C#N,0.2085 | |
| CCCN1CC=CC1=O,0.2092 | |
| C1C(CN1C=O)CCO,0.2664 | |
| [NH3+]C(CO)(C#C)C([O-])=O,0.2505 | |
| CCOC(C)C(O)C=O,0.2285 | |
| OCC#CC1C2CCC12,0.2692 | |
| COCC(C)N1CC1C,0.3014 | |
| CCCNC(C)(C)C#N,0.274 | |
| CC1N2C3CC2C1(C)C3,0.3068 | |
| CCC#CCCCO,0.3022 | |
| OCC1CC2C3CC2C13,0.3422 | |
| Cc1c(cno1)NC=O,0.2142 | |
| C1C2OC1C1NC21,0.3114 | |
| NC1=NC2CC2OCO1,0.261 | |
| N=C1CC2CCC(=O)N12,0.2383 | |
| CCC1CC11C2CC1O2,0.3146 | |
| C(C(C#N)(C#N)C#N)O,0.2904 | |
| c1c[nH]c(c1C#N)C#N,0.1947 | |
| CC12CC(C1)N2C(N)=O,0.2741 | |
| C1OC1C1=NCCO1,0.2465 | |
| CC(O)C1=CCOC1C,0.2408 | |
| CC(N)(C#N)C1CN1,0.2781 | |
| CC1C2CC=CCC1O2,0.265 | |
| CC1OC(=N)C1CC=O,0.2258 | |
| c1c(=O)c(con1)C=O,0.1674 | |
| C1OC11CC2OC1C=C2,0.2457 | |
| OC1(CCN2CC12)C=O,0.1981 | |
| COc1c([nH]nc1O)O,0.2523 | |
| CC1=CN=C(N)C(=N)O1,0.1614 | |
| CN1C2C=CC11COC21,0.2024 | |
| CCOc1c(c[nH]n1)N,0.2222 | |
| O=C1CCC2C(C#C)C12,0.222 | |
| CN(C(=O)CO)C(=N)N,0.2257 | |
| CC(C)(CCC=O)OC,0.2302 | |
| CC1C2=CCC3C2C13C,0.1783 | |
| CC1C2C3OC(=O)C2C13,0.267 | |
| CN=C1OCC11CC1C,0.2703 | |
| O=CC1C2C3C=CC2C13,0.2017 | |
| CC12CC1C(NC2)C#N,0.2739 | |
| CC1COCC2(CO2)C1,0.3224 | |
| CCC1CC2CCCC12,0.3486 | |
| CC1=CC2C3C4C3N2C14,0.2247 | |
| NCC1(C#N)C2CN1C2,0.2591 | |
| CCC1OCCC=C1,0.265 | |
| CC12C3C1C1C3C21C=O,0.21 | |
| COC1OCC2CCC12,0.3349 | |
| CC1OC1C(=O)C1CO1,0.2091 | |
| COc1cncc(=O)[nH]1,0.1669 | |
| CC1COCC2NC2C1,0.317 | |
| CCc1nc(c(o1)C)O,0.2131 | |
| c1c(ocn1)OCCO,0.2357 | |
| CC1C2(C)OC(=O)C12N,0.2438 | |
| CC1COC(=O)C(C)=C1,0.2218 | |
| CN1CC1(C)C(C)(C)O,0.2907 | |
| OC1CC(CC1=O)C#C,0.209 | |
| C#CCc1cc[nH]n1,0.2651 | |
| C1C=CC23NC12C1NC31,0.2487 | |
| NC(=O)C1CC2CC12O,0.2665 | |
| CC12OC1(C#C)C1OC21,0.2554 | |
| Cn1cccc1N(=O)=O,0.1718 | |
| C[NH2+]CC1=C([O-])OC=C1,0.226 | |
| COC1=NCC(C)(C)N1,0.277 | |
| c1c(c2c([nH]1)NCC2)N,0.221 | |
| C#CCC12CC3C1OC23,0.2849 | |
| FC1=CC(=N)C=CO1,0.1994 | |
| CC12CC(CC1)(O2)C#C,0.2714 | |
| CC(C)(C)OCC=O,0.2294 | |
| CCOC(C)CC=O,0.2232 | |
| OCC1N=CNC1=N,0.2243 | |
| CC1CC2C1C2(O)C#C,0.2733 | |
| OC1=CNC(=N1)C1CO1,0.2136 | |
| CC1(CCC1)C(=O)C=O,0.1525 | |
| C1C2CC3CC=CC13O2,0.2392 | |
| Cc1c(n2c(n1)CC2)O,0.2309 | |
| COC1CC1COC=O,0.2737 | |
| CC1(C)C2CC11CCC21,0.3095 | |
| CC1(O)C2C3C2N2C3C12,0.2846 | |
| CC12CC(CC1)C2(C)O,0.3205 | |
| N#CC12CCN1C=NC2,0.2422 | |
| O=CC12CC1(OC2)C#N,0.2102 | |
| c1cn(cn1)CC=O,0.1865 | |
| OC1C=CC2C3CN2C13,0.2254 | |
| CC1CC2C(O)C12,0.3161 | |
| CC12OC1CC1C(O)C21,0.3052 | |
| C1CC2(O1)C1C3NC3C21,0.2782 | |
| CC12CC3C1N3C2C=O,0.2135 | |
| O=C1C2C3C4C1C2N34,0.2215 | |
| O=CC1CCN(C1)C=O,0.2124 | |
| CC1OCC11OC1(C)C,0.3205 | |
| CC(O)C(=O)CO,0.2353 | |
| Cc1nc([nH]n1)COC,0.2671 | |
| c1c[nH]c(cc1=NO)F,0.1701 | |
| CCNC(=N)C(=O)C,0.1706 | |
| CC(C)C12CC1OC2,0.2997 | |
| CC1N2CC3OC1(C)C23,0.2796 | |
| CC(OC1(C)CC1)C#C,0.2852 | |
| CC1(CCC=CC1)C#C,0.2677 | |
| C1C2OC2C2=CN=CN12,0.2344 | |
| CC1(CC1)C(C)(C)CO,0.3361 | |
| O=CN1CC2(CO2)C1=O,0.209 | |
| OCC1COC(=N)C1O,0.2875 | |
| CCOc1c(cc[nH]1)N,0.224 | |
| CCC(CC)COC,0.3375 | |
| O=C1NC2C=CC(=O)C12,0.1841 | |
| OCC#CC(=O)OC=N,0.2223 | |
| Cc1ccc(=O)n(n1)C,0.1714 | |
| O=C1C2CC(=O)CC1N2,0.2067 | |
| CC1C(O)C1C1(C)CO1,0.3098 | |
| O=C1CC2(CN12)C1CO1,0.2381 | |
| OC12COC1C(C2)C#C,0.2763 | |
| CCOc1[nH]cc(n1)O,0.2398 | |
| CC1(CN1)C(O)C=O,0.2129 | |
| Cc1c2c(cno2)[nH]n1,0.2115 | |
| CC(C)C1(CO)CN1,0.3037 | |
| COC1C(O)C1N1CC1,0.2959 | |
| CCC(CO)(CO)CO,0.2972 | |
| CC1N=CN2C(C=O)C12,0.2021 | |
| CC12CC3(C)OC1(C)C23,0.3074 | |
| C1CC2OCCCOC12,0.307 | |
| COC1CC1OCC#N,0.257 | |
| COCC1CC1CC#C,0.307 | |
| COCC1CC(=O)N1C,0.2783 | |
| CCC1CC2CC1O2,0.3337 | |
| Cc1coc(=O)o1,0.2538 | |
| CC1OCCNCC1=O,0.2049 | |
| C1C2C3CCOC3CN12,0.2996 | |
| CC(C)C1(CC1)OC=O,0.2743 | |
| CC1CCC(C=O)=C1,0.1935 | |
| CC#CC(C)C(C)CO,0.3023 | |
| O=C1CC2C3CC2C1C3,0.2254 | |
| C1NC1C1=NCCO1,0.256 | |
| CC1C2C(O)C2N1C=O,0.2566 | |
| OC12CC1CCC2,0.3331 | |
| CC12C3OC1C3C21OC1,0.3206 | |
| C1CC1n2nc(nn2)O,0.2255 | |
| CC1(O)C(O)C(O)C1O,0.2731 | |
| CC12CC1C(C=O)C2O,0.2091 | |
| COC=NC1(C)CC1C,0.2419 | |
| CCOCC(=O)C1CN1,0.2151 | |
| CC1(C)C2C3OC2C13,0.2987 | |
| NC1(C#N)C2COC12,0.2682 | |
| CC1(C=O)C2CCN12,0.2186 | |
| CC1OCCCC(=N)O1,0.2804 | |
| O=C1OCC1CCC#N,0.2798 | |
| CC1CN(C=N)C(=O)O1,0.2479 | |
| CC1C=CC(C)N1C=O,0.2423 | |
| N=C1NC=CCCC1=O,0.1741 | |
| C1CC=C(COC1)C#N,0.2157 | |
| OC1CC=C2C3OC3C12,0.2389 | |
| Cc1c(oc(=NC)o1)C,0.2316 | |
| C#CC12CCCCC1O2,0.281 | |
| C1CC=CC2(CC2)C=C1,0.2393 | |
| CC#CCc1ncon1,0.2269 | |
| CC12CC1OCC2C=O,0.2061 | |
| CC12CN3CC1C23C#C,0.2481 | |
| CCN=C1OCC2NC12,0.2557 | |
| CCCC(C#N)C1CN1,0.2806 | |
| CC1(CN1)C(N)C#N,0.2867 | |
| CC12CC3C1N3C(=O)O2,0.2837 | |
| CC(C)C12CN1C(=O)C2,0.2375 | |
| N=C1NC=C(CC#N)O1,0.2183 | |
| O=C1CC2NC12C1CO1,0.2216 | |
| CC1(O)C=CCC1C#C,0.2632 | |
| CC1(C)CC2CN2C1,0.3032 | |
| OC1C2C3N2C2C1C32O,0.2916 | |
| CCCc1c[nH]nc1N,0.2348 | |
| CC1C(C)C1C,0.3412 | |
| CC(O)C(O)C(C)O,0.3058 | |
| C#Cc1cnncn1,0.1546 | |
| CCC1(C(=O)CN1)CC,0.2156 | |
| CN=C1OCC=C1C,0.211 | |
| C[NH2+]C(CO)CC([O-])=O,0.2783 | |
| CN(C)C(=O)NCCO,0.2884 | |
| CCC1C2C3N2C1C3=O,0.2324 | |
| CC1(COC(=O)CO1)C,0.2607 | |
| C#CC1NCC(=C1)C#N,0.204 | |
| OC1COC(=O)C=CC1,0.2225 | |
| O=CC1(C#C)C2CC1C2,0.2149 | |
| COC1(CC1C=O)C#C,0.2186 | |
| CC1(O)CC(C)(C1)C=O,0.2274 | |
| CC12OC(C=C1)C2O,0.2383 | |
| CC12CC(O1)(C#N)C2O,0.2665 | |
| c1c(onc1O)C#N,0.209 | |
| C#Cc1ncnn1C=O,0.193 | |
| CCC1=CCOC(=O)N1,0.2266 | |
| CC1(CO)CC11CCC1,0.324 | |
| CC1(CCC1)CCOC,0.3277 | |
| OCCC12CC1N1CC21,0.286 | |
| CC12COC3C4C3N1C24,0.2744 | |
| CC12C3C4C(O)C1C4N23,0.2936 | |
| CC(O)C(C)(CO)C=O,0.217 | |
| CC1C(O)C23CN(C2)C13,0.2577 | |
| OCC1OC1(CO)C#N,0.2856 | |
| O=C(C#C)C1C2CCN12,0.1762 | |
| C1CCOCOC(=O)C1,0.2722 | |
| COC1CC2CCCC12,0.3168 | |
| CC(=O)C1OC1(C)CO,0.2214 | |
| COCC1=NC2CC2N1,0.2377 | |
| NC12CNC1C2C#N,0.2671 | |
| c1ccccc1,0.2503 | |
| CC(C#N)C(O)CC=O,0.2292 | |
| Cc1cc(cc(n1)F)O,0.2364 | |
| CN1CC2(N)C(C#N)C12,0.245 | |
| CC(C)C#CCC=O,0.2188 | |
| CC12CC(O1)C1OC1C2,0.3203 | |
| CCCC1(COC1)OC,0.3213 | |
| COC1(CCC=C1)C#C,0.2507 | |
| NC=[NH+]CC(=O)[CH-]C=O,0.1945 | |
| CN1C2C3OC2C13C=O,0.1915 | |
| O=C1CN2CCC=CC12,0.1987 | |
| C#CCC12CC1COC2,0.3006 | |
| NC1=CN2C3CC3C2=N1,0.1913 | |
| CCC(O)(CO)C#N,0.3112 | |
| OC1CCC(CC#N)C1,0.3191 | |
| CCc1nc(=O)[nH]nn1,0.1628 | |
| CC1(CCC=C1)OC=O,0.2538 | |
| CN(C)C(=O)C#CC#N,0.1854 | |
| CC1=CC(=O)CC1=O,0.1591 | |
| OC1=NOC(=N1)C1CO1,0.2287 | |
| CC1OCC(C)(O)CO1,0.3258 | |
| CC1CN2C1=CN=C2O,0.2505 | |
| C1N=C2NC3C4NC13C24,0.1592 | |
| CC1OC(C)(C)CC=C1,0.2647 | |
| CN1CC11C2CC1(O)C2,0.3068 | |
| CC1OC2C1C=CC2C,0.2588 | |
| CC(NC(N)=O)C1CC1,0.3011 | |
| NC1(COC1=O)C1CO1,0.253 | |
| N=C1OCC=CC11CC1,0.248 | |
| CC1=CC(O)C(=O)OC1,0.2489 | |
| CC12NC(=O)C1C2C#C,0.2426 | |
| CC1(O)C2OC(=N)C12C,0.2657 | |
| OC1C(O)C11CC(=O)C1,0.2193 | |
| COCC1CC1COC,0.3339 | |
| CCC(C)(C=O)C=O,0.2125 | |
| C1C(N1)(CC#N)CC#N,0.285 | |
| CCn1c(ccn1)C=O,0.1972 | |
| OCC1C2C1C(=O)C2O,0.2209 | |
| CC12C3CC(C13)C21CC1,0.3261 | |
| CN(C1CC1)C(=O)C=O,0.1671 | |
| CCC1CC(CO)CO1,0.3234 | |
| CC(C=O)C1CC1(C)C,0.224 | |
| O=CN1C2COCC12,0.2574 | |
| C1CC2C3CC1C2CO3,0.3153 | |
| COC1C2C3C2C(=O)C13,0.2434 | |
| Cc1cn(c(c1C)N)C,0.2387 | |
| CC1(CCC#C)CO1,0.3137 | |
| C#CC1(CC2CC2)CN1,0.2752 | |
| N=C1OCC11CN2CC12,0.2563 | |
| N=COCC1CC1C#N,0.2837 | |
| CC(O)CC1(C)CCC1,0.3206 | |
| COCC#N,0.2939 | |
| C1C2C3OC1C1NC1C23,0.295 | |
| CC(O)C1(O)C2CCC12,0.3014 | |
| C1CC11OCC2OC12,0.3229 | |
| OC1CC2NC12CC=O,0.213 | |
| CC1C(CC#N)C2CN12,0.2768 | |
| C1CC1CCOC(=O)N,0.3234 | |
| C1C2OCC3NC13C=C2,0.2166 | |
| C#CC12COC(CO1)C2,0.2755 | |
| CN=C1NN=CC(C)=N1,0.1512 | |
| CN1N=NC(N)=NC1=N,0.1656 | |
| N#CC1CC(C1)C1CC1,0.3159 | |
| OCC1C2NC2C11CO1,0.3022 | |
| CC#CCN=C(CO)N,0.2557 | |
| CC12OC1C(=O)CC2O,0.2132 | |
| c1c(coc1N)NC=O,0.1944 | |
| CC1C2C3C4COC13C24,0.3141 | |
| CC(=O)C1CN1CCO,0.205 | |
| COC1=C(N=NO1)C#N,0.1669 | |
| CC(O)C1C(C)OC1=N,0.2869 | |
| OCC1OCCNC1=O,0.263 | |
| OCC1CC2OC2C1O,0.3076 | |
| O=CNC12CC1CCC2,0.2741 | |
| OCC1C=CCN2CC12,0.2449 | |
| c1c(c(c([nH]1)O)N)C=O,0.1658 | |
| CCC12C3C4C(N14)C23C,0.2791 | |
| N=C1CCCCN1C=O,0.2264 | |
| c1cnc2n(c1=O)CC2,0.2018 | |
| c1coc(=O)n1C2CC2,0.2337 | |
| OC1(C#N)C2CC=CC12,0.2304 | |
| CC1CC=C2CC=CC12,0.2475 | |
| O=C1NCC(O1)C1CN1,0.2994 | |
| OC1CC2CC=CC2C1,0.2638 | |
| CC(CC#C)C(=O)C#C,0.1986 | |
| O=C1CNC23CN(C2)C13,0.1857 | |
| C#CCCC12CCC1O2,0.3051 | |
| COC1(C)CC1CO,0.3248 | |
| CC1C2C3NC(=O)C2C13,0.2526 | |
| OC1CC2CCC=C2C1,0.2493 | |
| CC1C(C#CC#N)N1C,0.1968 | |
| CC1=C(OC(=N)O1)C=O,0.1705 | |
| CC1C=CCC=CC=C1,0.2258 | |
| CC1OC1C1(CO1)C=O,0.2036 | |
| O=CN1CC11CC=CC1,0.2489 | |
| OC1C2NC1C(=C2)C#C,0.1872 | |
| CC1CC2C(O)C(C)C12,0.3082 | |
| C1OC1C1C2CC1C=C2,0.2403 | |
| C#CC12CC3CN(C1)C23,0.2453 | |
| CCNC(=[NH2+])CC([O-])=O,0.232 | |
| OC1CC2(O)CCC2=C1,0.247 | |
| CCC#CC(NC)C=O,0.2072 | |
| N=C1NN=CC(=O)N1,0.1834 | |
| O=C1OC2CN3CC2C13,0.241 | |
| NC(=O)C1C2N1CC2=O,0.221 | |
| OCC1CC(O1)C#N,0.2665 | |
| OCC1C2C3OCC3N12,0.2747 | |
| C#CC1=CCOCC1=O,0.1752 | |
| Cn1nnc(=O)nn1,0.1496 | |
| CC(CCCO)CC=O,0.2281 | |
| CN1C2COC3(CC3)C12,0.3024 | |
| c1coc(n1)CCC=O,0.2207 | |
| COCC1C2CC3C2N13,0.3109 | |
| CC(C=O)C1(C)NC1C,0.221 | |
| CCN1C2CC3OC3C12,0.2804 | |
| c1c(oc(=O)o1)CO,0.2523 | |
| C1C2OC3C4C2N4CC13,0.308 | |
| Cc1c[nH]cc1N,0.2329 | |
| OCC1C2C3OC3C12,0.2837 | |
| CC1NC2(CC2O)C1=O,0.2107 | |
| CC(C)(CO)C(=O)NC,0.2773 | |
| CCCN(C=O)C(=N)C,0.2344 | |
| CC12CC3C4CC3C1C24,0.3501 | |
| CC1C(O)C11CCCC1,0.3181 | |
| CC1(CC1)C2(CC2)OC,0.3109 | |
| N=C1NC2C(OC12)C=O,0.2032 | |
| C#CC#CC1COC=N1,0.2254 | |
| O=C1OCC2OCC1O2,0.2604 | |
| CCCCc1ccn[nH]1,0.2571 | |
| CC1=CC2CC1(O)C2,0.2378 | |
| CCC1(O)C2NC2C1C,0.3018 | |
| Cc1c([nH]nc1O)C#C,0.2043 | |
| CCCN1CC1CC=O,0.2072 | |
| CC(=O)C1=CNCC1,0.1771 | |
| CCOc1c(nc[nH]1)N,0.2163 | |
| OC1C2C(C#N)C2C1O,0.2857 | |
| N#CC1CCC11CN1,0.2758 | |
| CCC1C2NC2(C)C1=O,0.2149 | |
| CC12CCC11CC(C1)C2,0.3397 | |
| CC(CC(C)=NO)C#C,0.2516 | |
| C#CC12NC1CN1CC21,0.2522 | |
| c1cncc2c1COC2,0.222 | |
| CC12CC1C1OC1CC2,0.327 | |
| CC(=O)COC(=O)C#N,0.1991 | |
| O=CC1CCC2CC1C2,0.2224 | |
| CC1CC1C1COC1=O,0.2742 | |
| CC(C#C)C1OC1C,0.3072 | |
| OC1C2CC(C#C)C12,0.2904 | |
| O=CC1CC2CC12C#C,0.2069 | |
| OCC1C2C3C4C3C2C14,0.3068 | |
| COC=NCCC(=O)N,0.2618 | |
| CC1(CC=CC1=O)C=O,0.1862 | |
| C1C=CCc2c1[nH]nn2,0.2407 | |
| OCC(C#C)C1CO1,0.3051 | |
| CC1C2C3N2C=NC13C,0.2357 | |
| OC12CC1C1CN1CC2,0.2882 | |
| CC1C2(O)COC12C#C,0.2367 | |
| C(CO)NC=O,0.2828 | |
| NC1=NCC2OC1C2O,0.2408 | |
| CC1CC(=O)OC1C,0.2785 | |
| CCC1OC2(CC)CC12,0.3107 | |
| CCC(C#C)N1CC1,0.2829 | |
| O=C1OCC2C(C#C)N12,0.2577 | |
| CC1COC=NC2CC12,0.2515 | |
| CC1(CCC1C#N)C#C,0.2839 | |
| COCC(C#N)C(C)=O,0.2285 | |
| CC1=CON=C(F)C1=N,0.184 | |
| CCC1NC1C1(C)CN1,0.2992 | |
| O=C1CCOCC11CN1,0.2258 | |
| Cc1c(nc[nH]1)OC,0.22 | |
| CC12CC1COC2C#C,0.2927 | |
| CCC1C(C)CCC1C,0.3585 | |
| OC1C2C3C=CC1(O)C23,0.2367 | |
| COC12CC3OC1(C)C23,0.2901 | |
| OC12C3OC1C1CC3C21,0.2902 | |
| CC1OC(C)(C#N)C1=O,0.2176 | |
| Cc1c(nc([nH]1)N)C#N,0.207 | |
| CC12CN1CC(C)(O)C2,0.2827 | |
| CCC1(O)C2CCC1O2,0.3268 | |
| CCCC1(O)CNC1=O,0.264 | |
| O=C(CCC#N)C1CO1,0.2246 | |
| CC1NC1C1OC1CO,0.3147 | |
| CC1C2CC3CC1(O)C23,0.3164 | |
| CCC1=NC(=N)NN=C1,0.1579 | |
| OC1C2CC1(O)CC2O,0.3162 | |
| O=CC1OC11CCOC1,0.2158 | |
| O=CCN1CCC1C=O,0.1988 | |
| Cn1c(cnc1C#C)N,0.1886 | |
| CCC(C)(OC)C#C,0.2963 | |
| Cc1ncc(c(n1)O)F,0.2195 | |
| O=CNC1CCC1C=O,0.2194 | |
| CC(C1C[NH2+]C1)C([O-])=O,0.271 | |
| ON=C1CC2NC12C#N,0.2352 | |
| CC(O)C(=O)NC(C)=O,0.2245 | |
| CC(C)(C)OCCOC,0.3233 | |
| C#CCc1nc[nH]n1,0.263 | |
| NC(=O)C1C(O)C2CN12,0.2421 | |
| CC1COC2CC1CO2,0.3252 | |
| CC(C)(C#C)C1CO1,0.3098 | |
| C1CC11CC2CCC2C1,0.3448 | |
| CCC1C2CNC(=O)C12,0.2687 | |
| CC1C(O)C11CCO1,0.281 | |
| OC1CC1C(F)(F)F,0.3287 | |
| CC1NC(C)(C#N)C1C,0.2712 | |
| C#CCC(=O)NC=N,0.2376 | |
| CC1(CC(O)C1=O)C=O,0.1898 | |
| O=C1NCC11CNC=N1,0.2366 | |
| Cc1nc(co1)N(C)C,0.205 | |
| c1nc(c(c(n1)F)N)F,0.2077 | |
| CC12CC(O)C1(N2)C#C,0.2715 | |
| CC1N=CN2CC12C#C,0.2397 | |
| Cc1ncnn1CCO,0.2609 | |
| C1C23OC=NC12C1OC31,0.2144 | |
| CC1CC(=O)C(C)O1,0.2192 | |
| O=CN1CC1C1CCC1,0.2563 | |
| C1C2OC11C3OC3CC21,0.2971 | |
| CC1C=CC=CC=C1,0.1774 | |
| ON=C1C2CC1N1CC21,0.2414 | |
| C[NH+]1CC=C(C1)C([O-])=O,0.1563 | |
| NC(=N)C(=O)CC1CN1,0.1794 | |
| CC1CC2C3C=CC1C23,0.2375 | |
| COCCCCOC=O,0.2695 | |
| CC1=CCC(=O)C=CC1,0.177 | |
| N#CCOC1CC1C#N,0.2842 | |
| c1cc(=O)onc1C#N,0.1745 | |
| CC(O)C1CCC(=O)N1,0.2702 | |
| CC1NC1C1OC1C#N,0.2614 | |
| CC1OC2C(CO)C12O,0.3018 | |
| CC12C=CC3CC1C23O,0.2407 | |
| COC1CC2CC2C1O,0.3132 | |
| CC1(CC1O)NC(N)=O,0.2952 | |
| CN1CC(C1)(C=O)C=O,0.1952 | |
| c1c(cncc1F)CO,0.2191 | |
| N=C1OC2CC3COC123,0.2616 | |
| C#CC1(CC1)C2(CC2)O,0.2818 | |
| CC(C#C)C1(CO1)C#C,0.2812 | |
| CC1(CCC2OC2)CC1,0.3476 | |
| CCC1(CC1)CCC=O,0.2286 | |
| CCC1C2CC1C(C)C2,0.3692 | |
| OC1C2C3NC(=O)C1C23,0.2534 | |
| Cc1cc(=O)oc(n1)N,0.1918 | |
| NC1CNC1C#N,0.2607 | |
| CNc1nc(no1)C=O,0.1769 | |
| CN(C=O)C1CC1(C)C,0.2629 | |
| O=C1C=CC2N=CNC12,0.168 | |
| CC1=NC(O)=CNC1=N,0.1397 | |
| OCC1CC2NC2C=C1,0.2497 | |
| C(#N)c1c(onc1O)N,0.2262 | |
| CC1NC1C(O)C#N,0.2769 | |
| CC(C)C#CC1CN1C,0.2601 | |
| CC1CCCN1CC#N,0.2626 | |
| CC(O)CC1C2CCC12,0.3083 | |
| CC1(C)OCC1C(N)=O,0.2593 | |
| CN=C1NC(C)=NC1C,0.224 | |
| CC12CC3(CCC3C1)O2,0.3192 | |
| O=CN1CCCC1C#N,0.2685 | |
| OC12CC1C(=N)NC2=O,0.2347 | |
| CCC1=CCC(C1)C=O,0.2207 | |
| C1C(=O)C(=O)COC=N1,0.1525 | |
| CN=COCC1CO1,0.2735 | |
| COC12COCC1C2O,0.296 | |
| O=C1OCC2=C1N=NO2,0.1771 | |
| CCC1C=CCC1=O,0.2225 | |
| OCC1CC2OC(=O)C12,0.2776 | |
| CC1OC=NC1C#N,0.27 | |
| OCC1(C#C)C2CN1C2,0.2539 | |
| CC(C)C(C#C)C(N)=O,0.2708 | |
| CC1CC(=O)C1OC=N,0.2042 | |
| N=C1COC(=O)CCO1,0.2664 | |
| CCN1CC1(C)CCO,0.3001 | |
| CC(=O)C1OC1C#C,0.2183 | |
| CC1CC(C=O)C=C1,0.2164 | |
| CC(C=O)N1C=CC=C1,0.1761 | |
| CC(CC1(C)CO1)C#C,0.3085 | |
| CC(O)CC(=NO)C#C,0.2064 | |
| CC1=CC2CC1C=C2,0.2157 | |
| OCC1=NC=NOC1=N,0.1713 | |
| CC12NC1C1(NC21)C#N,0.2274 | |
| CC1C2OC(=O)NC12C,0.2971 | |
| C1NC11C2CC1OCO2,0.3175 | |
| OC(C#N)C1CCC=C1,0.2551 | |
| c1cnn(c1)C=O,0.2191 | |
| OCC12C3C4C3C1C24,0.2807 | |
| COC1(CCC1)C2CC2,0.325 | |
| CCC1CCC(=O)CC1,0.2234 | |
| OC1CC(=O)C11CC1,0.2172 | |
| CC1=CC(O)C(O)C1O,0.2549 | |
| CNC(=O)C(C)(O)CO,0.2738 | |
| N#CC1CNC2CC2O1,0.241 | |
| ON=C1COC(C1)C#C,0.247 | |
| CCCC(O)CCOC,0.3187 | |
| OCC1C2C=CC3C2N13,0.2254 | |
| COCC1CC(=O)CO1,0.2206 | |
| OC1C2OCC12C1CN1,0.2931 | |
| CC1=NON=C1C1CO1,0.2428 | |
| O=CC12NCC1OC2=O,0.1907 | |
| CN1CC1(C#C)C(N)=O,0.2495 | |
| CC1CC2(C1)C(O)C2O,0.2793 | |
| OCC12CC(O)(C1)C2,0.3286 | |
| c1c(nc(o1)C(=N)N)O,0.1854 | |
| COC1(CC1)C2COC2,0.3115 | |
| C1C2OC3C4OC(C14)C23,0.3033 | |
| OC1C2C3C=CC2C13O,0.2255 | |
| CC12CC(C)(C1)C(=N)O2,0.2871 | |
| CC12C3C=CN1C(=O)C23,0.2005 | |
| CC(C)N(CC=O)C=O,0.212 | |
| CC1CC2CC12,0.3435 | |
| CC1COC=NC1(C)C,0.2729 | |
| OC1(CCC1C#C)C#C,0.2721 | |
| CC1CC(C)(C=O)C1=O,0.1939 | |
| COC12CN(C1)C2(C)C,0.3178 | |
| C(=O)C(=N)NC(=O)N,0.1937 | |
| OCCC1OC11CCC1,0.3318 | |
| CC1(CO)OCCC=C1,0.2597 | |
| CC1NC11C2OC2C1O,0.3128 | |
| CCC1(CC1(C)O)OC,0.2906 | |
| CC1C2C3CC1(C)CC23,0.3402 | |
| C1CC2C1N1N=CN=C21,0.2634 | |
| CC12NC1C1CC2C1O,0.2974 | |
| CCC12OCOC1C2O,0.3061 | |
| CC1C2C3C2C(C)(C)C13,0.3329 | |
| COC12CC1C=CC2O,0.2333 | |
| CCC(C=O)C(=O)OC,0.2272 | |
| CN1C=NC2CC1C2=O,0.1909 | |
| CC1(C)C2CCC12O,0.3017 | |
| N#CC12CC(C1)C2,0.3361 | |
| CC1C(=O)COC11CC1,0.2155 | |
| OC1C2C1C1=NC=CN21,0.2266 | |
| CC12CC3CC1(CO)C23,0.3106 | |
| C1CC1C(=O)CC=O,0.2102 | |
| CC12CCC1COC2=N,0.2813 | |
| CC(C#N)C(C)(O)C=O,0.2251 | |
| c1cc(c(=O)[nH]c1)N,0.1692 | |
| O=CC1NC2C3OC1C23,0.2058 | |
| CNC(C#N)C(C)(C)O,0.275 | |
| CC#CCC1CC1,0.3022 | |
| CCC12C3CN1C(=O)C23,0.2448 | |
| C1CC23C4OC2C4C3O1,0.3058 | |
| CCC12CCC(O1)C2=O,0.2317 | |
| CN=CN(CC#N)C=N,0.2217 | |
| CCC1=CC(O)C2OC12,0.2374 | |
| N#CCCCC1CO1,0.3101 | |
| COCC(C=O)C1CO1,0.2273 | |
| CC(C)CC1NCC1=O,0.2186 | |
| C#Cc1cc[nH]c(=O)n1,0.1656 | |
| CC(CC#C)C(F)(F)F,0.3167 | |
| N#CC1C2C3CC1OC23,0.284 | |
| N=C1N2C3CC(C23)C1=O,0.1746 | |
| CCC(=O)c1cnoc1,0.2061 | |
| CC1=C(NN=N1)OC=N,0.2114 | |
| CC1(C#C)C2CC1OC2,0.2788 | |
| N#CC12CN3C(CN1)C23,0.2517 | |
| OC12CNC1=CC(=O)C2,0.2026 | |
| COC1(C#C)C2COC12,0.2531 | |
| CCC(O)C(C)C#C,0.3073 | |
| O=C1OCC2(NC12)C#C,0.2368 | |
| NC(=O)N1C2CC1C2O,0.2621 | |
| CC1=NCCC(O1)C#C,0.2656 | |
| c1c(=O)nc(oc1F)N,0.2221 | |
| CC1(C)CC(O)C1(C)O,0.2987 | |
| CC1C2N3CC3C12O,0.2843 | |
| OC1CC2OCC2C1=O,0.2191 | |
| C(C#CC(=O)C#N)C#N,0.1943 | |
| Cc1cccc(c1O)F,0.222 | |
| N#CC1CC1(C#N)C#N,0.2741 | |
| O=C1C=CC2CC3C2C13,0.1794 | |
| CCC1(CCC1)OC,0.322 | |
| C1C2C3C1C1C=C3CC21,0.1208 | |
| OC12C=CCC1C2C#N,0.2467 | |
| C1CN1C(=O)CCCO,0.2535 | |
| CC(=O)OC1COC1,0.2608 | |
| CN1C2C3NC(=O)C1C23,0.2256 | |
| CC(=O)N(C)C(=O)C=O,0.1568 | |
| Cc1ccn(c1C)C=O,0.183 | |
| C1c2c(nn[nH]2)C(=N1)N,0.2188 | |
| CC1=CCC=CCOC1,0.2386 | |
| C1CC23CC4CC12CN34,0.2823 | |
| OC1C(=O)CC=C1C#N,0.2038 | |
| N=C1CN2C3CC2C3O1,0.251 | |
| c1c(con1)NC(=O)N,0.2181 | |
| CC1(CN1C1CC1)C#C,0.2756 | |
| CC12CC3OC1(C)C23C,0.2946 | |
| CC#CC1CC11COC1,0.2771 | |
| ON=C1CC2(CN2)C1O,0.2366 | |
| CC1(CCC1)C2CC2,0.3438 | |
| c1cnc(nc1O)C=O,0.1789 | |
| CC1(CO)CC(=O)C1O,0.2239 | |
| CC1=CCCCCOC1,0.2524 | |
| CC1CC1(C)OC(N)=O,0.3133 | |
| OCC1CC(O)C11CC1,0.3247 | |
| CC1=NCCO1,0.2718 | |
| O=CC#CC1OC1C#N,0.1961 | |
| C1CN(C=N1)C(=O)CO,0.2213 | |
| C1C2NC22C=CC3C2N13,0.2047 | |
| CC12CCC1(C)C1OC21,0.3389 | |
| CCC1(COC)CN1C,0.3031 | |
| Cc1c(nccn1)CO,0.1982 | |
| O=C1OCC2CNC2=C1,0.2097 | |
| CN=COCC(O)C#C,0.2619 | |
| O=CC12CC3C1CN23,0.2048 | |
| N#CCC12OC1C1CC21,0.2702 | |
| C1OC1C12OC1C1CC21,0.2828 | |
| COC12CCC1C(C)C2,0.3179 | |
| OCC12C3CC1COC23,0.2972 | |
| CCC(=O)C(=NC)NC,0.1802 | |
| NC(=O)C1(O)CNC1=N,0.2565 | |
| CNC(=O)C1CC1C#C,0.2512 | |
| CCOCC(C#C)C#N,0.276 | |
| CCc1cc(c[nH]1)NC,0.2209 | |
| CC1COC1(C)C#N,0.2838 | |
| OC1CCC2OCCC12,0.3015 | |
| NC(=O)C1=COC(=N)O1,0.195 | |
| CC12CC(C1)C2(C)CO,0.3265 | |
| CCC1C(CO)C1(C)O,0.3034 | |
| N#CC1OCC1N1CC1,0.2579 | |
| CC(C)N=C1OCC1O,0.2635 | |
| O=C1CC(CC#C)N1,0.2836 | |
| COC12C3OC1CC23C,0.3002 | |
| CC(=O)CC1(CO)CO1,0.2227 | |
| CC1C2OC2C2(O)CC12,0.3272 | |
| CC1C=C(C)C2COC12,0.256 | |
| C#CC12CC1OCOC2,0.2863 | |
| CC(=O)C#CC1(C)CO1,0.2053 | |
| NC12CCC1(OC2)C#N,0.2492 | |
| CC1OCC11CCCC1,0.3095 | |
| N=C1COC(O1)C1CC1,0.2879 | |
| CCCC(O)C#N,0.3136 | |
| ON=C1CC2CC3C1N23,0.2314 | |
| C1CC1CCC#N,0.3316 | |
| CN1CC2OC(C=O)C12,0.1956 | |
| C#CCCNC(=O)N,0.2999 | |
| CC#CC(CCO)C#N,0.2865 | |
| COC1COCC=CC1,0.2605 | |
| CCC(C)C1CCOC1,0.3224 | |
| CC1NC1C(C=O)C=O,0.2066 | |
| Cc1ccc(o1)NC,0.214 | |
| CC1(O)C2COC(=N)C12,0.2732 | |
| Cc1cc2cc[nH]c2o1,0.2179 | |
| N#CC1C2CC2C2CC12,0.3045 | |
| c1c(nc(c(=O)o1)F)N,0.1428 | |
| CCC1=CCC2(C)CC12,0.2449 | |
| O=C1CCCC2CCN12,0.2635 | |
| CC#CC(C)C#CC#C,0.2283 | |
| CC1C2C3CC(C3)N12,0.3069 | |
| O=C1OCOC2CCC12,0.2717 | |
| OC12CN(C1)C2CC#N,0.2946 | |
| CN1C2CCC(C2)C1=O,0.2636 | |
| CCC1CCC(=C1)C#N,0.2188 | |
| c1cnccc1C=O,0.1823 | |
| c1c(cn[nH]1)C(=O)N,0.237 | |
| CC1CN(C=O)C11CC1,0.2526 | |
| C1CCC(C1)CCC=O,0.229 | |
| CC1CC2(CN12)C#C,0.2536 | |
| CC1=CCOC(=O)N1,0.2283 | |
| c1c(oc(n1)N)C=O,0.1787 | |
| CC1CN1C1=CON=C1,0.2077 | |
| O=C1OC2CC(=O)OC12,0.2621 | |
| Cc1c(con1)CO,0.2491 | |
| CC1OC1C1(C)CC1C,0.3389 | |
| N#CC1CCOCO1,0.2959 | |
| CC1OC2=NC(C)CC12,0.2666 | |
| OC(C#C)C1C2CCN12,0.2576 | |
| CCNc1noc(=O)o1,0.268 | |
| C1C2N1CC1N3CC21C3,0.2939 | |
| CNC(=O)C1OCC1O,0.2614 | |
| C1C2N1CC21CCC1,0.3035 | |
| CCOC(C)(CC)C#C,0.2965 | |
| CC(OC(C)=O)C#N,0.2844 | |
| O=CC12NC3C1C=CC23,0.1853 | |
| NC1=CC(=N)ON=C1O,0.1628 | |
| C(=O)C(=O)C(=O)C#N,0.1169 | |
| c1cc(=O)onc1,0.1811 | |
| Cc1c[nH]c(c1O)C#N,0.2033 | |
| CCOCCOC(C)=N,0.2875 | |
| CC(C)CC1CC1(C)C,0.3367 | |
| C1C2C3OC4CN2C1C34,0.3016 | |
| C#CC1(CCC1)C#N,0.2902 | |
| C1CN=COCCC#C1,0.2554 | |
| C(=O)N(C(=N)N)C(=N)N,0.2181 | |
| C#CCC1NC1C1CN1,0.2927 | |
| C1N2C3CC4C=CC13C24,0.2252 | |
| OC1CC(NC=O)C=C1,0.2364 | |
| C1NC11C=CCC2CC12,0.247 | |
| CC(C)C1CC(O)CO1,0.3157 | |
| C1C(=O)N(C=N1)CC=O,0.2062 | |
| NC(=O)C1CC11CCC1,0.2729 | |
| CC1CC2C1C1OC21C,0.3204 | |
| CCCC(C)CC(C)=O,0.2335 | |
| N=C1OC2CC2CC=C1,0.2129 | |
| CC(C)C#CC(=O)C#C,0.1875 | |
| N#CC12C3CC1CN23,0.2652 | |
| CN=C1OC=C(F)N=C1,0.1477 | |
| CC1(CO)CNC(=O)C1,0.2741 | |
| OC1CC23CC(C12)C3=O,0.2517 | |
| CCc1ncnn1C=O,0.2183 | |
| CN1C2CC1C2(C)C#C,0.2463 | |
| NC(=O)C1C2C3CC2C13,0.2648 | |
| CC1C2C=CCC12C=O,0.2231 | |
| N=C1NN=CC=C1C#N,0.1399 | |
| C1COCCC1NC=O,0.2808 | |
| C#CC#CCNC=O,0.2217 | |
| CC1C2C(O)C2C2CN12,0.2722 | |
| NC1=NCC2(O)CC12O,0.2542 | |
| c1c(n[nH]c1O)CC=O,0.2076 | |
| C#CC1OCOC1C#N,0.2792 | |
| CC1C2C1N1CC(O)C21,0.2677 | |
| O=C1CC2(CC#C)NC12,0.2209 | |
| CCC(=O)OC=NC,0.2444 | |
| OC1CN2CC11OCC21,0.2548 | |
| Cc1c(c(=O)cc[nH]1)O,0.1849 | |
| ON=C1CC=CC1C=O,0.2126 | |
| CC1CC1(CO)C1CO1,0.3268 | |
| CC12CC(CO1)C1CC21,0.3256 | |
| CC1C2(O)C3CC1(O)C23,0.3039 | |
| C1C23CCCC12CCC3,0.3245 | |
| C1C2OC1C1=NNN=C21,0.2376 | |
| Cn1nc(nn1)CC=O,0.2249 | |
| CN1CC(CO)NC1=O,0.2887 | |
| O=CC1=CCNC1C#N,0.1758 | |
| C1C2CN1CCN=CO2,0.2187 | |
| C(C#N)C(=O)NC(=O)N,0.241 | |
| c1c2c(no1)NCCO2,0.224 | |
| COC1(C)COC1C=O,0.2195 | |
| CCC1COC(=O)O1,0.3321 | |
| C#CC1OC2CC2O1,0.2702 | |
| CC(O)CC1=CON=N1,0.2304 | |
| OC12CCC1NC(=O)C2,0.2734 | |
| CCC1(N)C(O)C1C#N,0.2796 | |
| CC12C3C4C3(O)C1C24O,0.2889 | |
| c1conc1C(=O)C=O,0.1475 | |
| OCC1C2C(CN12)C=O,0.2186 | |
| CC1CC(C)CC(O)C1,0.3352 | |
| CN(C=O)C(CO)C=O,0.2069 | |
| CCCOCC1CC1O,0.3226 | |
| CC(=O)NCCCC#N,0.2732 | |
| NCC(O)(C#N)C1CN1,0.2755 | |
| COC1OC(C)C2CC12,0.3445 | |
| CC1C(=O)C2NC12C=O,0.1907 | |
| CC1OC11CC2CC12O,0.3157 | |
| ON=C1C2CC1(O2)C#C,0.2425 | |
| CC1(C)C2CC3OC1C23,0.3147 | |
| C#CCC1CC1C#C,0.2845 | |
| CC(CO)CCOC=O,0.285 | |
| O=CC1C2OC(=O)C12,0.2163 | |
| CNC1CCC1(O)C#N,0.2403 | |
| CC(C#N)C12CN1CC2,0.2782 | |
| C1C2OCC=CC=CC12,0.2122 | |
| CC(N1CC1)C1(C)CO1,0.3132 | |
| c1c(nc(c(n1)O)F)N,0.1704 | |
| CC12OC(=O)C1(N)C2O,0.25 | |
| CCCC(CCO)C#N,0.3065 | |
| CC(C#C)C(=O)N(C)C,0.2597 | |
| c1c2c([nH]n1)CCCN2,0.2206 | |
| CC1CC(C1)C1CCC1,0.3512 | |
| COC1CC=C(C1)C#N,0.2218 | |
| COC12CCC1C2C,0.3241 | |
| Cc1c2c(no1)CC=C2,0.2014 | |
| C1COC2C3OC2C3O1,0.3118 | |
| c1c(c[nH]c(=O)c1N)O,0.1631 | |
| CCC1CC(C)(C)C=C1,0.262 | |
| CCC(=NO)C(C)OC,0.2578 | |
| CC1CC1(C)CCC#N,0.3135 | |
| CC1CCC2(O)CC2C1,0.3255 | |
| N#CC12CC3CC3C1N2,0.2763 | |
| CC1CCOC(C)=N1,0.2698 | |
| CC12OC3(C)CC1C23O,0.2904 | |
| CCC1C(C)C1CO,0.3273 | |
| COCc1cn[nH]c1N,0.2366 | |
| CC12CC3N(CC13O)C2,0.2726 | |
| CC(C)(C#C)C#N,0.2967 | |
| OCC12OC3C=CC1C23,0.2246 | |
| c1c(c2n(n1)C=CC2)O,0.189 | |
| C1OC2OCC3C1C23,0.3271 | |
| CNCC(O)C#N,0.2804 | |
| COCC1(O)C(C)C1O,0.305 | |
| Cn1ccc2c1onc2,0.2152 | |
| CNCc1c(non1)N,0.2127 | |
| CC(C)(CC1CC1)C=O,0.2281 | |
| c1c(nc(c(n1)O)N)F,0.178 | |
| CN(C)c1ccoc1,0.2158 | |
| CCC1CCC2C(O)C12,0.3066 | |
| O=C1CN2CCC1CC2,0.1934 | |
| CN1C(=O)C2OCC12C,0.2478 | |
| C1CC1(CC#CC#N)O,0.2305 | |
| CC1CC(O)C(=C1)C#N,0.2222 | |
| CC(C)C1CCC(C)C1,0.3754 | |
| CC(C1CC1)C(C)=O,0.2286 | |
| CC12C3OC1CCOC23,0.2845 | |
| CC1CC11COCO1,0.3283 | |
| CC1(O)CNC11COC1,0.2972 | |
| CC1C2CC2(C#C)C1O,0.2725 | |
| OCC(=O)N1CC1C=O,0.2065 | |
| CC1CC=CC1CCO,0.2616 | |
| CC(O)C1(O)CC2NC12,0.291 | |
| CCC1CC(C)C(=O)O1,0.2776 | |
| CC1(CC#N)CCCO1,0.2914 | |
| CN1C=CC(=O)CC1=O,0.1797 | |
| CC1(C)CC1CCCO,0.3373 | |
| O=C1COC11CC=CC1,0.2203 | |
| c1[nH]c(=O)n(n1)C=O,0.214 | |
| CC12CCC1OCCO2,0.3096 | |
| C#CCCC(=O)C#N,0.1862 | |
| CC1CC23CN4C2CC134,0.2498 | |
| CC(C)C1NC(=O)C1C,0.2795 | |
| CNC(=N)c1ncno1,0.1781 | |
| CC12NC(=O)C1C2C#N,0.2447 | |
| COC(C)C(C)CO,0.326 | |
| CC1C2C3OC1(C)C23O,0.2894 | |
| CC(O)CC1(CC1)C=O,0.2333 | |
| CC(C)(CO)COC,0.3217 | |
| CCC1(O)CC(O)C1,0.3196 | |
| OCC1(CO1)C#CC#C,0.2174 | |
| OC1CC1C1OC1C#C,0.2761 | |
| CC1C2CC(O)C(=O)N12,0.2345 | |
| COC=Nc1c[nH]nc1,0.2074 | |
| C1CC1c2nc(no2)O,0.237 | |
| C1CC1c2c([nH]nn2)N,0.2237 | |
| CC1C(C)C1(CO)C#C,0.2871 | |
| CNC12CC1NC2C#N,0.2442 | |
| O=C1OCC1CC1CC1,0.2806 | |
| OC1C2CN3CC2(O)C13,0.2864 | |
| Cc1c(ocn1)OC,0.2303 | |
| COC(C=O)C1CC1C,0.2098 | |
| CCCCOCC1CN1,0.3228 | |
| CC12OC1C(O)CC2=O,0.2143 | |
| CC1C=CC23CC12CO3,0.2257 | |
| CNC12CC1(OC2)C#N,0.2314 | |
| OC12CC1CC21CC1,0.3035 | |
| c1c([nH]c(c1O)O)C#N,0.187 | |
| N=CN1C(=O)CCC1=O,0.2245 | |
| Cc1cc(c(o1)O)OC,0.2174 | |
| CC12OCC1CNC2=O,0.248 | |
| CC1(COCCO1)C=O,0.2075 | |
| CC(C)(CCC#N)OC,0.3075 | |
| CC#CC(C)(C)CO,0.3002 | |
| OCC1CCC2OC2C1,0.3316 | |
| NC(=[NH2+])N1C=NC=C1[O-],0.18 | |
| CC(C#N)C(=O)CO,0.2326 | |
| C#CCc1noc(=O)o1,0.2667 | |
| O=CC1CC=CC(=O)C1,0.187 | |
| CC1OC1C1=NON=C1,0.226 | |
| OC1CC(=O)C1C1CC1,0.2173 | |
| CC1CN2C(=O)CC12C,0.237 | |
| OC1C2NC(CC#N)C12,0.2721 | |
| CC12CCC(C=C1)C=C2,0.2383 | |
| CCC(=N)OCCOC,0.2902 | |
| CN1CC2NC2(C1)C#N,0.2318 | |
| CC1([NH3+])CC1(O)C([O-])=O,0.2595 | |
| CCOC1(C)CN2CC12,0.3084 | |
| CCOCC1CC(=N)O1,0.2781 | |
| CC1CC2CCOCC12,0.3176 | |
| CC12CC(C=C1)C21CC1,0.2358 | |
| O=C1NCC11CN=CN1,0.2363 | |
| CC12COC11CC(C1)O2,0.304 | |
| OC1C2CC(C3CC3)C12,0.3173 | |
| OCC(O)CC1CCC1,0.3119 | |
| ON=C1CC2OC2C=C1,0.1837 | |
| OC1=C(F)C(=N)N=NO1,0.1965 | |
| CNc1ccc(o1)C#C,0.1764 | |
| c1c(c(=O)oc(n1)F)N,0.1674 | |
| COC(C)C1OCC=C1,0.2505 | |
| CCCCC1CCC1O,0.327 | |
| CC1=COC(=N)NC1=O,0.2042 | |
| CC1CC=CN(C)C1=O,0.2099 | |
| CCNc1c(cn[nH]1)N,0.233 | |
| C1C2(CO1)C(=O)OCO2,0.2525 | |
| CC1COC(=N1)C1CN1,0.2558 | |
| CC1C=CC=CC=C1C,0.1742 | |
| C1COC(=O)CC(=O)N1,0.2507 | |
| CC1C=C(C)C(=O)C1=O,0.139 | |
| COCC1(CN1)C(C)=O,0.2251 | |
| CCC(COC)OC,0.3287 | |
| N#CC1OCC=C1C#N,0.2164 | |
| CCC1CC1OC(N)=O,0.315 | |
| CC1C(C#C)C11CCO1,0.2687 | |
| O=CCC1CC2CC2O1,0.2255 | |
| CC1NC2CNC12C#N,0.2453 | |
| CCC1C2OCC2N1C,0.2875 | |
| C1OC11CCC11CCC1,0.3296 | |
| OC1C2(O)C3CC3C12O,0.2668 | |
| CC(=N)OCC#CC#C,0.2223 | |
| c1c(c(n[nH]1)C=O)N,0.1752 | |
| CC12CC3=CCC(O1)C23,0.2116 | |
| CCCc1cnnn1C,0.2509 | |
| O=C1CC2C1NCC2=O,0.1829 | |
| CC(O)CC1COC1=N,0.2906 | |
| CC1(C)OC11COC1=N,0.2713 | |
| O1C2C3C4C3N3C2C3C14,0.2972 | |
| CC1C=C(C#N)C2CN12,0.1915 | |
| CC12CN3C1CC3(C)C2,0.3116 | |
| CC1C(=O)CCC11CC1,0.2183 | |
| N#CC1CC(O1)C#N,0.2716 | |
| COC1C2CC=CC1O2,0.2409 | |
| CC1(CO)CC1CC=O,0.2254 | |
| CC1(NC1CC#N)C#C,0.2724 | |
| c1c2c(co1)NCCC2,0.2132 | |
| ON=C1C(O)CNC1=N,0.1956 | |
| OC12CC3C=CC(C1)C23,0.2524 | |
| CC1NC1(CCO)C=O,0.2169 | |
| CC(CCO)C(C)=NO,0.2584 | |
| CNc1cn(nc1N)C,0.2141 | |
| O=C1OC(C#N)C2NC12,0.2523 | |
| CC1(CC=O)CC1CO,0.2233 | |
| CCCC(=O)CNC=O,0.2209 | |
| CN(C)C(=O)NC(=O)N,0.2594 | |
| C1OC23CC4CN(C12)C34,0.2752 | |
| CC1(CO)NC1C#N,0.287 | |
| C(C(CO)(C#N)O)O,0.2937 | |
| CC1OC1(C)COC=N,0.2805 | |
| CC12CN3CC1C(O)C23,0.283 | |
| CC12CC3CC4C1N2C34,0.2976 | |
| CC1C2C3C(C2C#C)N13,0.2843 | |
| NC(=O)NC1CC1CO,0.2926 | |
| C#Cc1ccc(=O)oc1,0.166 | |
| c1c(c(no1)C=O)CO,0.1937 | |
| CC1CCCC(C)=CC1,0.2522 | |
| OC1CC2CC(=O)NC12,0.273 | |
| CCCN(C)C=O,0.2724 | |
| O=C1C2CC3(CCC13)O2,0.2076 | |
| C1CC12CCN2C=O,0.2524 | |
| c1cc(ncc1CO)F,0.2188 | |
| C1C23CC4NC4C12CO3,0.2787 | |
| CCC1C2C(C)C(=O)N12,0.2328 | |
| CC#CC(=O)CO,0.2095 | |
| O=C1CC2CN2CC1=O,0.1424 | |
| OC1C2C3OC2C3C1=O,0.2038 | |
| CC1C2N1C1CC2(C)C1,0.3158 | |
| CCC12C3CC1N=CN23,0.2385 | |
| CC(C)C1(O)CC2CC12,0.3107 | |
| O=C1C2CC2CC11CO1,0.2121 | |
| CC1=NCC(CO1)C#N,0.2703 | |
| OC12CC(C1)(C2)C1CC1,0.3301 | |
| CCOC(=N)C1CCO1,0.2866 | |
| CC1CC1C(C=O)C=O,0.1952 | |
| CNC(=O)C12CC1CC2,0.269 | |
| NC(=O)C1CC2COC12,0.2649 | |
| CC1(C)C(CC1=O)C#N,0.2192 | |
| CCC1(CC1)C(C)CO,0.341 | |
| OC12CN3C1C1(CC1)C23,0.3096 | |
| Cc1c(cc[nH]c1=O)O,0.1841 | |
| CC(=N)Nc1cnco1,0.2139 | |
| CN1CC(O)C1C#C,0.2575 | |
| CC1=Cc2c(ocn2)C1,0.191 | |
| O=CC1C=CCCC1=O,0.2052 | |
| CC1C2COC12C,0.3109 | |
| C1COCC(=C1N)C=O,0.1821 | |
| c1cnc(cn1)C2CC2,0.2001 | |
| OC1C2C=CC11OCC21,0.2145 | |
| CC#CC(O)C(=O)C#C,0.1798 | |
| CC1CNC2=C1N=NO2,0.1656 | |
| C1C2C1C1CCC21,0.3171 | |
| CC1=CNC(=O)CC1,0.2098 | |
| CN1CC2(CN2)C11CC1,0.2767 | |
| OC1=C(F)C=NC(=N)O1,0.1593 | |
| OC1C(O)C1OCC#C,0.2555 | |
| CC(CCO)NC(N)=O,0.2998 | |
| CCC(=NO)COCC,0.2539 | |
| NC1=CC(=O)CC11CO1,0.2011 | |
| c1cc([nH]c1)C2(CC2)O,0.2349 | |
| CC(O)C1(CO)CC1,0.326 | |
| CC1CCCC(C)O1,0.3293 | |
| C1C2OC3CC=CC12O3,0.2309 | |
| c1c([nH]c(c1O)O)C=O,0.164 | |
| CC1C2OC3(COC3)C12,0.3073 | |
| [NH3+][C-]1C=CC2=C1ON=N2,0.1112 | |
| CC1=CCCC1(C)C=O,0.2064 | |
| Cc1c(ccoc1=O)F,0.1848 | |
| CCCC1(CC1)C#N,0.3201 | |
| N#CC1C2C1N1CC2C1,0.2679 | |
| Cc1c(c([nH]c1O)N)O,0.2109 | |
| CC1(CC1)OC(=O)CN,0.259 | |
| COC1C2CC1(O)C=C2,0.2359 | |
| CC(O)CC(C)C(N)=O,0.2716 | |
| CCCOC(=O)NC=O,0.2456 | |
| CC(O)C1=NNN=C1N,0.2156 | |
| c1c(nc(nc1O)F)N,0.2347 | |
| CC1C(O)CC1(C)C#N,0.3094 | |
| CCC1COC1(C)CC,0.3183 | |
| CCC1OC2C3OC2C13,0.3043 | |
| CC1N2C3CC(C)=C1C23,0.1656 | |
| Cc1c(=O)c(non1)N,0.1617 | |
| CC1C2CC3NC3CN12,0.2711 | |
| C1C2CCC11N=COC21,0.2546 | |
| CC12CC3OC1C2C3O,0.2941 | |
| CCC(=O)C12CN(C1)C2,0.1983 | |
| CC1CC2C3C2C1C3O,0.3282 | |
| C1CC23CCC12CCO3,0.313 | |
| OC12CC3=CCC1C23,0.1759 | |
| OC(C#N)C1CCC1,0.3038 | |
| O=CCCC(C=O)C#C,0.2094 | |
| CC1CC2C3CCC2C13,0.3653 | |
| CC1(OCCC1=O)C=O,0.1985 | |
| CC1=NCCCOCO1,0.2585 | |
| C#CCNC(=O)C1CC1,0.2718 | |
| CC1(NC1C#C)C#C,0.255 | |
| O=CC1=CC2OC2C1=O,0.148 | |
| c1c2n(cn1)CCCC2,0.2421 | |
| C1CC(C1)CC(=O)C#N,0.2016 | |
| O=C1C2C3CC4C3C2C14,0.2193 | |
| CCC1C2C3CC1OC23,0.3175 | |
| N#CC1=CC2CC2CC1,0.2071 | |
| C#CC1CC1CCC#N,0.2873 | |
| CC(C)COC(=O)C#N,0.2471 | |
| Cc1c(c(c[nH]1)O)C#C,0.2057 | |
| C(C#N)NC=NCC#N,0.2581 | |
| NC1=NON=NC1=N,0.1636 | |
| CC(C)CC1C2COC12,0.3076 | |
| C1C(=O)C(=O)CN1C=O,0.1427 | |
| O1C2C3OC4C1C4OC23,0.2346 | |
| CC1CC1CCC#C,0.3132 | |
| Cn1ccc2c1[nH]nc2,0.2231 | |
| OCCN1CC1C1CN1,0.304 | |
| N=CN1CCC(=O)C1=N,0.1692 | |
| CCOCC1(CC)CN1,0.3152 | |
| c1cn(c(=O)cn1)C=O,0.1551 | |
| C1C2C1C1CC2C11CO1,0.3411 | |
| CCC1CCC1(O)C#N,0.3058 | |
| CC1(C#N)C2C(O)CN12,0.2785 | |
| OC1(CC11CCO1)C#C,0.2558 | |
| CC(C)C1NC1CO,0.3189 | |
| C1C(=NO)CNC1=O,0.2392 | |
| CC1OCC1NCC#N,0.2661 | |
| CC1OC2(CO)CNC12,0.289 | |
| OCC1=CC2CCC2C1,0.257 | |
| CC(C=O)C(=O)OC=N,0.2158 | |
| CCC1C(CO)C1OC,0.3071 | |
| CC(=O)OC1(CC1)C,0.277 | |
| Cc1ncnc(n1)O,0.2286 | |
| C1CC2OCCOC2C1,0.3145 | |
| O=C1C2CC2C1C1CN1,0.2154 | |
| CCC1(O)COC=NC1,0.2628 | |
| C#CC1C2COC1OC2,0.2949 | |
| C#CC1OC2CC12C#N,0.2598 | |
| OC12CC3OC1C23,0.2898 | |
| CC1(O)CC2CC2C=C1,0.2484 | |
| CC12C3C4OC1C4C23C,0.3219 | |
| C#CCc1ccc[nH]1,0.2416 | |
| CN1CC2CC1C2=O,0.2036 | |
| CC(O)(C#C)C1CO1,0.2892 | |
| CC12CC3C1C=CC23,0.2263 | |
| CC(C)C12CC1OC2=O,0.276 | |
| CN(CCC#C)CC#N,0.2602 | |
| CC12CC(CO1)CC2O,0.3187 | |
| COCC(O)CC#C,0.3051 | |
| CCC1C2OC2C1O,0.323 | |
| CCNc1cc([nH]n1)N,0.2291 | |
| C#CCNc1ccn[nH]1,0.2391 | |
| OC12CCC1COCC2,0.3151 | |
| COC(=N)CC#CCO,0.2827 | |
| CC(=O)C(O)CC1CC1,0.2324 | |
| CC1CC2OC1C1CC21,0.343 | |
| C1C2OC3OC12CC=C3,0.2408 | |
| OCC1C2CC3(CC3)C12,0.316 | |
| CC1C2COC(C)=NC12,0.2535 | |
| Cc1cc(no1)C#N,0.2243 | |
| CC1CC11OC2CC12C,0.303 | |
| CCC(C)C1(C)CC1C,0.3356 | |
| CCc1cc(no1)OC,0.2473 | |
| CCC12OC(C1C)C2C,0.3175 | |
| C#Cc1nc(on1)C=O,0.1812 | |
| CC12CC3OC(C1)OC23,0.3454 | |
| O=C1OC2C3N4CC13C24,0.2327 | |
| C1C2C3C1N1C3C=CC21,0.2239 | |
| CC1(N)CC(=N)OC1=O,0.2432 | |
| CCCn1cc(nn1)N,0.2155 | |
| CCc1c(nno1)O,0.2017 | |
| CC(C)(CC(=O)N)CO,0.2709 | |
| CN1CC1C1CC(=O)N1,0.2674 | |
| COC(C)C(C)CC#C,0.308 | |
| CC1COCC2(C)NC12,0.3085 | |
| O=C1CN2CC2C2CN12,0.2268 | |
| OC12C3C1C1OC2OC31,0.3174 | |
| OC1C2C(C#C)N2C1=N,0.2352 | |
| CCC(C)(C=O)C(N)=O,0.2017 | |
| CC12OCC34CC(C13)C24,0.3188 | |
| CC1CCC(=N)OC1C,0.2765 | |
| CC12C3C4C(N13)C24O,0.267 | |
| OC1C(O)C11NCC1=O,0.2013 | |
| CC1(C)C2OC3C2OC13,0.3007 | |
| CC1OCCC1O,0.302 | |
| CCCC1OC(=O)C1N,0.2497 | |
| COC1C2CCN2C1=O,0.2203 | |
| C1C2CC=CC3OC1C23,0.2434 | |
| O=C1NC(C#C)C11CN1,0.2612 | |
| OC1CC(=O)C11CN1,0.2064 | |
| CC#CC(CO)(CO)O,0.2745 | |
| CC#CC1(CC(=O)C1)C,0.2164 | |
| CC1CC2=NC(O)=CN12,0.224 | |
| C1CC11N=C2NC3C2C13,0.1582 | |
| C#CCC1C2COC12,0.2977 | |
| CC12C(O)C1C=CC2=O,0.1798 | |
| CC(=O)CCC(F)(F)F,0.2365 | |
| COC1CN=C(O1)C#C,0.2229 | |
| OC1CCC2OC2C1=O,0.1999 | |
| CC1C(O)CCCC1=O,0.2256 | |
| C1CC1C(=N)NC=O,0.2331 | |
| C1CC2C3OCC2C1O3,0.3298 | |
| C(c1c([nH]c(=O)[nH]1)O)O,0.2224 | |
| CCC1NC1C#CC=O,0.2011 | |
| N=COC1CNC1=O,0.2583 | |
| CC1OC(=N)C2C(O)C12,0.2676 | |
| OC1C(C#C)C11COC1,0.273 | |
| CC1C2(C)CCC12C,0.3192 | |
| CC1(CC(C1)C=O)C#N,0.2221 | |
| COC1CC2C(CO)C12,0.3211 | |
| CNC1(C)COC1=O,0.2455 | |
| CN1CC(N)(C#N)C1=O,0.2417 | |
| c1[nH]c2c(n1)c(n[nH]2)O,0.2268 | |
| O=C1C2CC3(COC13)O2,0.1981 | |
| COCC12NC3C1OC23,0.2949 | |
| N#CC#CC12CN(C1)C2,0.2115 | |
| CCC1(C)CC2(O)CC12,0.3263 | |
| CC(C)C12C3C4C1N4C23,0.2783 | |
| [NH3+]C1(CC1CO)C([O-])=O,0.2669 | |
| CCC12C3OC1C(O)C23,0.2959 | |
| C1CC2(CN3CCC23)O1,0.2788 | |
| c1cn(cn1)CCCO,0.2531 | |
| N=C1C=CN=C2CCN12,0.1829 | |
| CC1(CC1)n2cccc2,0.2456 | |
| CC1N2CC1(O)C2C#N,0.2703 | |
| CC(C)(C#N)C1CC1,0.3407 | |
| CC12CC3(C1)OCC3O2,0.299 | |
| COCC1(CN1)C1CO1,0.3175 | |
| O=CC1C=C2CC3C1C23,0.171 | |
| COC(=O)N1CC1C=O,0.212 | |
| OC1C2CC3OC2C13,0.3077 | |
| C(#N)c1c(c([nH]n1)N)O,0.2015 | |
| CCC1(COC1=O)OC,0.2586 | |
| CC#CC(C)CC(C)=O,0.2239 | |
| CC#CC(=O)C(C)O,0.2034 | |
| OC1C=C2CC3(O)C1C23,0.1782 | |
| CC(C=O)C1OC1C#N,0.223 | |
| Cc1c(c(n(n1)C)C)N,0.234 | |
| CC1CC2OC2C11CN1,0.3133 | |
| CN(C)CCC(=O)C#N,0.1415 | |
| CC1C2N(C)C(=O)C12C,0.2466 | |
| CC1OC(=O)C2CC12O,0.2693 | |
| CC(C)C1CC1C(C)=O,0.2293 | |
| O=C1CC2N3CC3C2=C1,0.1881 | |
| Cn1c(=O)c(cnn1)F,0.1862 | |
| N=C1OCC11CN1,0.2698 | |
| CC1=C(CC(O)C1)C#N,0.2173 | |
| COC(CO)CO,0.3127 | |
| CC1NC11CC2(CO2)C1,0.3043 | |
| CCC1N(C)C(C)C1=O,0.208 | |
| CC1OC11C2C3CC1N23,0.3148 | |
| CC1C2OC3C1(O)C23O,0.2765 | |
| CC1CC2(CN12)C=O,0.2137 | |
| CC1(OC2C(O)C12)C=O,0.2041 | |
| CC12CCC1CC21CO1,0.327 | |
| NC12CC(C1)OC2=O,0.2537 | |
| CNc1conc1C#C,0.1804 | |
| CC1(O)CC(=NO)C1O,0.2455 | |
| C1CC2OCCN=C2N1,0.2499 | |
| c1nc(n(n1)CCO)N,0.2451 | |
| Cc1c(cn[nH]1)N(C)C,0.2378 | |
| CCC1CC1(C)C1CC1,0.3381 | |
| COC1=NCC(=O)N1,0.2474 | |
| CC12CC1C1C(C#C)N21,0.2415 | |
| N#CC12CN3C(C=C1)C23,0.2286 | |
| CC12COC(C1)OC2=O,0.2748 | |
| Cc1nc(on1)OC,0.2606 | |
| OC12CN(C1)C21CCC1,0.3108 | |
| CC12CN3CC4C(C13)N24,0.2735 | |
| CC#CC1CC(C)C1C,0.2934 | |
| CC1N=C(C)OCC1=O,0.2081 | |
| OC1C2OCC(=O)OC12,0.244 | |
| COC1CC2(C)CC1O2,0.3242 | |
| CC12CCC1(N2)C=O,0.2183 | |
| Cn1c(=O)ocn1,0.2392 | |
| CC#CC1(O)COC1=N,0.2609 | |
| CC1=CC(=O)C2CC12O,0.1866 | |
| C1CC23OCC4C2N4C13,0.3008 | |
| CC1CC2CCCC=C12,0.2564 | |
| CC12CCC(O1)C(O)C2,0.3175 | |
| CCC1C(O)C1C#N,0.2987 | |
| CC1C2C(O)C1C21CO1,0.3256 | |
| Cc1cc(on1)C#N,0.2161 | |
| COC12CC1OCC2C,0.3012 | |
| N=C1OC23CC(C2)OC13,0.2636 | |
| CC1(CC2CN2C1)C#N,0.2797 | |
| CCC1=NCC(C)O1,0.2699 | |
| C#Cc1ccoc1,0.2173 | |
| CC1(C)OC1(CN)C#N,0.2633 | |
| CC12C3C4C(C1C3O)N24,0.2976 | |
| CC1C2OCC2(O)C1=O,0.2133 | |
| CNC(=O)CN1CCC1,0.2656 | |
| CCC1C=CCC1(C)O,0.26 | |
| CC1C2OCC3(CO3)C12,0.3133 | |
| CC1COC1C(O)C#C,0.2682 | |
| CC1CC=C(CO)C1=O,0.1979 | |
| COCC#CCNC=O,0.2701 | |
| CC1=CN2CC2CC1=O,0.1813 | |
| FC1=NC(F)=NC(=N)O1,0.2153 | |
| c1c(=NO)cn[nH]c1F,0.1557 | |
| CC1CC2NC2C1C=O,0.2162 | |
| C1NC1C12CN1C1CC21,0.2847 | |
| CC1CC(C)(O)C2CN12,0.2976 | |
| CCC1OC(C=O)C1=O,0.2023 | |
| CC1C2CC1(CO2)C=O,0.2137 | |
| CCCC(=N)OC(C)=O,0.2439 | |
| CC1NC1C(C)=O,0.2228 | |
| C1CC(=O)C=C1,0.1938 | |
| O=C1OC2CC2C1C#C,0.2637 | |
| N=C1OCCC(O1)C=O,0.2083 | |
| CC1CC(N)(C=C1)C#N,0.2591 | |
| Cc1cnc(=O)[nH]c1C,0.174 | |
| CN1C(=O)CC=C1C#C,0.1774 | |
| CC1(O)CCC1C(N)=O,0.27 | |
| C#CC12OC1C1CCC21,0.2572 | |
| CC1CC1N1N=CN=N1,0.2494 | |
| CC1(O)C2C(=O)NC12C,0.2508 | |
| OC1(CCN2CC12)C#C,0.2588 | |
| CC12OC3CC(C13)C2=O,0.2017 | |
| CC(C)C1(CC1)NC=O,0.2758 | |
| CC(=O)C(=N)NC(=O)C,0.1654 | |
| CCn1cncnc1=O,0.2013 | |
| OC1=NC=CC=CC1=N,0.1515 | |
| OC12CC1CC=C2C#N,0.2081 | |
| OC1CCC(=C1)C#C,0.209 | |
| CC[NH2+]C(C)C([O-])=O,0.2681 | |
| CC1N2C3C2(C)CC13O,0.2983 | |
| C#CCC1(CCO1)C#N,0.2721 | |
| CC1OCC2NC1C2=O,0.2242 | |
| CC1CC2CC1(C2)C#C,0.3001 | |
| CCN1CC2(C1=O)CC2,0.2734 | |
| C1C2C=CC3CC3C12,0.2465 | |
| CCC1C(=O)C=CC1=O,0.154 | |
| CC1CCCC1C1CO1,0.3392 | |
| C1OCC2CC1CC=C2,0.2652 | |
| CC1(CCN=CO1)C,0.2765 | |
| CC1(O)CC2(CC2)C1O,0.3191 | |
| CN1C(=O)C2CC12C,0.2477 | |
| OCC(O)C1CC(=N)O1,0.2817 | |
| O=C1CC(CCC#C)O1,0.2762 | |
| CN1C2C1C1CC2CO1,0.3065 | |
| CCCc1cccnc1,0.228 | |
| OCC1(CC(=O)O1)C#C,0.276 | |
| CC12C3CC1C3C21CO1,0.3475 | |
| CC1C(O)C11OCC1=O,0.2122 | |
| C1C2OC22CC1CC=C2,0.2399 | |
| CC1C2C3C=CC2(C)N13,0.2066 | |
| CC1C2C3N1CC23C,0.3037 | |
| CC#CC1(C)CC1(C)O,0.2809 | |
| COC1COC(C)CO1,0.3275 | |
| CCC1CC2(CC12)OC,0.3283 | |
| CC1CC(N(C)C)C1=O,0.1925 | |
| CCc1nc(co1)CO,0.24 | |
| OC12C3OC1C3NC2=N,0.243 | |
| C(C(=N)NC(=N)C=O)O,0.1655 | |
| CC12CCC1(C)C(=N)O2,0.2866 | |
| CC1C2COC1(C)OC2,0.3248 | |
| CC1C=C(CO)NC1=O,0.2115 | |
| CNC(=O)C1(C)CCO1,0.2667 | |
| OCCC12NC3C1NC23,0.2869 | |
| CC1(OC1C1CN1)C=O,0.2137 | |
| CCC1CC11COC1=O,0.2783 | |
| c1nn(c(=O)o1)C2CC2,0.228 | |
| CC1CC2C3OC(C1)C23,0.3064 | |
| N=C1N2C3CC1(C#N)C23,0.2687 | |
| CC(O)C1CCOCO1,0.343 | |
| OCC1CC(CO1)C#C,0.2975 | |
| CC1OC2(CC12O)C=O,0.2167 | |
| O=CN1C2CC(C2)C1=O,0.2231 | |
| OCCOC(C=O)C#C,0.2066 | |
| CC1C2C3CC3N12,0.2781 | |
| CC(NC=O)C1CO1,0.2812 | |
| CCC1(CC(=O)C1)C=O,0.2148 | |
| C1CC1C2(CC2)OC=O,0.2595 | |
| CCC(O)C(C)(O)C#N,0.2938 | |
| CCC1(CC1C)NC=O,0.2745 | |
| CC#Cc1cnn(n1)C,0.2141 | |
| CCC1CC2CC(C2)C1,0.3508 | |
| OC1=NC(=N)C=C(F)O1,0.2209 | |
| OC12CCC34OC(C13)C24,0.2907 | |
| OC(C#N)C(=O)NC=N,0.2297 | |
| N=C1NC(=NC=N1)C#C,0.1539 | |
| CN1C2CCC3OC2C13,0.2827 | |
| CC1=CCC2CCCC12,0.26 | |
| OCC#CC12CC1OC2,0.2499 | |
| O=CC12CC1C(=O)NC2,0.2163 | |
| CC1(O)C(O)CCC1O,0.3164 | |
| O=C1OC23COC2CC13,0.2633 | |
| CC(C)C1CC(O1)C#N,0.2787 | |
| c1cn(c(n1)O)C2CC2,0.2455 | |
| c1c[nH]c2c1cc([nH]2)O,0.2211 | |
| CC(O)C(=O)C#CC#N,0.1716 | |
| CC1=C(COC1)CC#C,0.243 | |
| C1CC1OCCCO,0.3213 | |
| C#CC(C=O)C#C,0.2157 | |
| C1OC2C3OC12CC=C3,0.2307 | |
| CCN=CNC(=O)OC,0.2495 | |
| CCN1N=CC=CC1=N,0.1521 | |
| O=C1C2C3CC1(C#N)C23,0.241 | |
| C1C2C3C1C21C=CCC31,0.2427 | |
| CC1C=C(C)C(C)C1C,0.2548 | |
| COCC1CC1OC,0.3334 | |
| CC(=O)C(C(=O)C)O,0.2019 | |
| CC12NC1C=CC2C=O,0.2067 | |
| N=C1OCC2(CO2)C=C1,0.2054 | |
| CC(=O)CC1=NCCO1,0.2337 | |
| CCC(=O)NC(C)C#C,0.2706 | |
| CC12C3C4C3C1C(O)C24,0.3083 | |
| COC1C2CC3OC2C13,0.3198 | |
| Cc1c[nH]c2c1[nH]cn2,0.2087 | |
| CC1(O)CC1CC#C,0.3038 | |
| C1CC1C#CC1CO1,0.2636 | |
| CC1NCC2CC2C1=O,0.1956 | |
| CC1C2C(C=O)C2C1=O,0.2073 | |
| C1C(N=CO1)(CO)CO,0.2546 | |
| CCC1(CC(=O)O1)C=O,0.2212 | |
| CC#CC(N)C(F)(F)F,0.2927 | |
| O=CC#CC(=O)C1CO1,0.1953 | |
| CC1(C)OC2CCC12C,0.3103 | |
| CNc1ccon1,0.2223 | |
| CCCCC1CNC1=O,0.2804 | |
| O=C1NC23CC2(CC3)N1,0.2807 | |
| CC1CC(C=O)=CCO1,0.1962 | |
| CC1C2(C)CCC12C#C,0.2629 | |
| CCC1(C)C2OC1C=C2,0.2308 | |
| N=C1CCCCCO1,0.2766 | |
| CC1CC2(CO)CCC12,0.3285 | |
| CCCCCOCC,0.3377 | |
| C1Cc2c(nc([nH]2)O)C1,0.2432 | |
| CC(O)C(O)C(O)CO,0.2877 | |
| CNc1cnc(nn1)N,0.1464 | |
| CCc1c(nc(o1)O)O,0.229 | |
| CC1CCC(=O)CC1,0.2232 | |
| CC12C3C4C(C(O)C13)N24,0.2986 | |
| CC1OC1CC(F)(F)F,0.3591 | |
| NC1=NNC=NC1=N,0.1878 | |
| c1nnc2n1c(no2)O,0.2257 | |
| CCNc1c[nH]nn1,0.2091 | |
| CNC1CC(C)OC1=O,0.2455 | |
| COC1C2OCC12C#C,0.2584 | |
| C#CC1C2CCCN12,0.2577 | |
| OCC1(CC1O)C1CC1,0.3134 | |
| c1c2cnoc2oc1N,0.2168 | |
| CC1C2CC1(C)OC=N2,0.262 | |
| CC1COC(CC#N)C1,0.2961 | |
| N#CCCOCC1CO1,0.3072 | |
| OCCC1OCC2NC12,0.3106 | |
| C1C2C3OC22CCCC132,0.2999 | |
| OC1CC(C2CN2)C1=O,0.2091 | |
| COC(C)(C=O)C(N)=O,0.1949 | |
| C1CC12C(=O)OCO2,0.2609 | |
| OCC1CC(=O)C(=N)N1,0.1744 | |
| OCC1C2OC3C2C13O,0.2733 | |
| CC12COC11CN2CC1,0.2612 | |
| c1cc(nc(c1)N)C#N,0.1776 | |
| OC1C2OC3C2COC13,0.2927 | |
| CN1C=NC2(CC12)C#N,0.238 | |
| CC1N=COC1C1CC1,0.2693 | |
| OCC12CC(C1)(O2)C#N,0.2596 | |
| c1nc2n(n1)CCC2=O,0.1993 | |
| CC1(CCCC1)COC,0.3253 | |
| CC1CC2COC1C2=O,0.2072 | |
| CC12COC1(CO2)C#N,0.2545 | |
| CC1CC2(O1)C1COC21,0.2761 | |
| CC#CC1OCC1C,0.2718 | |
| CC1CC2OC12C#C,0.2631 | |
| Cc1c(cc([nH]1)C#C)O,0.1829 | |
| c1[nH]c(c(n1)O)CC=O,0.1588 | |
| OCC1CC(O)C1C=O,0.2116 | |
| CCc1cncc(n1)F,0.2069 | |
| O=CC1C2OC3(CC3)C12,0.215 | |
| CCC1=CC2OC2C1,0.2413 | |
| CCC1(CC=O)CC1C,0.2238 | |
| C#Cc1cc(oc1O)N,0.2093 | |
| CC12CCC1C=CCC2,0.2621 | |
| CC1=COC(=N)C=N1,0.1594 | |
| CC1=CCC(CC#C)C1,0.2603 | |
| CC12CN3C(C13)C2CO,0.301 | |
| C#CCN1C2C3NC2C13,0.2611 | |
| OC1C2C3CC2(O)C13O,0.3085 | |
| CC1=CC(=NO)C2CC12,0.1853 | |
| CC1(C)C(=N)OCC1=O,0.2181 | |
| CC12CCC1CC(=O)C2,0.2226 | |
| O=C1CC23CC4C2C1N34,0.2182 | |
| N#CC12CN1CCCC2,0.2677 | |
| OC1C2N=CN(C=N)C12,0.1998 | |
| CCC(CC(C)C)C#C,0.3135 | |
| C1C23COCC12C1OC31,0.2724 | |
| O=C1NC2CC2C=C1,0.2042 | |
| CC12COCC1C1OC21,0.3127 | |
| C1C=CC=CC(=O)N1,0.1802 | |
| CC1COC(=N1)C1CC1,0.2592 | |
| CC(O)CC#CC#C,0.2281 | |
| OC1C=CN2C=CC=C12,0.1865 | |
| O=C1C=CCOC1C#C,0.1765 | |
| CN1CC1CCC#N,0.2715 | |
| C1C2OC2C2=NOC=C12,0.2425 | |
| CC(O)C1(C)NC1(C)C,0.3 | |
| CC#CC1CCC2CN12,0.2792 | |
| CCC1=CCOCCC1,0.2464 | |
| Cc1ncc(nn1)NC,0.165 | |
| CN1CC11COCC1=O,0.2005 | |
| OCC12CC1CC2C#N,0.2973 | |
| CC(C)(C#CCC#N)O,0.2867 | |
| CC(=O)CC(=O)COC,0.2082 | |
| N=COCC#CCC#N,0.2745 | |
| O=C1CC2C(C3CN3)N12,0.2333 | |
| CN=c1[nH]c(=O)nno1,0.1595 | |
| COC1C2C1C(=O)C2C,0.2268 | |
| CC(CN1CC1C)C=O,0.2066 | |
| CCCNC(=N)C=O,0.1698 | |
| Cc1nc(cn1C)O,0.2223 | |
| CC1(CN1CC#C)C#N,0.2705 | |
| O=C1CC2C1CCC2=O,0.21 | |
| CC1CN=C(N1)C=O,0.1646 | |
| CCC12CC(C)(O1)C2O,0.3292 | |
| N=C1OC=CC(=N1)C#N,0.1487 | |
| CC#CC1CC(CO)O1,0.2686 | |
| C(CN(C=O)C=O)C#N,0.2153 | |
| CC1C2(C)CCOC12C,0.3067 | |
| CC12CC(C1)C(O)C2=O,0.2183 | |
| COC(CO)CC1CC1,0.3235 | |
| CC1CCC(C=O)C=C1,0.2097 | |
| CC(O)C1=NOC=N1,0.2461 | |
| CC1=CCN2CC12C#N,0.2357 | |
| O=CC1=CNCC2OC12,0.1869 | |
| CC1(CO)C2C3CC2C13,0.3353 | |
| CC1(C#N)C2CN=CN12,0.2318 | |
| O=CC1CO1,0.2217 | |
| CC12CC1(OC2=O)C#C,0.2437 | |
| CC1C=CC2=NC=NN12,0.196 | |
| OCC#CC1C2CCN12,0.2476 | |
| c1(c(c([nH]c1O)O)N)N,0.2126 | |
| N=COC1=CN=CN=C1,0.2032 | |
| C(C=O)C#CC#N,0.217 | |
| CNC(=O)C1CCC1O,0.2645 | |
| O=C1OCC=C2CCC12,0.2402 | |
| C#CC1COCC11CN1,0.2829 | |
| C[NH2+]CC(C)C([O-])=O,0.1479 | |
| CC1OC2=NCC(C)C12,0.269 | |
| COCCC1(C)CCO1,0.3195 | |
| OC1C2OCC11COC21,0.3038 | |
| COC1C(O)CC1=NO,0.2441 | |
| c1[nH]c2c(n1)NCCC2,0.2154 | |
| CC1C2CC2C=C1C,0.2439 | |
| c1cncnc1O,0.2284 | |
| [NH3+]C1(CC1O)C([O-])=O,0.2677 | |
| C#CC1NC=NC11CC1,0.2337 | |
| CCC1(CC2NC12)C#C,0.2848 | |
| OC1CC2C3CN3CC12,0.2778 | |
| CC12CC1C1(O)CC21O,0.263 | |
| CC12NC3=NCC1(N)C23,0.1764 | |
| CC(C)(CC=O)C(=O)N,0.2177 | |
| Cc1cncc(n1)C#N,0.1888 | |
| CC1OCC(O)C1C,0.3038 | |
| Cc1nc(=O)nnn1C,0.1688 | |
| CC(O)C1CCCOC1,0.3089 | |
| O=CN1CC2CC2C1=O,0.2187 | |
| C1CC2OC3CC2C1O3,0.3283 | |
| CC12C3OC1C3OC2=O,0.2419 | |
| NC(=O)C1(CC1O)C#N,0.2554 | |
| OCC1NC(=O)C11CN1,0.2597 | |
| C1CC(C1)N=C(C=O)N,0.1803 | |
| CC1=CC2(CN2)C(=O)N1,0.1961 | |
| N#CC12CN1CCOC2,0.2635 | |
| CC12CC1NC(CO)=N2,0.2483 | |
| c1(c(=O)[nH]nc(n1)F)N,0.177 | |
| CC1C2COC(C)C12O,0.3176 | |
| CC1(CO1)C(=O)C#C,0.1979 | |
| C1CC2=CC3OCC3C12,0.246 | |
| Cn1cnc(c1O)C#C,0.2176 | |
| Cc1cnc(o1)N=CN,0.1805 | |
| C#CC12OC3C4C3C1C24,0.2661 | |
| CC1NCCOC1=O,0.252 | |
| CC1NC(=O)C1OC=N,0.2591 | |
| C#CC(CC=O)CC=O,0.2095 | |
| C1C2OC3OCCC2C13,0.3319 | |
| O=CN1C2CC2NC1=O,0.2383 | |
| CC#CCC1CC2CC12,0.3004 | |
| OC(C1CN1)C1CCC1,0.2883 | |
| CCCC1C2CC2C1C,0.3347 | |
| OC1CC2NC2C11CC1,0.3125 | |
| CC1C(C=O)C1(C)C#C,0.2142 | |
| CC1C2CC2C1C(C)=O,0.2189 | |
| CC12CC3CC1(C)C23,0.3269 | |
| O=C1OC2C3CN3CC12,0.2458 | |
| Cn1cc(cc1O)C#N,0.2092 | |
| CC(O)C1=COC(=N)N1,0.2128 | |
| CCC(O)C(N)C#N,0.2972 | |
| N#CC1CC1CN1CC1,0.2727 | |
| OC1C(O)C1(C#N)C#N,0.2634 | |
| CC1(N)COC1(C)C#N,0.2647 | |
| c1cc2n(c1)CCC=C2,0.1774 | |
| O=C1CC2NC1CC=C2,0.202 | |
| OC1CC2CC(O)CC12,0.2948 | |
| C1CN=C(C(=O)C=C1)N,0.1545 | |
| C1NC11C2COCC1N2,0.2987 | |
| C#CC1CCCC1C#N,0.2964 | |
| CC12CC3CN3CC1O2,0.3079 | |
| CN1CC2CC1(C2)C#N,0.2489 | |
| COC1C(O)CC1C#C,0.294 | |
| CN1C(=N)C2NC2C1=O,0.2299 | |
| CC1CC(=O)CNC1=O,0.2196 | |
| CN1CC2CC(=NO)C12,0.2184 | |
| CC(CC#N)C1CCO1,0.2975 | |
| C1CC23OC12CC=C3,0.2314 | |
| OCC1(CN2CC2)CO1,0.3183 | |
| CC12OC3C1C1(CC1)C23,0.321 | |
| CC1(COCCOC1)C,0.3193 | |
| CCCC1C(C)C1CO,0.3272 | |
| C1CC11N=COC2CC12,0.2557 | |
| CC1CC(O)C(CO)O1,0.3033 | |
| CN=C1NC=NC(C)=N1,0.1724 | |
| Cn1c(coc1=O)C#N,0.189 | |
| c1c([nH]nc1N)C=O,0.1572 | |
| CC1C2CC3CC2C1O3,0.3191 | |
| CC1OC(=O)C(O)C1=O,0.2108 | |
| C#CC12OCC3OC1C23,0.2412 | |
| CCC12CC1CCC=C2,0.2512 | |
| CCC1(O)CC2OCC12,0.3053 | |
| CC1OC1COC=O,0.2798 | |
| CN1C=NOC(=N)C1=O,0.1948 | |
| CCC(O)C#CCOC,0.284 | |
| CN=C1NC2(CC2)C1O,0.2488 | |
| CCc1cnn(c1C)C,0.2492 | |
| CC1COCC1NC=O,0.2746 | |
| N=C1ON=CN1CC#N,0.2265 | |
| CC1OC(=N)C(CO)=C1,0.2204 | |
| C#CC12CCC1C1NC21,0.2683 | |
| CC1=CCC2N=COC12,0.258 | |
| O=CN1C2CC1CCC2,0.2661 | |
| CC(O)C12CC1C(=N)O2,0.2777 | |
| CN(CCC#C)CC=O,0.2038 | |
| CC12CCOC1=NCC2,0.2716 | |
| C#CC1CC2CCCC12,0.304 | |
| C1C2CC3OC3COC12,0.3059 | |
| C1CC11N=C2OC3C2C13,0.1503 | |
| [NH3+]C1(C2COC12)C([O-])=O,0.2651 | |
| OCC1(O)C2OC2C1=O,0.2 | |
| CC1OC2C(CC#C)C12,0.2936 | |
| CCC12OCC1C2(C)C,0.2999 | |
| CC1=CC(=O)OC=NC1,0.212 | |
| CC(C)C1(O)C(C)C1C,0.3103 | |
| C1C2CC3OC=NC2C13,0.2617 | |
| Cn1cncc1CCO,0.2454 | |
| CCCC1CCC1(C)O,0.3267 | |
| COC12CC1C1CC1C2,0.3243 | |
| CC1CNC(=N)C1=O,0.186 | |
| ON=C1CC2CC12C=O,0.2098 | |
| CC12CCC=CC1CO2,0.2579 | |
| N=C1OC2C3C4OC13C24,0.2628 | |
| OC1CC2CC1(N2)C#N,0.2687 | |
| OCC12CN1CCC2O,0.2843 | |
| CNc1ccc[nH]1,0.2386 | |
| c1c(=NO)c(con1)N,0.1516 | |
| CC1CC(CO)OC1=N,0.2803 | |
| CC1C2C3C(CO)C2N13,0.2978 | |
| C1C2C3CCOCC1N23,0.3067 | |
| CC12CC(CO1)C(=N)O2,0.2854 | |
| CC1OC1C1=CCOC1,0.2319 | |
| C1CNc2c1c(on2)N,0.2353 | |
| CC1=C(CCNC1=O)N,0.2026 | |
| CC1CCOC(=O)N1,0.3042 | |
| COC12C3NC(C13)C2=O,0.2177 | |
| CC1OC(=O)C2NC12C,0.2505 | |
| CC(=O)OC=NC1CC1,0.2318 | |
| C#CC1CN2CC12C#N,0.2543 | |
| C1C2CC3COCOC123,0.3282 | |
| C1C2OC3COC3=NC12,0.2448 | |
| C1CC=C(CC=C1)C=O,0.1954 | |
| C1CC23NC4C(OC24)C13,0.2877 | |
| CNc1cc([nH]n1)C#N,0.1761 | |
| CC1C(=O)CC1(C)C=O,0.2111 | |
| CC1CC(C)(C1)C(N)=O,0.2717 | |
| CCC1(CC)C(O)C1O,0.2809 | |
| CCCC(C)C(C)OC,0.3329 | |
| C1CN1C1C2C3CC1C23,0.3188 | |
| CCC1(CN2CC2)CO1,0.3191 | |
| CCCNc1cc[nH]c1,0.2276 | |
| CCOC1CC(O)C1C,0.3206 | |
| Cn1c(cc(n1)N)CO,0.2139 | |
| COC1COC2(C)CC12,0.3108 | |
| CC(NCC1CC1)C#N,0.2696 | |
| CC1(CCC1)C(C)(C)C,0.3453 | |
| CC1CC2(C)C(C#C)N12,0.2545 | |
| CC1=NC=C(O)C(=N)O1,0.1762 | |
| CCn1cc(c(c1)O)C,0.2324 | |
| CNC=NC(C=O)C#N,0.2021 | |
| c1c(cc(nc1F)F)N,0.2356 | |
| C#CC(=O)NC(=N)CO,0.2005 | |
| N=C1NN=CN=CC1=O,0.1412 | |
| C1C2C3CC4C=CC13N24,0.2318 | |
| CC12CC(CC11CN1)O2,0.3072 | |
| C1NC11C2CC3CC1N23,0.2841 | |
| CC12CC1C=CCC2O,0.2444 | |
| N#CC12CN1CC1CC21,0.2619 | |
| Cc1c(oc(n1)CO)C,0.2339 | |
| O=C1CC2CC3CN1C23,0.2455 | |
| CC#CC(C#C)C#CC,0.2844 | |
| CC(CCO)C1CCO1,0.3228 | |
| c1c(cc(nc1O)F)F,0.2276 | |
| CC(O)CN(C)C=O,0.2665 | |
| O=COC1CC2COC12,0.2702 | |
| COCCC1(C)OC1C,0.3411 | |
| CC(=O)C#CC1CO1,0.2045 | |
| CC1OC(=O)NC(C)=C1,0.2282 | |
| OC12CCCC1OCC2,0.3206 | |
| CC1CC1C1(CO1)C=O,0.2175 | |
| CC1CC2N1C2(C)C=O,0.2181 | |
| CCCCOCCO,0.3434 | |
| OC1CC1C1OC1C=O,0.2158 | |
| CC1(CO)C2COCC12,0.3112 | |
| CC(C)(C)c1cnco1,0.2431 | |
| CCCOC1OCC=C1,0.2617 | |
| CCC(C#N)C1(C)CO1,0.3113 | |
| OC1CC(C#N)C(=O)C1,0.2208 | |
| CC1(O)CN2CC2C1O,0.2944 | |
| Cc1c(=NO)cn[nH]n1,0.1638 | |
| c1nc(on1)NC=O,0.2264 | |
| c1c(oc(c1N)N)CO,0.209 | |
| CCCCCOC1CC1,0.3312 | |
| CC1(C)CC2OC2C=C1,0.2475 | |
| CCc1ccc(n1C)C,0.2312 | |
| CN1CC(C1)(C=O)O,0.1781 | |
| O=C1C2CC(C2)C1=O,0.1539 | |
| CCC1(O)COCC1C,0.3053 | |
| CCC(CO)(C=O)C#C,0.2219 | |
| CC1(C)CC(O)C11CC1,0.3274 | |
| C1OC2C3CCOC1C23,0.3077 | |
| C1CC23OC2C=CCC13,0.246 | |
| OC1C=CC(O)C1C#C,0.2641 | |
| O=C1C2CC2CC11CN1,0.2253 | |
| CC(O)C1=CC=NN1,0.2566 | |
| CC1CC1CCCO,0.3417 | |
| CC1=NC(OC=N)=NO1,0.2388 | |
| Cc1c(oc(=NC)[nH]1)C,0.218 | |
| C1C2OC3C4CN1C2C34,0.2955 | |
| CC1CC2(C)NC2CO1,0.3077 | |
| CC(=O)C(O)CC1CN1,0.2136 | |
| CC12NC3C(C=C1)C23O,0.2253 | |
| CC1OCC2=C1N=NN2,0.2353 | |
| CC1OC(=O)C(C)=C1,0.2301 | |
| O=C1CC2OC12,0.2179 | |
| OC1CC1C1CCC1,0.3312 | |
| O=COC12CCC1OC2,0.2559 | |
| C#CCN1CCC1C#N,0.2501 | |
| O=C1COCC2CC1C2,0.2142 | |
| CC1(C=O)C2NC(=O)C12,0.2035 | |
| CC1C=C(C)C2CCC12,0.254 | |
| C1CC12CCNC(=O)C2,0.268 | |
| CC12CC3C1C3(CO)C2,0.3152 | |
| CC1(C)[NH2+]CC1C([O-])=O,0.2725 | |
| C1CC2C3C4C3C(=C1)C24,0.2107 | |
| Cc1[nH]c(c(n1)OC)N,0.2211 | |
| Cc1c(cn(c1N)C)N,0.2249 | |
| COC(=O)COCC=O,0.2289 | |
| CC1=CCCNC1C#N,0.2435 | |
| N=C1ON=CC(C=O)=C1,0.1466 | |
| CC1C=CC2C(C=O)C12,0.2122 | |
| c1c(c(on1)CN)CO,0.24 | |
| CC1C2CC1(O2)C(C)=O,0.2197 | |
| CCCC(O)(CN)C#N,0.3027 | |
| [O-]C(=O)C1(CC[NH2+]1)C#C,0.2533 | |
| CCC(C)O,0.335 | |
| CC12COC(O1)C1NC21,0.3123 | |
| CC1(CC(O)CO1)C=O,0.214 | |
| CC1OC1(C)C1(O)CC1,0.3185 | |
| OCCNC1COC1=O,0.244 | |
| CC1(C)OCCOC1=N,0.2724 | |
| CC1(CCCC1)C(=O)N,0.2732 | |
| OC1C2CC(C=O)C12O,0.2225 | |
| CC(O)CC1OCC1C,0.3153 | |
| Cc1ncnc(n1)C,0.2185 | |
| CC1(O)CC2C(O)CC12,0.3187 | |
| O=C1CCC2CC3C1N23,0.217 | |
| CCC12CC(O)CC1O2,0.3365 | |
| CCn1cc(c(c1)C)C,0.2451 | |
| CC(C)Cn1cccc1,0.2462 | |
| CC12CCC(OC1)OC2,0.315 | |
| NC1C(=N)OC11CC1,0.2683 | |
| O=CC1CN=COCO1,0.2088 | |
| N#CCC1OCC11CC1,0.2933 | |
| CC1(O)CC11COC=N1,0.237 | |
| CC(C)CCC(C)(C)O,0.3251 | |
| CN1CC11COCC=C1,0.2393 | |
| N=C1CC2OC(O1)C=C2,0.2438 | |
| N=C1ON=C(CC=O)O1,0.2148 | |
| OCC1OCCCC1=O,0.2103 | |
| COCCN=COC,0.2572 | |
| CC1OC2(C)C1C2(C)C,0.3103 | |
| CC1=C(C)C2NC1C2O,0.2284 | |
| ON=C1C(O)CCC1=O,0.1654 | |
| OC1CN=C2OCC12,0.2648 | |
| CC1C2CC(C)C(=O)N12,0.239 | |
| N#CCC12C3CN1CC23,0.2704 | |
| CC1C2OC2C11CCC1,0.3359 | |
| CCC1CC2NC12C#N,0.2606 | |
| CC1=NC=NC(=N)O1,0.1839 | |
| O=CC1=CCCC1C#N,0.1921 | |
| CC1(CO)OCC2NC12,0.311 | |
| CC(O)CCOCC#C,0.2878 | |
| CCn1c(cc(n1)N)O,0.2445 | |
| CCOCC1(C)CN1C,0.3004 | |
| FC1=CC(=N)NN=N1,0.1612 | |
| OC(COCC#N)C#C,0.2656 | |
| OC(C=O)C1CCC1O,0.2128 | |
| CC1N=C(C)OC11CC1,0.2595 | |
| CC1CCC1C(C)=O,0.2271 | |
| CC1COCC1=NO,0.2518 | |
| CC12C(O)C1C1CC21O,0.275 | |
| C1OC11CC2C3NC3C12,0.2911 | |
| CC1(O)CC1(O)C=O,0.2178 | |
| C1C=CCNCC1=O,0.2125 | |
| O=C1C2CC2C11CO1,0.217 | |
| CC1(CO)C2OC(=N)C12,0.2737 | |
| c1c2ncncn2cn1,0.1579 | |
| CCOCCC(O)CC,0.3172 | |
| CC1(CC1)CC#CC#N,0.2451 | |
| CC(C)C12CC(C1)CC2,0.3599 | |
| CCc1c([nH]c(=O)[nH]1)C,0.2278 | |
| CC#Cc1[nH]cc(n1)N,0.179 | |
| O=C1NCC2CC2CO1,0.2972 | |
| NC1C(N)C1(N)C(N)=O,0.2356 | |
| N=COCC1=COC=N1,0.2479 | |
| CC1(CCCC1=O)C,0.22 | |
| C1=CC=CC=CC=C1,0.1583 | |
| COCCN1CC1C#N,0.2684 | |
| CC(=O)C1C2C3CC2N13,0.2207 | |
| CCC(CO)OC1CC1,0.3265 | |
| CCC(CC)C(=NO)C,0.2562 | |
| CCC(=O)CNCC#N,0.2149 | |
| c1c(n[nH]n1)C2COC2,0.2425 | |
| CCOC1CC1(C)C=O,0.2216 | |
| CC1C2OC3(C)C2C13O,0.2786 | |
| CCC1C(CC)C1CC,0.3351 | |
| C1NC11CC2OC=NC12,0.2558 | |
| CC12CC1(C)C(O)CC2,0.3168 | |
| CC1CN=C(C)N1C=O,0.2253 | |
| CCc1nccn1CC,0.2455 | |
| CC1NC1CC(O)CO,0.305 | |
| OCC(NCC=O)C#C,0.2135 | |
| CN=c1occ(o1)O,0.2498 | |
| OC1CCCCC11CO1,0.3096 | |
| OCC1C2OCC3C2N13,0.3013 | |
| CC12CN3C1C1NC1C23,0.2953 | |
| CC1(C)CCC(CO)O1,0.3163 | |
| CCC12CC3(O)C1OC23,0.2994 | |
| CC1OCC11NC1(C)C,0.3011 | |
| CCC1(CC)CCC1C,0.3479 | |
| c1c2c([nH]n1)CCC2,0.2478 | |
| O=CC1CNC(=O)CN1,0.1871 | |
| CC1(C)CN(C=O)C1=N,0.2292 | |
| CC1=NC(C#N)C2CN12,0.248 | |
| OCC1NC1C(O)C#N,0.2693 | |
| CC(=NO)CCCOC,0.2564 | |
| CC12CC1C(CC#C)O2,0.285 | |
| CC1C2CCC(C)C1O2,0.3043 | |
| CC(CCO)OC=O,0.2759 | |
| OCC1C2CC1(O)CO2,0.2961 | |
| COCCOCCC=O,0.2283 | |
| CCc1cn(nc1C)C,0.2504 | |
| COCC(C)C(=O)CO,0.2321 | |
| C#CC1C2C3CCN1C23,0.2517 | |
| COC1(C)C2C3CN3C12,0.2789 | |
| C1CC1N(CC#N)C=O,0.2537 | |
| CCOC(=O)C(O)C=O,0.2213 | |
| CC(=O)CC1(CO1)C#N,0.2284 | |
| C#CCC(=O)CCO,0.2329 | |
| CC1=CC2OC1C2CO,0.2339 | |
| CC12OC1COCC2O,0.3091 | |
| CC12CC(O1)C21CN1,0.305 | |
| O=C1CC2CCC(C2)N1,0.2672 | |
| CC12C3C1C1C3CCC21,0.3248 | |
| CCC#CC(O)C1CC1,0.2895 | |
| C1=CC=CNC(=O)C=C1,0.1668 | |
| CCC(CC=O)C#C,0.2242 | |
| CC1C=CC2CC1CO2,0.2465 | |
| CNC(=O)C1CC1C#N,0.2653 | |
| CN(C=O)C1CCC1=O,0.2021 | |
| CC12NC(=N)C1(O)C2N,0.2345 | |
| CCC12OC(C1O)C2O,0.3039 | |
| CC12CN3C1C(O)C23,0.2908 | |
| OC1C2CC3C(O)C3C12,0.2798 | |
| NC1C2NC2C1(N)C#N,0.2559 | |
| OC(CCC#N)C#C,0.2974 | |
| OC12CCC1OC(=N)C2,0.2806 | |
| C1CC2=CCCCOC12,0.2457 | |
| C1C2OC3C2OCCC13,0.3132 | |
| CNC=Nc1nnon1,0.1889 | |
| c1c(n2c(n1)CC=C2)O,0.1886 | |
| c1nc-2n[nH]nnc2n1,0.1648 | |
| OC1CC2(CN2C=O)C1,0.2508 | |
| CC1=CNCCC1=O,0.1826 | |
| CCC12CC1(C)OCO2,0.3067 | |
| COc1ncc(o1)CO,0.2359 | |
| Cc1c(c(oc1N)N)C,0.2272 | |
| CCC1(C)CCC(=N)O1,0.2844 | |
| NC(=N)C(N)(C#C)C#N,0.2481 | |
| NC1(C#N)C2C3CC1C23,0.2815 | |
| CC1OC(=O)C1O,0.2629 | |
| CCC1C2C3NC3C12C,0.2772 | |
| C1CC12COC(=N2)C#N,0.198 | |
| CN=C1N2C3CC1(O)C23,0.2625 | |
| CCC(CO)C(C)=O,0.2293 | |
| OC12CC=C3CC1C23O,0.182 | |
| Cc1cc(n[nH]c1=O)F,0.1737 | |
| CC1CC(=O)C=C(N)C1,0.1972 | |
| CC#CC1CC=CC1=O,0.1816 | |
| CC1CCC(O1)C1CC1,0.3192 | |
| NC(C#C)C1=CC=CO1,0.231 | |
| C#CC#Cc1nc[nH]n1,0.1907 | |
| CCC1OC(C)C1CO,0.3061 | |
| OC1=NOC(=N)C(F)=N1,0.1648 | |
| C1CC11C2OC1C21CO1,0.309 | |
| OC1CNC(=O)C2CC12,0.2653 | |
| CC1=CCOC1=N,0.2201 | |
| CC1CC1C1=CN=NO1,0.2184 | |
| [NH3+]C1CC1C([O-])=O,0.2734 | |
| O=C1CN=C2NCC2C1,0.2064 | |
| OC1=NNC(=O)NC1=N,0.1897 | |
| CN1C2C(C#C)C2C1=O,0.2359 | |
| COC1C2NC3C2NC13,0.2854 | |
| C1OC11CC2=CCCC12,0.244 | |
| Cn1c(coc1=O)N,0.2393 | |
| CC#CC12OC1CC2C,0.2591 | |
| COC1COCC1=NO,0.2396 | |
| N=C1OC(=O)COC1=O,0.2192 | |
| OC(C#N)C1(CN1)C=O,0.225 | |
| c1c(cn(n1)C2CC2)N,0.218 | |
| Cc1nc(=O)onn1,0.1579 | |
| Cc1ccc(c(c1)C)C,0.2325 | |
| C1C2C3CC22OCCC132,0.3263 | |
| COC1(C#C)C(C)C1C,0.2707 | |
| CC(=O)N(C)CCC=O,0.217 | |
| NC1=CNC(=N)N=C1F,0.1463 | |
| [O-]C(=O)CC1C[NH2+]1,0.2746 | |
| N#CC1C2CC3NC3C12,0.2769 | |
| C#CCC1CNC1C#N,0.2622 | |
| CN=CNc1ncno1,0.2179 | |
| N#CC12CN1C1CC2C1,0.2753 | |
| CC1C2OCC(O)C12O,0.2955 | |
| COC1C2CC1(C)N2C,0.3034 | |
| CC(=O)CC1CCO1,0.2284 | |
| N=C1OCC11CCO1,0.2628 | |
| CC(C)(C#C)C#CCO,0.281 | |
| [NH3+]C(C1CC1)C([O-])=O,0.2671 | |
| Cc1cc(oc(=O)n1)F,0.1925 | |
| CCC12CC1C(C2)C=O,0.2251 | |
| CCC(C)(CCO)C#N,0.313 | |
| CC(C)(C)C12CN1CC2,0.3038 | |
| CC1N2CC(O)C12C=O,0.21 | |
| N#CCC12NC1C1OC21,0.2551 | |
| CC12OC1C(C)(C)C2O,0.3262 | |
| CC1(C=CCC1=NO)C,0.2485 | |
| Cc1[nH]c(c(n1)N)CO,0.2088 | |
| CC1(CC1C#N)C#C,0.2692 | |
| OC(C=O)C1CC2CN12,0.2045 | |
| CC1CC1C#CC(N)=O,0.2315 | |
| COC1CC(=O)C(C)O1,0.2204 | |
| NC12CC3NC1(C#N)C23,0.2409 | |
| N#CCN1CC1C1CN1,0.255 | |
| c1c(non1)N,0.2173 | |
| CC(CO)C1NC1C#N,0.2777 | |
| CC(=O)C1(CC1)CO,0.2312 | |
| CC1CC2(C)C(C#N)C12,0.3048 | |
| NC12CN(C1)CC2C#N,0.2666 | |
| CC1(C)C2CC3CC2C13,0.3551 | |
| CC1CC2(O)CC12C#C,0.2539 | |
| COC1C(O)C1(C)C#N,0.2773 | |
| CCC1CCCC1OC,0.3221 | |
| CN1CC1(C)C(=O)C#N,0.1652 | |
| COC1(C)C2NC(=O)C12,0.25 | |
| CC1C=CC2OC2C1O,0.2396 | |
| COC1CCC(C)=C1,0.2597 | |
| CN1CC2(C)C3C1CN23,0.2883 | |
| C1CC11OC2CC12,0.3049 | |
| CC1C(C)=CC2NC12C,0.241 | |
| Cc1cc([nH]c1C=O)N,0.1672 | |
| OC1CC(C#N)C1C#N,0.2942 | |
| COCCC1(CC1)C#C,0.2945 | |
| c1c[nH]c2c1C=CCO2,0.1769 | |
| CC1CCC1CC(N)=O,0.2777 | |
| OC(CNCC=O)C#N,0.2251 | |
| CN=C1N=CN=CN1C,0.1702 | |
| CCC#CC(=O)CC#C,0.2066 | |
| OC1C2C=CC1C2C#N,0.2324 | |
| O=CC1=CC2C3C1CN23,0.1759 | |
| CCOCCCCC#N,0.2951 | |
| OC(C#C)C1CC(=O)C1,0.2235 | |
| C1C=CC(=NCCO)O1,0.2019 | |
| CC(C#C)C(O)CC#C,0.289 | |
| CC1CC(C1)(CO)CO,0.3011 | |
| c1c(onn1)CO,0.2331 | |
| CC1NC(=O)C=C1C,0.2169 | |
| C(C#N)OC(=O)C=O,0.1822 | |
| C1CC(O1)C1=NC=CN1,0.243 | |
| C(C1CN1)C1=CON=N1,0.2072 | |
| CCN1N=CC(=N)N=N1,0.169 | |
| CC12CC1(O)CC2,0.3214 | |
| C1C2OCOC1C=C2,0.2446 | |
| CC12OC1C1(CO)OC21,0.2894 | |
| OCC1(O)CC2CC12,0.3004 | |
| CN=C1N=NNC=C1C,0.1613 | |
| CC1OC2C1COC2=O,0.2445 | |
| CC1(O)CC1(C)CO,0.3214 | |
| CC1(C=O)C=CCC1=O,0.1995 | |
| Cn1cc(nn1)N2CC2,0.2398 | |
| O=CC1OC1C1CCC1,0.2163 | |
| OC12C3CN(C13)C2=N,0.257 | |
| CN1CC2OC(C1)C2O,0.2562 | |
| CC1=CC(=N)NN=C1O,0.1535 | |
| COCc1c[nH]cc1N,0.2251 | |
| CC(O)C1CC(C1)C#N,0.3058 | |
| C1CC1N2CCNC2=O,0.2912 | |
| c1cnc(nc1)CC=O,0.1999 | |
| OC1CC1CCOC=N,0.2824 | |
| c1c(cc(nc1F)F)O,0.2432 | |
| C#CC1=CC(=O)NCC1,0.1845 | |
| OC1CN2CC12C1CO1,0.3019 | |
| O=CC1(C#C)C2CCN12,0.2014 | |
| OC12C3C1C1=CCN3C21,0.1791 | |
| OC1CCCC(=C1)C#N,0.2238 | |
| CCC(C#C)C(=O)C=O,0.1523 | |
| CN1C2CC(O)C(=O)C12,0.1973 | |
| CCC1=CCCC2CC12,0.2483 | |
| CCC(O)CCC(N)=O,0.2801 | |
| OC1C2CC1CC(O)C2,0.3178 | |
| COCC(O)C(=O)C#N,0.1784 | |
| CCc1nc(no1)C=O,0.1923 | |
| COCC(OC)C1CO1,0.3305 | |
| NC1(CCC=C1)C#N,0.2448 | |
| NC1CNC1(C#N)C#N,0.2387 | |
| C#CCCC1CCCC1,0.3156 | |
| CC1OCC11NCC1=O,0.2105 | |
| c1c(onc1N)CC=O,0.1997 | |
| ON=C1C2CC2OC1=O,0.1985 | |
| C1C=C(COC1=O)C#N,0.2187 | |
| OC1CN2C1=NOC2=N,0.2184 | |
| CC1CC(O1)C#CC#C,0.2181 | |
| CC1CC(O)C11CO1,0.3101 | |
| COc1ccc([nH]1)C=O,0.1724 | |
| CCCC1CCC1(C)C,0.3543 | |
| CC1NC1(C)C(C)=NO,0.2409 | |
| COCC1=CC(C)CC1,0.2585 | |
| Cn1cc2c(n1)ocn2,0.214 | |
| CC1(C2CC2)C2CCC12,0.3281 | |
| C1C2CCCCC1C=C2,0.2589 | |
| C1C2=CC3C=C1C1C2N31,0.0835 | |
| Cc1cc(c[nH]1)CC=O,0.1937 | |
| c1c(c(on1)C(=O)N)N,0.1775 | |
| CC1(OCC2(O1)CC2)C,0.3248 | |
| OC1C2CC3COC2C13,0.304 | |
| ON=C1C2CC1C2C#N,0.2663 | |
| O=C1CC2OC=NC12,0.2064 | |
| C1C2C3OCOC1C23,0.3203 | |
| CC(=O)C1N2CC1(C)C2,0.2105 | |
| CC1(C)C2OC3CC2C13,0.3231 | |
| C(COCC#CC#N)O,0.2206 | |
| CC1=CCCC(=NO)C1,0.2502 | |
| OCC1NC1CCC#C,0.303 | |
| C1C2CC3OC2C1CO3,0.3207 | |
| CC12CC1(O)CC2C#N,0.2933 | |
| c1cn[nH]c1CCO,0.2583 | |
| C#CC12CC3CC1CC23,0.2854 | |
| Cc1ccn(c1)C(=O)N,0.2078 | |
| O=C1OC23CC4C2CC134,0.2422 | |
| CC(CC1CC1O)C#C,0.3121 | |
| OC1C2CCC3(CO3)C12,0.3196 | |
| CCC12C3C1C1CC3C21,0.3219 | |
| CC1=N[N-]C(N)=[NH+]C1=N,0.1826 | |
| CC1CC2=C(N)C=NN12,0.2252 | |
| CC1=CC(C=O)C2OC12,0.2097 | |
| CCC1(CCOCC1)C,0.3167 | |
| CC(C)C12CC1CC2C,0.3206 | |
| C1C(C(=O)N1)(CO)CO,0.2684 | |
| C#CCc1[nH]cc(n1)N,0.2197 | |
| CC1COC(C)(C)CO1,0.318 | |
| CCC1COC(CO)C1,0.3198 | |
| c1cnccoccn1,0.1628 | |
| C1CCC(C1)(CC=O)O,0.2239 | |
| C1CC23N=COC2CC13,0.2479 | |
| CC(C)NC(=O)NC,0.302 | |
| CC1CC(O1)C(N)=O,0.2648 | |
| Cc1cnoc1CO,0.2346 | |
| CC1(O)COC1C#N,0.2702 | |
| CC1OCC1COC=O,0.2604 | |
| O=CC12CC3C(O1)C23,0.201 | |
| CC(C)C1=NCCCO1,0.27 | |
| CC1OC11CCC1O,0.3104 | |
| COC(C)(C=O)C#C,0.2051 | |
| c1c(nc(o1)CC=O)O,0.1872 | |
| N#CCN1CC2CC12,0.2574 | |
| CC1CCC2=C1NC=C2,0.2375 | |
| CC1CCC2OC12C#N,0.2891 | |
| Cn1c(nc(=O)nn1)N,0.1708 | |
| NC(C#N)C(O)C1CN1,0.2688 | |
| OCC1OC1CN1CC1,0.3155 | |
| CCC1CC(=O)C=C1,0.1917 | |
| C1CC1CCC2COC2,0.3217 | |
| O=C1OC2CC2C11CO1,0.252 | |
| CN=C1NN=CC(N)=N1,0.1513 | |
| OC1CNC2=C1N=NN2,0.2214 | |
| COC1(C)C2C3NC3C12,0.2632 | |
| CN1C2CC2(CO)C1=O,0.2456 | |
| NC1(CC[NH2+]C1)C([O-])=O,0.2711 | |
| CC1CCC(=O)N1C=N,0.2211 | |
| CC(C=O)C1CCC1O,0.2261 | |
| O=CC1CC2OC2C=C1,0.2199 | |
| CCC12CC(OC1)C2C,0.3151 | |
| CC#CC12CC1OC=N2,0.2433 | |
| OC1C2COC1C2C#C,0.2869 | |
| CCC(O)C1CC2OC12,0.3165 | |
| OC1C2C3CCC1OC23,0.2848 | |
| CC(C)(C#N)N1CCC1,0.2706 | |
| OCCC(CO)C=O,0.2226 | |
| Cn1ccc(cc1=O)F,0.1855 | |
| O=C1C2C3CN1C23,0.2453 | |
| CN=c1[nH]cc(o1)C=O,0.1553 | |
| O=C1CCC2CN2C=C1,0.1831 | |
| COC(=O)CCCC#N,0.2868 | |
| CC(=O)C12CC1(O)CC2,0.2101 | |
| CC1CN(C=O)C1(C)C,0.2685 | |
| CN=COCCN1CC1,0.2732 | |
| CN1C2C(O)CC12C=O,0.2161 | |
| CC1CC2NC2C=C1C,0.2449 | |
| OCC1OC2CC12C=O,0.2198 | |
| CC12CC3(C)C1OC23C,0.3084 | |
| CC12CC3(C)COC1C23,0.3113 | |
| C(C(=N)NC(=O)CO)O,0.2338 | |
| CC(O)C12CC1NC2=O,0.2527 | |
| COC(C#N)C(N)=NC,0.2413 | |
| Cc1nc2c(o1)cc[nH]2,0.1998 | |
| CC1(C)OC2C(O)C2O1,0.2963 | |
| CC#CC(CO)CC#N,0.2722 | |
| CC12C3C4C(C13)N24,0.282 | |
| CCC1OC(C)CC=C1,0.2652 | |
| CC1OC(C)(C)C2OC12,0.3385 | |
| CC1NC(=O)C(CO)=C1,0.2243 | |
| CN1CC(=O)CCC1=O,0.2147 | |
| C(C=O)NC(C=O)C=O,0.1899 | |
| C1CC1C1CC=CCO1,0.2668 | |
| CC1C(C#N)N1CCO,0.2636 | |
| N#CC1C2CC2N2CC12,0.2798 | |
| C1CC11C2C3CN2C13,0.311 | |
| CC12C3CC(=CC1=O)N23,0.1697 | |
| CC1C2N1C(C#N)C2=O,0.2153 | |
| CC(C)C1CO1,0.3501 | |
| CCC12OC1CC2OC,0.3193 | |
| c12c([nH]nn1)nc([nH]2)N,0.203 | |
| CC#CC#CC#CCO,0.1772 | |
| CC1OCC(CO)C1=O,0.2141 | |
| Cn1cncc1C(=O)N,0.2139 | |
| OCCC1(O)CNC1=O,0.2621 | |
| OC1C2OC1C2NC=O,0.2782 | |
| CCC1C(C#N)C2CN12,0.2727 | |
| N=COC(=O)COC=O,0.2435 | |
| CC1CC(O1)C(C)=O,0.2171 | |
| OC1C2OC1C2OC=O,0.2698 | |
| CC12CC(O)(C#N)C1O2,0.2785 | |
| OC1CC23NC4C2OC134,0.2643 | |
| C(=N)NC(=O)C(F)(F)F,0.2206 | |
| CC1C2C3CC1(O)CN23,0.289 | |
| CC(C)(C1CN1)C(N)=O,0.2637 | |
| OCC1C2N1CC21CN1,0.2941 | |
| C#CC(=O)N1CCCC1,0.2174 | |
| N#CCNC1C2CC1C2,0.2643 | |
| N=CN1CC(C=O)C1=O,0.2107 | |
| FC1=NC(=O)NC(=N)O1,0.2337 | |
| [O-]C(=O)C1C2C3[NH2+]C2C13,0.2647 | |
| NC1=NC=C(F)C(=N)O1,0.1779 | |
| CC12COC1C1CCC21,0.3043 | |
| N=C1CC2(CC2C#C)O1,0.2695 | |
| CN1CC11C=CCC1O,0.2352 | |
| CCC1=C(O)NC(=N)O1,0.2261 | |
| CC12CC(O1)(C=C2)C#C,0.2336 | |
| O=CC12CN(C1)CC2=O,0.1954 | |
| CC1=CC(O)CN1C=O,0.2114 | |
| OC1=NC=NC(=N)O1,0.1946 | |
| CC12CC1C1=CCOC21,0.2312 | |
| COC=NC1CC1C#N,0.2515 | |
| C#Cc1cc(co1)N,0.1814 | |
| CC1CCC2(CO)NC12,0.2967 | |
| C1CC23CC4CC2N4C13,0.2818 | |
| O=CC1CC2(CC12)C=O,0.2085 | |
| O=CC(C1CN1)C1CO1,0.1924 | |
| CC1OC2C3NC3C=C12,0.2308 | |
| CC(O)C1(CO)COC1,0.3008 | |
| O=CC1CC(=O)C11CC1,0.2182 | |
| CC(CC(C)=O)NC=O,0.2121 | |
| CC1(CO1)C1=NC=CO1,0.2335 | |
| ON=C1COCC(O)C1,0.2482 | |
| CC12CC1(OC2)C1CN1,0.2957 | |
| CCOC1COC1=O,0.2516 | |
| O=C1C2OC3C4C(C23)N14,0.2139 | |
| OCC12CN3C1C=CC23,0.2059 | |
| CC12CC1C(C)(C2)C#C,0.3013 | |
| CCC12OC1C1CCC21,0.3215 | |
| CCC1(O)C2OC1C2O,0.2873 | |
| CC1OCC(=N)OC1C,0.2742 | |
| CCC1C(CC)C1(C)O,0.3132 | |
| CC1=CC(O)C=CC=C1,0.184 | |
| COC(=O)C(N)CC#C,0.2493 | |
| Cc1c(nn(n1)C)OC,0.2255 | |
| OC1C2CC3N2C13C=O,0.2122 | |
| OCCCC12CC(C1)O2,0.3101 | |
| N=C1NC2(COC2)CO1,0.2891 | |
| CC1(C)C(O)C2OCC12,0.3013 | |
| Cc1[nH]c(c(n1)N)OC,0.2217 | |
| C1COCC2NC2C1,0.3178 | |
| CC(C)Cc1ccon1,0.2519 | |
| CC(=O)N1C=NOC1=N,0.202 | |
| CC1C(CC#N)N1C,0.2649 | |
| Cc1cnn[nH]1,0.2527 | |
| C#CCCc1ccoc1,0.2418 | |
| CC1(O)COC1C=O,0.2153 | |
| CC1OC2C(CO)CC12,0.3144 | |
| C1C2CC3CCCC2C13,0.3591 | |
| CC1NC11C=CCC1O,0.2401 | |
| CC1C(O)C2CC=CC12,0.2546 | |
| O=C1OCCC2CNC12,0.2406 | |
| CC1CCCC1(O)CO,0.3106 | |
| Cc1cc([nH]c1C#C)C,0.1955 | |
| C1C2CN=COC1C=C2,0.2379 | |
| C(CCO)CC#CC=O,0.2053 | |
| O=C1C2CC11NCC1N2,0.1924 | |
| CC1(C)C2C3NC3C12O,0.2723 | |
| CC12C3C4C1C4(C=O)C23,0.2079 | |
| CC(O)C1COC1C#N,0.2821 | |
| C#Cc1ncc(nn1)N,0.1673 | |
| c1[nH]c(c(n1)O)O,0.2198 | |
| CC1OC2(COC2)C1=O,0.2093 | |
| O=C1CN=C2NCC2N1,0.2441 | |
| C1CC1C#CCCO,0.2852 | |
| CCN=C1COC(=O)N1,0.2538 | |
| OC1C2C3CC3(C#N)C12,0.2941 | |
| CC1=CCN(C1)CC=O,0.1911 | |
| CC(=O)C1C2C3NC3C12,0.2275 | |
| CCCCC(C)(O)C#N,0.316 | |
| CC1=CC2OC3CC1C23,0.2353 | |
| CCC(=O)NCCOC,0.2784 | |
| CC1C2C3(C)CN1C23C,0.3039 | |
| CC1N=CN2CC12C=O,0.2176 | |
| Cn1c(ncn1)C=O,0.1938 | |
| CC(=NC)N1CCC1=O,0.2229 | |
| CC1COC2(CC12)C#C,0.2623 | |
| CC1CCC=C(C1)C=O,0.1981 | |
| O=C1CC2CC1C1NC21,0.221 | |
| CCC1(C)CC11CCC1,0.3288 | |
| OC1C=CC2CN3C2C13,0.2287 | |
| Cc1[nH]cc(n1)N(C)C,0.2111 | |
| CC1(COC1)C#N,0.2909 | |
| CC(CC#N)C(C)C#C,0.3068 | |
| CC(O)C(O)C#CC#N,0.2254 | |
| Cc1cnc(c(n1)F)F,0.2041 | |
| CC12CN3C(CC13C)C2,0.3028 | |
| CC(=O)C#CC=O,0.1958 | |
| CNC(=O)C#CC#N,0.1988 | |
| C#CC#CCOCCO,0.2212 | |
| CC1C=C(C)C(=O)C1C,0.1959 | |
| O=C(C#N)C12CC(C1)O2,0.1676 | |
| CC12CN3C4C3C1C4O2,0.2898 | |
| CC(CC=O)C(C)C#C,0.2285 | |
| C1CCOC(=NC1)C#N,0.2197 | |
| CC(C)C12CCCC1O2,0.3341 | |
| CC(CO)NC(=O)CO,0.2769 | |
| OC1CN=C2NC=NC12,0.225 | |
| CC(C)OC1CC1CO,0.3177 | |
| N#CC1C2OC1C21NC1,0.2851 | |
| C1NC23COC12CC=C3,0.2274 | |
| C1OC2C3CC12COC3,0.289 | |
| CNc1cc(=O)[nH]nc1,0.1724 | |
| O=C1CN2CC11NCC21,0.1941 | |
| O=C1CNCC1CC#N,0.2014 | |
| NC(CC#C)(C#C)C#N,0.2656 | |
| O=C(C#N)C1(CN1)C#N,0.1881 | |
| CCC12CC1(C)OC2,0.3029 | |
| c1c[nH]c2c1C(=O)CC2,0.2109 | |
| C1C=CNC(=O)N1,0.2248 | |
| CC(=O)COCCC=O,0.2111 | |
| CC(C#C)C#CC1CC1,0.2706 | |
| CC1C2C1C1OCC2O1,0.3385 | |
| OCCCC1OC1C#C,0.2807 | |
| CN=C1COC(=O)CN1,0.237 | |
| OC12CC3C1C2(O)C3=O,0.2414 | |
| CC1(CC1CC=O)C#C,0.217 | |
| CC(CO)C1NC1C=O,0.2211 | |
| CC(C)(C)CCC1CO1,0.337 | |
| CCC12CCC(O1)C2C,0.3244 | |
| COC1(C)C2CC1C=C2,0.2328 | |
| NC1=NCCOC1C#N,0.2454 | |
| CC12CN=COC1CN2,0.2459 | |
| CC1CCCC1=O,0.2218 | |
| CC1=NC(C)=NC(=N)N1,0.182 | |
| CCC(=O)CC1(C)CN1,0.2247 | |
| CCC12CC3C1C2C3=O,0.2444 | |
| C1CC12CC3(O2)COC3,0.298 | |
| c1cn2ccoc2n1,0.2228 | |
| O=CC1OCCNC1=O,0.2201 | |
| CN(C)C(=O)C(N)C#C,0.2576 | |
| CC12C=CCCC1C2O,0.2359 | |
| OCC(C=O)C(=O)C#C,0.1895 | |
| CC1CCC2CN2C1=O,0.2461 | |
| CN1C2C3CC2(C#C)C13,0.2419 | |
| Cn1cc(cn1)OC,0.2288 | |
| c1(=O)c(n[nH]nc1N)N,0.1479 | |
| COC12CC1COCC2,0.3272 | |
| CC12C3OC3C3C1CN23,0.2918 | |
| CC(=O)C1COC(=O)O1,0.2264 | |
| CCC1(CCC1)C#CC,0.2942 | |
| CC(C)C(C#C)C#N,0.2982 | |
| c1c(con1)OC=O,0.241 | |
| CCC#CC1OC1C#N,0.2534 | |
| CC1OC23CC(O)(C2)C13,0.2964 | |
| CC12CC3(CO)OC1C23,0.2941 | |
| [O-]C1=C(F)C=CNC1=[NH2+],0.1474 | |
| C#CC1CCCCCO1,0.2903 | |
| C1C2C3C=CC1C=CC23,0.2438 | |
| CC1(CCC(CC1)O)C,0.3315 | |
| CC(CCO)C1CC1O,0.3246 | |
| [NH3+]C1CC=C(C1)C([O-])=O,0.208 | |
| CC1=NC(CO)C(=O)N1,0.2318 | |
| NC1=NC(CO1)C1CC1,0.279 | |
| COCC(CO)C=O,0.2184 | |
| CN(C)c1cc([nH]c1)N,0.221 | |
| Cc1cc(=O)nc([nH]1)O,0.2109 | |
| COC1(C)C2CC1(O)C2,0.3319 | |
| CC1C2CN2C(=O)C1C,0.239 | |
| O=C1CC=CCN2CC12,0.2031 | |
| OC(C#N)C(=N)N1CC1,0.2541 | |
| C#CC1N=COC1C#N,0.2661 | |
| OC12CC1C1(O)CC21,0.2892 | |
| CC#CCCC(O)CO,0.2999 | |
| N=C1OC=C2C=CCN12,0.1555 | |
| Cn1cc(cc1C=O)O,0.1647 | |
| CCc1cc([nH]c1)NC,0.2355 | |
| CC(O)C(C)(C#N)C#N,0.2912 | |
| c1c(c(=O)nco1)F,0.2089 | |
| CCC(=O)c1conn1,0.2019 | |
| CC(C)C1(O)CCC=C1,0.2622 | |
| CC1C2COC(C#N)C12,0.2906 | |
| CC12OC3CC1OCC23,0.3208 | |
| N=C1OC2=C(COC2)O1,0.2436 | |
| OCC1NC(=O)C1CO,0.2807 | |
| CC1OC2(C)C3CC2C13,0.3322 | |
| OCC1OC(=N)C=C1,0.2128 | |
| NC1=C(F)C=NC(=N)O1,0.1573 | |
| CCC(C)NC=O,0.2828 | |
| C1C2COC3CC3CC12,0.3144 | |
| CC1=C(CC(=O)N1)CO,0.2087 | |
| c1c([nH]c(=O)[nH]1)OC=O,0.1903 | |
| C1CC2OCOC2C1,0.3254 | |
| Cc1ncnn1C(C)C,0.2638 | |
| CC1=CC(=O)C2(C)NC12,0.179 | |
| CC1COC(=O)CC1O,0.271 | |
| CC(C#N)C(O)C#C,0.2951 | |
| Cc1cc(=O)onc1F,0.1821 | |
| CC1OC2OC3CC2C13,0.3274 | |
| CCC(=O)C#CC1CN1,0.2021 | |
| CC(=NO)C1CC1(C)C,0.2395 | |
| CC1C2CN3C4C3C2C14,0.309 | |
| CC1(C)C2C3C1C(=O)N23,0.25 | |
| CCCOCCC1CC1,0.3399 | |
| COC1C2COCC1O2,0.3037 | |
| CC1(C)NC11CCC1O,0.2983 | |
| CCNC1CNC1C#N,0.2461 | |
| O=CC1OC1(C#C)C#N,0.208 | |
| N1C2C=CC3C4OC23C14,0.1725 | |
| c1cn[nH]c1CN2CC2,0.2582 | |
| C(CO)C(=O)NC(=N)N,0.2199 | |
| CC#CCOC(=O)CO,0.2722 | |
| C1OC2COC=NC12,0.2697 | |
| C1C2CC=CC3CC3C12,0.2348 | |
| COc1[nH]c(c(n1)O)N,0.2375 | |
| C#CC12OC3=NCC1C23,0.1614 | |
| COC(C)CC1OC1C,0.3352 | |
| CN1CC(=N)NC(=O)C1,0.2193 | |
| OC1CCN(C=O)C1=N,0.228 | |
| CCC(=N)NC=O,0.2322 | |
| O=CC#CC12CCC1N2,0.1985 | |
| CCC(O)C1=CCCC1,0.259 | |
| c1c2c(on1)NCC=C2,0.1799 | |
| O=CC12CNC1=NCC2,0.2048 | |
| O=C1OC2C3CC2C13,0.2666 | |
| CC1=NNC=NC1=N,0.19 | |
| OC(C#C)C1(CC1)C#N,0.2881 | |
| C1C(=O)CNCC1=O,0.1898 | |
| c1c(nco1)CO,0.2461 | |
| CCC(C)(C)C(C)O,0.3275 | |
| N=C1NC2=C(ON=N2)O1,0.1304 | |
| c1coc(=O)n1C(=N)N,0.2307 | |
| c1c(cnc(c1N)O)N,0.1798 | |
| COC1C2C3OC3C12C,0.2745 | |
| C1C2COC3(CCC3)C12,0.3258 | |
| CC1CC2C3CC3C=C12,0.2374 | |
| CC12CC=CC1N2,0.2339 | |
| CC(O)(C#C)C(O)CO,0.2934 | |
| CC12CC1C1CC1(C)C2,0.3377 | |
| COC(C(C)C)C(C)=O,0.2164 | |
| OC1CC(C2CC2)C1O,0.3029 | |
| CC(=O)C(CC#C)C=O,0.2026 | |
| CC(C)(C(=O)N)OC,0.2779 | |
| C#CC1CCCC1C#C,0.2972 | |
| CCOC1C2CN2C1=N,0.236 | |
| CC1(O)CC1(O)C1CC1,0.3115 | |
| CN(C)C12CC1CC2=O,0.1972 | |
| N=C1OC2C3NC2C3O1,0.2913 | |
| CCCC(=N)OCC=O,0.2299 | |
| CC12CC(=O)C=CC1O2,0.1819 | |
| C1CC12CC(=O)NC2,0.2743 | |
| CC1C2NC(C#N)C12N,0.2366 | |
| OC1=CNC=C1C1CO1,0.2306 | |
| N#CC12CNC3C1NC23,0.2598 | |
| CN1CC(=O)C1CC#C,0.203 | |
| OCCC12NC1CC2O,0.3041 | |
| CCOCC1NC1CO,0.323 | |
| C1CC1(CCCO)C=O,0.2332 | |
| CC12CC3(C)OC1C23C,0.3026 | |
| CCCCC1CN=CO1,0.2714 | |
| CC1(C)C2OC(=O)C12O,0.248 | |
| C#CC(=O)C1OCCO1,0.1781 | |
| COCC1CC(=O)C1C,0.2215 | |
| CC1CCN2CC12CO,0.3137 | |
| OC12CC(C1)C=CC2=O,0.1961 | |
| C(C(=O)C=O)NC(=O)N,0.1499 | |
| CN(C)c1cncnc1,0.1805 | |
| O=C1C=CC2OC3C2C13,0.1719 | |
| OC1C=C(C#N)C2NC12,0.2029 | |
| CC1C2C3CC4C3C1N24,0.3017 | |
| CC12CC3OC3C1C2O,0.2996 | |
| CC1C2C3CN3C12C#C,0.2386 | |
| CC1CC1C1(CO)CO1,0.3293 | |
| CCN=C(C=O)NC=O,0.1492 | |
| CC1CC2CCC2(O)C1,0.3193 | |
| O=CC12C3CC1N=CN23,0.2125 | |
| N=C1OC2C1NCC2=O,0.1961 | |
| OC1=CNN=C1OC=N,0.2183 | |
| CC1OCC2(C)CC12O,0.3184 | |
| CC1OC2CC1CO2,0.3318 | |
| c1ccnc(c1)N(=O)=O,0.1919 | |
| C1C(=O)CNC(=O)CN1,0.1921 | |
| CC1NC(=O)CC=C1C,0.2518 | |
| O=CC1C2CC2NC1=O,0.2192 | |
| O=CC12OCC3CC1C23,0.2135 | |
| N=C1CC=CC(O1)C#C,0.246 | |
| CC1C(C)N1C(C)=O,0.2559 | |
| CC1=C(F)C(=N)NC=N1,0.1824 | |
| CN1CC2OCC12C#N,0.2334 | |
| CCC(O)C1(CO1)C#C,0.278 | |
| CN1CC1C([NH3+])C([O-])=O,0.2549 | |
| CC#CC1(C)C(O)C1O,0.2658 | |
| CCC12NC1C(O)C=C2,0.2367 | |
| CC1CCNC(=O)C=C1,0.2117 | |
| CC(O)C1C(C)C1C#N,0.2969 | |
| CC(C)(C)C(C#C)C#N,0.2967 | |
| CC(C)C(CO)C#C,0.3139 | |
| O=C1CC2CC2C11CO1,0.2055 | |
| CC1CC1C1=CNC=N1,0.2465 | |
| O=CN1C2C3CCC2C13,0.2495 | |
| C1OC1C1C2C3CC3C12,0.2793 | |
| CC1(C#C)C2NC2C1=O,0.2085 | |
| Cc1cnc(cc1F)O,0.2167 | |
| CCOC(=N)C(=O)OC,0.2188 | |
| CC12C3C1C1(O)CC2C31,0.3022 | |
| CC1=CCN2CC(=O)C12,0.2017 | |
| CC12CCN1C=CC2=O,0.1828 | |
| CC(=O)C#CCC#C,0.2077 | |
| CCC1=CC2OC2CC1,0.2355 | |
| C#CC1CCC2CC1C2,0.3087 | |
| CCC1N=C(C)OC1=O,0.2469 | |
| COC(CO)C(F)(F)F,0.3367 | |
| CCC1(C)CC1CC#N,0.3181 | |
| C#CC12CN=C3CC1N23,0.1927 | |
| CC1=CCN(C1=O)C=O,0.1992 | |
| CC(O)C1=CC2CC2C1,0.242 | |
| O=CC12CC1N=CO2,0.2217 | |
| O=C1OCC2CNC1C2,0.2374 | |
| CC1CN(C(C)=O)C1=N,0.2347 | |
| OC1CC2CCOC2C1,0.3088 | |
| CC1=C(C)C2CC3C1N23,0.2188 | |
| CC1=CCN(C1)C(=O)N,0.2432 | |
| CC12CN1CC1NC21C,0.2889 | |
| CC(CO)C1CC=CC1,0.265 | |
| C1CC23CN4CC(C24)N13,0.2789 | |
| CC1(CC1)c2c[nH]nc2,0.2566 | |
| CC1(CC=O)OC2CC12,0.2191 | |
| O=CC1CC=CC2CN12,0.2058 | |
| COC(C)C(=O)CC#N,0.2304 | |
| CC#CCCC(=NO)C,0.2495 | |
| CCCCOC(C)CC,0.3334 | |
| CC12N=C(N)C3OC1C23,0.2252 | |
| CC1(CCO1)C1(O)CC1,0.309 | |
| CC1(C#N)C2C3NC3C12,0.2495 | |
| CCOCCOC(C)C,0.331 | |
| CC1OCC1OCC=O,0.2204 | |
| CC1CCC=CC1=O,0.1859 | |
| ON=C1CC2OC2C1O,0.2483 | |
| c1c[nH]c2c1oc(=O)o2,0.2286 | |
| C1OC1C1C2C3OC3C12,0.2835 | |
| N=COCC1=NC=NO1,0.2327 | |
| CC12CN3C(CC1=O)C23,0.2168 | |
| CC1C=CC(=O)C1O,0.1935 | |
| OC1CC(OC1=O)C#C,0.2719 | |
| CN=COC1COC1,0.274 | |
| CC1N2C3C(C2=O)C13O,0.2394 | |
| CC1C[NH2+]C1C([O-])=O,0.2621 | |
| O=C1NCC23CC(C2)C13,0.2609 | |
| O=C1NCC=CC2NC12,0.2264 | |
| CCC(=O)CC,0.2356 | |
| C1C23CCCC12C=CC3,0.2455 | |
| CCC1NCC1(O)C#N,0.2551 | |
| O=C1C=CC23CC12OC3,0.1803 | |
| O=CC1=CCCC2NC12,0.1888 | |
| CC12NCC1=CCC2=O,0.2099 | |
| CC1=CC2(CN2)CC1,0.2359 | |
| CC(O)C(C)C1CCO1,0.3132 | |
| NC1=COC(=O)NC1=N,0.184 | |
| COCC(OC)C1CN1,0.3222 | |
| CCC12C(C)C1OC2=N,0.277 | |
| CC(C1CO1)C1OC1C,0.3418 | |
| CC1OCC(NC=O)=C1,0.2118 | |
| O=CCOC12CC(C1)C2,0.2292 | |
| CC1N2CC(O)C12C,0.2859 | |
| ON=C1C2C3CC1C23O,0.2481 | |
| OC12C3OC1C1(CC1)C23,0.2946 | |
| c1cncc(=O)nc1N,0.1627 | |
| CC1(C(=O)OCCO1)C,0.2605 | |
| OC1CC1(O)CC1CN1,0.2904 | |
| c1coc(=O)o1,0.2556 | |
| OC12COCC1OC2=O,0.2581 | |
| C1CC1(C#N)C(=O)C=O,0.1554 | |
| O=C1C=C2NCC3C1C23,0.1775 | |
| CCn1ncc(n1)OC,0.2285 | |
| O=C1CCC11OCC=C1,0.1918 | |
| COC1CC11C2CC1C2,0.3301 | |
| FC1=CNC=CC1=N,0.1882 | |
| OC1CCC23CC12OC3,0.2803 | |
| O=C1C2CC2C2OCC12,0.2157 | |
| CN1C=CC(=O)[CH-]C1=[NH2+],0.2016 | |
| Cn1c2c(cn1)nn[nH]2,0.2245 | |
| c1c(nn[nH]1)CC2CC2,0.2507 | |
| CCNC(=N)C(=O)OC,0.1891 | |
| COC12CC1C(C)=CC2,0.2475 | |
| CCC(C#C)C1CCC1,0.3112 | |
| O=CC(CC#N)C1CN1,0.2132 | |
| CC1C2OCC2C1C#N,0.2791 | |
| CC1(CN=CN1C=O)C,0.223 | |
| N=COCC12CC1OC2,0.2637 | |
| Cc1c[nH]nc1C,0.2603 | |
| O=CC1COC2(CC2)C1,0.221 | |
| CCC1(CO)OC1C#N,0.2751 | |
| CC12CCC1C(C2)=NO,0.2452 | |
| CC1=CC2CN2CC1O,0.2284 | |
| c1cnc(cc1N)F,0.225 | |
| CC1(CO)NCC1C#N,0.2633 | |
| C1NC1C1OC11COC1,0.316 | |
| C#CCC1C2CCC1O2,0.297 | |
| [NH3+]C(CC1CC1)C([O-])=O,0.2674 | |
| O=CNC1CC=CC1,0.2634 | |
| CN1C2(C)CCC12C#C,0.2679 | |
| c1c[nH]c2c1CCC2=O,0.1963 | |
| c1nc(c(o1)N)CCO,0.2189 | |
| CC1C2C(CC1=O)N2C,0.2104 | |
| OCC1OCCC1C=O,0.2226 | |
| [NH3+]C(C1CCO1)C([O-])=O,0.2665 | |
| CC(C)C(=O)C(=O)C=O,0.1339 | |
| CCc1coc(n1)C#N,0.2016 | |
| O=C1CC2C1C21CCC1,0.2291 | |
| C1CNc2c1nn[nH]2,0.2176 | |
| C1=CNC(=O)C(=O)C1=O,0.1234 | |
| NC1=NC2C(O)C2OC1,0.2297 | |
| CC(=O)CC(C)(C)C#C,0.2286 | |
| CC1C2(C)CC1(O)C2=O,0.2424 | |
| CC1C2COCC12C#C,0.285 | |
| CCOc1cnccn1,0.1989 | |
| OC1=NON=C1OC=N,0.2204 | |
| CC1COC(OC1)C#C,0.2985 | |
| [O-]C(=O)C1CC=CC[NH2+]1,0.2596 | |
| CC1(C)OC1(C)C#C,0.2845 | |
| CC1(O)CC1(C=O)C#C,0.2099 | |
| CCC(O)(CO)COC,0.3231 | |
| CCC12COC1CC2O,0.3099 | |
| CC1=C(F)C(=N)N=NN1,0.1695 | |
| C(C=O)NC(=O)CO,0.2194 | |
| CC1=NCC(CC=O)O1,0.2202 | |
| COC1(CCC1)CCO,0.3243 | |
| CC(=O)CNC(=O)C#C,0.2256 | |
| CC1C=CC2(CC12)C#C,0.2366 | |
| C(c1c(nc([nH]1)N)O)O,0.2181 | |
| NC1=CC(=O)N2CC12,0.2055 | |
| CC(C)(O)C(CO)C#N,0.2944 | |
| CCC(C)(C)CCC#C,0.3156 | |
| CCN=c1[nH]c(no1)O,0.246 | |
| CCC(=O)OC1COC1,0.2623 | |
| CC1COC2=C1NN=N2,0.2102 | |
| O=C1NCC2OCC2=C1,0.2062 | |
| C1CC12C=CCO2,0.2267 | |
| C#CC1OCC=CCO1,0.2629 | |
| CC1CC1C1(C)CO1,0.3333 | |
| CC(=O)C(O)CC=O,0.211 | |
| O=CC1C2CC1CCC2,0.2233 | |
| CC1(C#N)C(N)C1CO,0.2755 | |
| C1CC2(C1)CC(=O)C2,0.2207 | |
| CC12OCC1OCC2O,0.294 | |
| C1CC(O1)C1=CC=NO1,0.2313 | |
| CCC1(N)CC1(N)C#N,0.2646 | |
| OCC1C=CC(O)C1O,0.2545 | |
| Cc1c(ncnc1O)O,0.2298 | |
| CC1C2(C)CC1(C)OC2,0.309 | |
| CC1COC2C3OC2C13,0.3017 | |
| Cn1nc2c(n1)NCC2,0.2035 | |
| C1C2OCC3(CCO3)C12,0.2981 | |
| CC1CC=CCOC=N1,0.2519 | |
| CC1CC2(O)CC2C=C1,0.2505 | |
| c1nc(c(o1)NC=N)N,0.2033 | |
| CN=C1OC=CC(O)=C1,0.1653 | |
| OC1CC(=O)C2CC12O,0.2264 | |
| Cc1cc(c(nc1)C)C,0.2223 | |
| Cc1c2c(no1)COC2,0.2331 | |
| CCc1ccc(nc1)O,0.2065 | |
| CC1CC2C1NC2=O,0.2729 | |
| CC1OCCC=CC1=O,0.1817 | |
| CC(=O)C1OC2CCC12,0.2188 | |
| CC1CC(CO)OCO1,0.3481 | |
| C1OC2OC3C1C3C=C2,0.2372 | |
| CC1NC2=CC(=O)CC12,0.2064 | |
| CC(CCC#C)C(N)=O,0.2731 | |
| C#CCOC=NCC#N,0.2723 | |
| O=C1NC2CC1C=C2,0.2161 | |
| CCC1(O)C(N)C1C#N,0.2682 | |
| CC(C)C1OCOC1=N,0.2859 | |
| ON=C1COC(C1)C=O,0.2159 | |
| COC1C2OC2(C)C1O,0.3115 | |
| CC1=CCc2c1n[nH]c2,0.2101 | |
| CC1(C)C2C3C2C(=O)C13,0.2439 | |
| CCn1nccn1,0.2576 | |
| COCCCO,0.3295 | |
| c1cc(c(c(c1)F)N)F,0.2161 | |
| CC(C=O)C1OCC1O,0.2225 | |
| Cc1c(c(co1)OC)O,0.2282 | |
| CC1CC2OC1CC2C,0.3277 | |
| C1OC(=O)C(C(=O)O1)N,0.2451 | |
| Cn1c(cc(n1)O)C#C,0.1991 | |
| O=CC12CC3CC1CN23,0.2018 | |
| C1OC23CC=CC2OC13,0.2407 | |
| NC12C3OC1CC23C#N,0.2525 | |
| c1c(onc1O)CC=O,0.2117 | |
| C#CCCCC=O,0.2274 | |
| c1nc(n(n1)C(=O)N)N,0.2156 | |
| OC1CC23CCC2(C1)N3,0.2787 | |
| N=C1CC(C=O)N1C=O,0.2077 | |
| CCC1OC(=N)C11CN1,0.2708 | |
| CNC(C#N)C1CC1,0.2779 | |
| OCC12CC1(CC2)C#N,0.2782 | |
| CCc1c(nn[nH]1)C,0.2434 | |
| c1nc(c(o1)N)N(=O)=O,0.1711 | |
| NC1=C(C[NH3+])C([O-])=CO1,0.2171 | |
| O=CC1(OCC=C1)C#N,0.207 | |
| COCC(O)C#CCO,0.2844 | |
| c1(nc(no1)O)C(=O)N,0.2104 | |
| CC1NC(=O)NC1=N,0.2573 | |
| CC12OCOC1CC=C2,0.2607 | |
| CCC1C(OC)C1C#N,0.288 | |
| C1CC1OC(CO)CO,0.318 | |
| CC1CC1(NC=O)C=O,0.2205 | |
| CC1C2CC(CC12)C#C,0.31 | |
| CC1(C)C2CCCC12C,0.3249 | |
| CC12C3C4C3C1C4C2O,0.314 | |
| N=C1ON=C(O1)N(=O)=O,0.1626 | |
| C1C2CCC3=CCOC123,0.2253 | |
| CC1NC1C1(CO)CO1,0.3181 | |
| OC1C(O)C1OC=O,0.2596 | |
| OC1CC2OC12CC#N,0.2885 | |
| CC1C2CC11CN(C)C21,0.2812 | |
| CCNC(C)(CC)C#N,0.2728 | |
| CC12CCC1(O2)C1CO1,0.3048 | |
| C1C23CCC12OCC3,0.2937 | |
| CC1CC2(COC2)C1O,0.2957 | |
| N#CC1CCCN1,0.2769 | |
| CC#CC1OC=NC1C,0.2665 | |
| CCC1C2OCOC1C2,0.3235 | |
| CC1CC2(O)CC12CO,0.3168 | |
| CC1C=CCOCC=C1,0.2464 | |
| CCC(O)C1CC1(C)C,0.3273 | |
| OC12CC(C1)OCC=C2,0.246 | |
| CNC1=C(C)OC(=N)O1,0.2345 | |
| CC12CCC1(CO)OC2,0.3005 | |
| Cc1c(nn[nH]1)C(=O)C,0.2087 | |
| OC1CC2CC(=O)OC12,0.2807 | |
| N=C1N=CNN=C1C#C,0.1646 | |
| CN(C)C1C2OC=NC12,0.2374 | |
| CCC(C)(NC=O)C#C,0.2741 | |
| COC1OC2CC2C1C,0.3224 | |
| CC1OCC11OC1C#C,0.2642 | |
| CC1OCC2OC2C=C1,0.2383 | |
| OC1CC2=CCCC12O,0.242 | |
| CC12CC(O)C1C(O)C2,0.2964 | |
| CC1CC11COC1=N,0.2809 | |
| O=CC1C2OC3CC3C12,0.2107 | |
| CC12CC(=O)NC1C2O,0.2661 | |
| CNC1=CC(=O)CC1O,0.2031 | |
| CC1CN1C1=NNN=C1,0.2173 | |
| Cn1cnc(n1)N(C)C,0.2133 | |
| CCOC1(CC1)C#CC,0.2744 | |
| CC1CC(C=O)C(C)=C1,0.2128 | |
| CC1N=COC1=O,0.2455 | |
| NC(CCOC=N)C#N,0.2834 | |
| OCC1NC(=N)NC1=O,0.2304 | |
| OC1=C(F)C=CC(=N)O1,0.1567 | |
| c1c[nH]c2c1nc([nH]2)O,0.2262 | |
| CCC12CC1(N)C(=N)O2,0.2601 | |
| N=C1OCC2=CN=NN12,0.2326 | |
| Cc1ccnc(n1)C=O,0.1786 | |
| OCC1CC2NC12,0.3082 | |
| CC12CCC(C)(CC1)O2,0.3224 | |
| CCC1CC(=O)C1C#N,0.2222 | |
| CC1C2OC11CN(C)C21,0.2646 | |
| COc1c[nH]c(n1)CO,0.2211 | |
| CC1(O)C2CN2C1C#C,0.256 | |
| CC1CCCC1CCO,0.3355 | |
| CN=CN(C)C(=O)C=O,0.1642 | |
| CN1C2CC1(CO)C2O,0.2766 | |
| CN(C)C(=O)CC1CO1,0.2694 | |
| CN1C(C#C)C11CCC1,0.2552 | |
| CCC1(O)CC1(O)CC,0.3135 | |
| COC(=O)C(C)C1CC1,0.2784 | |
| C(c1[nH]c(c(n1)O)N)O,0.2214 | |
| CN1CCc2c1cn[nH]2,0.2068 | |
| OCC1C2CCC2C1=O,0.2138 | |
| C1CN1C1CC2(CO2)C1,0.3021 | |
| CC1(CC1C#N)OC=N,0.2783 | |
| CC12CC1C1CC2(O)C1,0.3132 | |
| O=C1CC2OCCC2N1,0.2717 | |
| ON=C1C2NC2CC1=O,0.1705 | |
| CCN=CNC(=N)C=O,0.1559 | |
| Cc1ncc(o1)N,0.2217 | |
| C1C=CC2(O1)CC(=O)C2,0.2089 | |
| Cc1c[nH]c(c1C)C,0.241 | |
| CC1=COC(=C1)C1CO1,0.2225 | |
| CCn1cnc(c1C)N,0.2181 | |
| C1OC2=NCCCOC12,0.2648 | |
| C1OC1C1OCC11CO1,0.3115 | |
| COC1C=CCOC1=N,0.2467 | |
| N#CC1(C#N)C2CCN12,0.25 | |
| CC1OC2C(O)C12CO,0.2962 | |
| OCC(C=O)C(=O)CO,0.2098 | |
| CC12C3CC1C3CC2=O,0.2219 | |
| CCCC(OC)C1CC1,0.3373 | |
| CC1(CC1)c2[nH]ncn2,0.2573 | |
| C[NH2+]CC1=CC([O-])=CO1,0.0805 | |
| NC(=N)N1CC(O)C1=O,0.2172 | |
| OCC12CCC1C(O)C2,0.3157 | |
| CC1=CCC(=O)C2OC12,0.2071 | |
| CC(C1CO1)C1CC1C,0.3422 | |
| C1OC1C1CC11COC1,0.3103 | |
| CC1NC(C)C(=O)C1=O,0.1404 | |
| CC(=O)OCC1CCC1,0.2844 | |
| CNC(=O)NC(=O)OC,0.2731 | |
| c1cnc(cn1)CO,0.1971 | |
| CC1(C)C2OC2C1(C)O,0.3121 | |
| CC1OC2C3OC1C23C,0.2843 | |
| CC1CC([NH2+]1)C([O-])=O,0.2641 | |
| CCC1(CC1)C(=O)CO,0.2396 | |
| CC1=CCCCOC1,0.2501 | |
| OCC1(O)C=CC2OC12,0.2417 | |
| C1CC1(C#N)C(=O)CO,0.2322 | |
| CC12CC3C1C2C3C=O,0.2207 | |
| OC12CC3C(CC13)OC2,0.3051 | |
| CC#CC(=O)C#CC,0.1869 | |
| CCCNC(=O)CC=O,0.2212 | |
| CCc1cnncn1,0.1659 | |
| CC1C2C3N2C1C3=O,0.2328 | |
| C(#CC#N)C#CC(=O)N,0.173 | |
| c1nnn(n1)C2CCC2,0.2609 | |
| C1C2OC3C=CC1C23,0.2338 | |
| CC1(O)CC2OC2C1O,0.3181 | |
| CC12CC(C1)C2(C)C#N,0.3235 | |
| OC1CC11C2NC1C2O,0.3138 | |
| NC(=O)C12COCC1N2,0.2607 | |
| CC(C)OCC1COC1,0.3235 | |
| CC#Cc1c[nH]cc1O,0.2122 | |
| N=C1CC(O1)C1CCO1,0.2847 | |
| CC1=CCC2(C)CC12,0.2468 | |
| CC(O)(C=O)C(O)CO,0.2185 | |
| OC1CC11COCC1=O,0.2166 | |
| OC1CCC11CN1C=O,0.2503 | |
| CC1(CN1C1CC1)C=O,0.2181 | |
| C1CC(=O)CN=COC1,0.2146 | |
| CC12CN3C4C(OC14)C23,0.2864 | |
| OC1CCC1(O)CC#C,0.2861 | |
| C1OC=NC2C3OC3C12,0.2686 | |
| COC1C=CC2CC1C2,0.2492 | |
| NC1=CC=C(N1)C1CO1,0.2191 | |
| COCC(=NCC#N)N,0.2592 | |
| CNC(=O)c1c[nH]cn1,0.2351 | |
| CC1N2CC2CC11CC1,0.3134 | |
| C1C=CN2C1=CCC2=O,0.1907 | |
| c1ccc(cc1)CC#N,0.2416 | |
| CC(O)C1(CCC1)C=O,0.218 | |
| OC1CN2N=CC=C12,0.2616 | |
| COC1CC(C)=CC1O,0.2594 | |
| C1CC2CCOC2C1,0.3179 | |
| CC1(CC(C1O)(C)C)C,0.3079 | |
| CC#Cc1c(nco1)C,0.1974 | |
| N#CC1C2OC1C21CC1,0.2783 | |
| CC12CC1(CC2)C1CO1,0.3223 | |
| COC(=O)C(C)OC=O,0.2646 | |
| CC(C)CC(C)OC=O,0.2837 | |
| CC1CCC2(CO2)CO1,0.3213 | |
| CC(O)CCCC#N,0.3147 | |
| C1CC(=O)CNCC=C1,0.1955 | |
| CC1C2CCC1O2,0.3301 | |
| C1CC1N=COCC#N,0.2438 | |
| COC(C=O)(C#C)C#C,0.2169 | |
| CC1(O)CC(=O)C11CC1,0.2169 | |
| CC1OC1C1(CN1)C#N,0.2871 | |
| OC1C2C3NC3C2C1=O,0.195 | |
| CCN1CC1CC(C)=O,0.2082 | |
| CC(NC=O)C(O)C#C,0.2649 | |
| COC1C2C3CC2(O)C13,0.3177 | |
| CC1N(C)CC1(O)C=O,0.194 | |
| CC#CC(O)C(F)(F)F,0.292 | |
| CNc1c([nH]cn1)O,0.2386 | |
| OC1CC2C3CC=C1C23,0.2191 | |
| CN1N=COC(=O)C1=N,0.1744 | |
| CCC1(CN2CC12)C=O,0.2124 | |
| CC12OC(=N)C1C2O,0.2658 | |
| CC(CO)C=O,0.2304 | |
| CN1C=NC2=C1ON=N2,0.1414 | |
| CC1CC=CC1C,0.2637 | |
| C(CO)C(=O)C(=O)C#N,0.1501 | |
| OCC1CN=C(N1)C#N,0.1986 | |
| C1CC23CC(C=C2)N13,0.2177 | |
| O=C1C2CN2CC2NC12,0.2075 | |
| C#CCCC(=O)CC=O,0.2094 | |
| OC(C#C)C1CC1C#N,0.2927 | |
| OC1CC1CCNC=O,0.2835 | |
| NC(=O)C1CC(O1)C#C,0.2484 | |
| CC1COCCCOC1,0.3143 | |
| CC(C=O)C1=CN=NO1,0.2063 | |
| CC(C)C1(C)OC1C=O,0.2151 | |
| CCOCCC(N)C#N,0.283 | |
| c1c(c(=O)nn[nH]1)N,0.1696 | |
| CCC1(CC1C)C(N)=O,0.2742 | |
| CC(C)COCC#N,0.2926 | |
| CC1CC1(C)CC=O,0.2227 | |
| OC1C(CC11CN1)C#N,0.2832 | |
| OC1C2C3CC3C(O)C12,0.2816 | |
| CN=C1OC=CC=N1,0.1628 | |
| O=C1CC2(C1)C1CC2C1,0.219 | |
| CN=C1OC(C)C1N,0.265 | |
| CCC1(C)OC1C#N,0.2918 | |
| C#CC1C2C3CN1C23,0.2569 | |
| OC12CC=CC3CC1C23,0.2554 | |
| CCC(C)C1COCO1,0.3284 | |
| Cn1nc(nn1)NC=O,0.2246 | |
| O=C1NC2CCC(C2)N1,0.2936 | |
| CC1C2C3CC=C1C23O,0.1768 | |
| C1CC11CC2C=CCC12,0.2607 | |
| COC(=O)COC(=O)N,0.2829 | |
| CC1CC23COC2CN13,0.2787 | |
| CN(C)C1C2OC1C2=O,0.2157 | |
| CCC1(CO1)CC,0.3484 | |
| CCc1c(cco1)C#N,0.2172 | |
| OC1C=CC2N=COC12,0.2546 | |
| c1nc(nc(n1)F)CO,0.2082 | |
| OCC12COC1C(=O)O2,0.2457 | |
| C1C2CC3C1C=CC3O2,0.2393 | |
| N#CC1CC2NC12C#N,0.26 | |
| N#CC1CC2OC2CO1,0.2922 | |
| c1cc(=O)cc(nc1)O,0.1403 | |
| OCC1=CC2CN2CC1,0.2333 | |
| COC1C2C(C)C1C2=O,0.2415 | |
| C1CN1C1C2COC12,0.284 | |
| CC12C3CC(C)(C1O)N23,0.3056 | |
| CC1(O)C2CC3CC1C23,0.3258 | |
| CC(C)(CCCOC)O,0.3133 | |
| OC1CC(O)C(C=O)=C1,0.1855 | |
| OC12CN3CC1CC23,0.2933 | |
| C1COC(=O)OCC1=O,0.2235 | |
| CN=C1OCC1CC=O,0.2237 | |
| CC1CC2(C)C(O)C2O1,0.3091 | |
| CNc1ncc(o1)C#N,0.1902 | |
| COC1C=CCC1(C)C,0.2621 | |
| c1c[nH]cc1CCC=O,0.1937 | |
| O=C1CCC2(NC12)C#C,0.206 | |
| C1CC1C(=O)C#CCO,0.2075 | |
| C1CC1C1OCCC=C1,0.266 | |
| OCC1=CC2C3OC2C13,0.2241 | |
| CC(=O)C(=O)C(O)CO,0.159 | |
| CCc1cc(on1)OC,0.2391 | |
| COC1C(=O)CC1(C)C,0.2027 | |
| C1CC2OC=NCC2O1,0.2702 | |
| CC1=CC(=O)C2CN2C1,0.1834 | |
| COC1CCC2NC12,0.3074 | |
| CC(C)OC(CO)CO,0.3184 | |
| C1NC1C1OCCO1,0.3291 | |
| C#CC1C2CC3CC3C12,0.2788 | |
| CCC(C)C(C)(O)CC,0.3255 | |
| CCC(NC)(C=O)C#N,0.2159 | |
| CC1C2C3N1C2C31CO1,0.3065 | |
| CC(C)OC1CN2CC12,0.3037 | |
| COC1C2CC1C2CO,0.3194 | |
| O=CC(=O)C1CN2CC12,0.14 | |
| CC#CC1(CC(=O)C1)O,0.2172 | |
| CCC(=O)C1CC1(C)O,0.2298 | |
| COC1CC=CC11CN1,0.2434 | |
| OCC1=CC2(O)CC2C1,0.2438 | |
| CCNC(=O)CC(=O)C,0.2118 | |
| CCC1=CC(CC1)OC,0.2576 | |
| OC1C2CC2(C=O)C1=O,0.1949 | |
| C[NH+]=CN(C)CC([O-])=O,0.2466 | |
| CC1(CC(C1)(C)OC)C,0.3187 | |
| CC1(CCN=CO1)C#C,0.2694 | |
| OC12C=CC3C4C1C2N34,0.2329 | |
| CC12CC1(O)COC2=O,0.2702 | |
| CN(CCC=O)C=O,0.212 | |
| CC1(C)C2C3C=CC1C23,0.2323 | |
| COc1cc[nH]c(=O)n1,0.1982 | |
| OCC1CC=CC1O,0.262 | |
| CN(C)CC(=O)CC=O,0.2023 | |
| CC(=O)Cc1ccoc1,0.2127 | |
| CC(O)C1CC1N1CC1,0.307 | |
| C1CC1N(C=N)C(=O)N,0.2403 | |
| CCC1(CC1)COC,0.3309 | |
| CC(C)N=CNC(=O)C,0.2286 | |
| NCC1(CC(=N)O1)C#N,0.2596 | |
| CC(=N)OC(=O)C1CC1,0.2414 | |
| NC1=NC2CC1(O)C=C2,0.2123 | |
| Cn1cnc2c1c[nH]n2,0.21 | |
| CNC(C#N)C(O)CO,0.2809 | |
| CC1CC(C)C=CC=C1,0.1884 | |
| CC12OC3CCC1C23,0.309 | |
| CC1CCC2C1C2(C)C,0.331 | |
| CC(O)C(O)C(O)C#C,0.2761 | |
| OCC12CC(C1)C2O,0.3125 | |
| CCC#CC(C)(O)C#N,0.2743 | |
| COC(=O)NC(C)CO,0.3062 | |
| O=CC1OCC(O1)C#N,0.211 | |
| Cc1c(con1)CC#C,0.2505 | |
| CC1C=CC2C1C2(C)O,0.2362 | |
| CCC1(O)CC2OC12,0.3144 | |
| CC(=O)C1C2NC2C1O,0.2256 | |
| CC(CO)C(=O)OC=N,0.2498 | |
| C1CNc2c1c(no2)O,0.2276 | |
| CN1CC(N=C1N)C#N,0.2547 | |
| C#CCCc1[nH]ccn1,0.2493 | |
| OC1CCCC11COC1,0.2961 | |
| CC(C)C1OC1(C)C#N,0.2988 | |
| OC1C=CC(C=O)C1O,0.21 | |
| O=CNCC1C2CCN12,0.2559 | |
| CC1(C#N)C2NC2C1=O,0.2129 | |
| CN=COC(C)C1CC1,0.2737 | |
| CC1CC2(O)C(C=O)C12,0.2158 | |
| CCCC1=CCOCC1,0.2591 | |
| CC(=N)OC1=NNN=N1,0.2546 | |
| COC(CN)(C#C)C#N,0.2384 | |
| OCC1(CO1)C(=O)C#N,0.1903 | |
| Cc1cccn1CC#N,0.2191 | |
| CCC(C)C1(CO1)C=O,0.2202 | |
| N#CC1C2C3CC2N13,0.2645 | |
| CC12NC(C=C1)C2=O,0.246 | |
| CC12NC(C1C#N)C2=O,0.2471 | |
| CNC(=O)C1OCC1C,0.2643 | |
| CC12CC1(O)C1OC21,0.3099 | |
| C1CC2=CCC3OC23C1,0.24 | |
| CN1CCN=C1C#N,0.1873 | |
| O=C(CC1CO1)C#N,0.1954 | |
| OC1CC2OC2C2NC12,0.3071 | |
| C1OCC23NC12C1OC31,0.3079 | |
| C1CC(=CC(=O)OC1)N,0.2033 | |
| CC12C3C=CC1C=CC23,0.2342 | |
| C1CC23CC1CCC2O3,0.3293 | |
| CC1CN2CC2CC1O,0.2723 | |
| CCc1c(n[nH]n1)OC,0.2313 | |
| C1C2CCC11C=CCC21,0.2493 | |
| CC(=O)CC#C,0.2275 | |
| OC1CC11COCCO1,0.3068 | |
| CCC1(C=CCO1)CC,0.2481 | |
| CCN1CC(C)OC1=O,0.301 | |
| COC(=O)n1cccn1,0.2301 | |
| Cc1c(cccn1)N,0.1998 | |
| OC1C2CC3CCC2C13,0.3325 | |
| OCCC1C2C3CC2N13,0.308 | |
| C(CNC(=N)C=O)C=O,0.1735 | |
| Cc1cnn2c1NCC2,0.2337 | |
| N#CC1C2OC2C2CN12,0.2701 | |
| CCOCC(=O)N,0.2737 | |
| C(=O)C(=O)N(C=N)C=N,0.159 | |
| [NH3+]C(CO)CCC([O-])=O,0.2722 | |
| CC1=CC(=O)CC2OC12,0.1837 | |
| OCC1CC(=O)CCO1,0.2239 | |
| CC12COC(C1)C(=O)C2,0.2091 | |
| OCC12CC(C1)C21CN1,0.3033 | |
| C1OC1C12OC1CC=C2,0.247 | |
| Cc1c[nH]nn1,0.2526 | |
| C1CN1C12CC1OCC2,0.2966 | |
| NC(C#N)C(CO)C#N,0.2889 | |
| CC1(OCCC1O)C#N,0.297 | |
| CC12COC1C(O)C2O,0.2844 | |
| CC1CC11OCC1=NO,0.2242 | |
| COC1C2C3OC3C12,0.2738 | |
| CC1=C2CCC2OC1,0.2342 | |
| O=CC1C2C3C4C2C1N34,0.2058 | |
| N=C1CNCCOCO1,0.245 | |
| OCC1C=CCOC1=N,0.2468 | |
| CC12C3N4C1C2(C)C34C,0.2754 | |
| CC(C)(O)C1CCO1,0.3246 | |
| O=C1C2C3CC1CN23,0.2187 | |
| N#CC1CN2C=CC=C12,0.2342 | |
| CC1COCC=C1C#N,0.2221 | |
| Cn1ccnc1C#C,0.2029 | |
| Cc1cnn(c1)CCO,0.2519 | |
| Cc1cnc(o1)CC#N,0.2334 | |
| CCN1C2CC1C2=NO,0.2518 | |
| COC1CCOCC1=O,0.2024 | |
| CC(C)C(C)(C)C1CO1,0.3399 | |
| COC1(C)CCC1C#C,0.2948 | |
| OC1CCC2(CO2)C1=O,0.206 | |
| CC1CC2(C)OCCC12,0.3139 | |
| CC1(CO1)C1CC2OC12,0.3269 | |
| CC1C2OCC(=O)C12C,0.2187 | |
| CC1CC2C3CC1C23C,0.3241 | |
| CC(C)(O)C(C)(O)CO,0.3102 | |
| CNC(=O)N1CC=CC1,0.2373 | |
| CC1C2CC1CC=CC2,0.2709 | |
| CC1C2C3CC2C13,0.3808 | |
| CC1CC2=C(C)COC12,0.2335 | |
| c1c[nH]c(c1C(=O)N)N,0.1975 | |
| OC12CC1(C=O)C=CC2,0.2044 | |
| CN=C1OC2CC12,0.2724 | |
| OC1COC=NC1C#C,0.2646 | |
| CC(=O)N1CCCC1=N,0.2267 | |
| Cc1c(ncnc1C)C,0.2162 | |
| CC(C)CC1(C)CO1,0.3401 | |
| CCC1OC1C(N)C#N,0.2953 | |
| OC1=CC(=NN1)C1CO1,0.2435 | |
| CC1CC(O)C2(CC2)O1,0.29 | |
| CCC1N(CC1=O)C=O,0.2147 | |
| C1C2C3C4CN2C13C=C4,0.2337 | |
| COCC(C)C(O)C#C,0.2819 | |
| CC1CC23CCC2(C1)O3,0.326 | |
| CNC(=O)CC1CCO1,0.2716 | |
| NC1=CC(=O)C2COC12,0.2023 | |
| CC1CC(CO)O1,0.322 | |
| C#CC1CN2CC(C2)O1,0.2483 | |
| CC1NC1C(C#C)C#C,0.2861 | |
| NC1=C(NC=C1)C1CN1,0.2214 | |
| Cc1cc(n(n1)C)O,0.2557 | |
| C1NC11C2OC1C=C2,0.2318 | |
| CC1CC2(CC2)C(=O)N1,0.2725 | |
| CC1(OC2CC12)C#N,0.2729 | |
| CCC(=O)NC=N,0.2432 | |
| CC1C2NC2C1(O)C=O,0.2008 | |
| COC=Nc1cnno1,0.1845 | |
| OC1CC=CCCC1=O,0.2139 | |
| NC(=O)C1CC2CCC12,0.2691 | |
| OC1CN2C=NC=C2C1,0.2491 | |
| CC1NC(CC1=O)C#C,0.2205 | |
| CCCC(C)C1CN1C,0.3019 | |
| N=C1NCC2=C1N=NO2,0.1635 | |
| c1c(nc[nH]1)OCC=O,0.184 | |
| CN=CN(C)C(=N)C=O,0.1482 | |
| CC1C2CC3C(C1O)N23,0.2888 | |
| N=COCC1CC(=N)O1,0.2783 | |
| CC#CC1CN1CCO,0.2621 | |
| CCC1C2CC1(C2)C#N,0.3272 | |
| C#CCC(CC#N)C#C,0.2871 | |
| CC1C2OC3C(O2)C13O,0.2881 | |
| CC1=CN=C(OC=N)O1,0.2203 | |
| C1CC1C12CC1C1OC21,0.2824 | |
| CC12CC(CO)C1CO2,0.3111 | |
| CC1(CO)OC2CC1C2,0.3248 | |
| CC1(CO1)C12CN(C1)C2,0.3043 | |
| CN1CC23CC1C2CO3,0.2616 | |
| OC1C2CC2C11CO1,0.307 | |
| O=CC12NCC3C1NC23,0.1994 | |
| CCC12CC1C1(C)CC21,0.287 | |
| CC(C)(C1(CC1)CO)O,0.3289 | |
| CC12NC3C(C1O)C23O,0.2776 | |
| C1NC11C=CCC11CO1,0.245 | |
| COC1C(O)C11COC1,0.2935 | |
| CCC12C(O)C1C1OC21,0.2804 | |
| CC1(CCCCC1)CO,0.3354 | |
| OC1CCC2(CO2)C1O,0.3044 | |
| C(C(CO)NC(=O)N)O,0.2962 | |
| COC1COC(C1)C#N,0.2862 | |
| c1c(c(n[nH]1)O)C2CC2,0.2338 | |
| c1cnnc(n1)CC=O,0.1643 | |
| Cc1cnc(cn1)NC,0.1741 | |
| O=CC(C#N)C1CO1,0.2225 | |
| OC12CC1N1CC=CC21,0.2223 | |
| CCC(=O)C(O)C(C)C,0.2382 | |
| CC1C2C3C4C1C2C34O,0.3057 | |
| CC1C(C)(O)C1(C)CO,0.3033 | |
| CC12C3CC1(OC23)C=O,0.1989 | |
| COCC1(CN1C)C=O,0.2114 | |
| O=CCC12C3CC1CC23,0.2176 | |
| C1CN1CC2=CCOC2,0.244 | |
| CC1COCOCCO1,0.3329 | |
| CC1=C(COCC1)C,0.2553 | |
| CC(C)C1C2C3OC1C23,0.3036 | |
| C1CC2(C1)CC1OC21,0.3318 | |
| CNC12CNC1C2C#N,0.2662 | |
| CC1C2CCC22OCC12,0.3021 | |
| C1C2C1C1OCCOC21,0.314 | |
| CCC(OC=N)C#C,0.2826 | |
| CCC1(OCC1=O)C#N,0.2205 | |
| CC12CC1C1(CC1)C2O,0.3153 | |
| CC1(CO)NC1C1CO1,0.2981 | |
| CC12C=CCC1CC2O,0.2504 | |
| CC1(C#N)C2CCCN12,0.2754 | |
| OC1CCNC(=O)C=C1,0.2068 | |
| OCC1OCC11CCC1,0.3038 | |
| C#CC1CC1CC1CC1,0.2901 | |
| C1C2C=CC11N=COC21,0.2304 | |
| CC(C)C(=O)CC#C,0.2294 | |
| c1c(c(ncn1)CO)N,0.1872 | |
| CCCc1[nH]nc(n1)O,0.246 | |
| C1C(N=CO1)(C=O)C=O,0.1853 | |
| CC1CC2C3CC1C2O3,0.3203 | |
| CC1CCC2(NC12)C#C,0.2673 | |
| CC1CC11C2OC2C1C,0.3331 | |
| OC12CCC1OCC=C2,0.2376 | |
| CC1(C)C2CC1COC2,0.3185 | |
| C1OC2C3NC3C2=C1,0.2247 | |
| OCC1(CC2NC12)C=O,0.2058 | |
| CC1(O)CC(=O)NC1=O,0.234 | |
| CC(CC#C)C1CC1,0.3131 | |
| CC1OC11CC2NC12C,0.3044 | |
| CC1CC=CC=CC1C,0.1906 | |
| COC1CC2C1C2(C)O,0.3121 | |
| CC1(CC2(CC2)O1)C#N,0.262 | |
| CC1=CCC2CCC1C2,0.2576 | |
| C1C2NC2C11CC2OC12,0.3103 | |
| CC#CC1(O)CC1O,0.2649 | |
| NC12CC1CC2(N)C#N,0.2676 | |
| O=CNC(C#N)C1CO1,0.2763 | |
| CCNC(=O)C#CCO,0.2344 | |
| O=C1CC2CCC(=O)N12,0.2317 | |
| CC(C)n1c(ncn1)O,0.2663 | |
| CC(N=COC=O)C#N,0.2448 | |
| OC1CCCC=C1C=O,0.1919 | |
| CC(O)C(=O)NCC#C,0.2709 | |
| CC(=O)c1c[nH]cc1N,0.1636 | |
| CC(=O)C1CN1,0.2334 | |
| CN=C1OCC1C(C)=O,0.2271 | |
| C#CC#Cc1ccco1,0.1672 | |
| O=CC(NCC#C)C#N,0.2093 | |
| CN1C2CC2C1C#N,0.2417 | |
| N1C2C3OC2C2OC3C12,0.2606 | |
| CCCC(O)C(C)(C)O,0.3121 | |
| O=CC1CC2NC12C#N,0.2094 | |
| O=C1CNC2C3CC12N3,0.2048 | |
| CCC(=O)NC(=N)CO,0.2451 | |
| CC(COCC#N)C#C,0.2783 | |
| C1C2CC3OCC3=CC12,0.2445 | |
| CCCCC1CC1(C)O,0.3242 | |
| CC12COC3C4C3C1C24,0.2865 | |
| O=C1CC2CNC12C#C,0.2004 | |
| CC1(C)CCC(N1)C#N,0.2702 | |
| OCC1CC(=O)N1,0.2787 | |
| O=CC1C2CC1COC2,0.2223 | |
| OC1CC2C3C2C(=O)C13,0.2343 | |
| C(CCO)CNC=O,0.2824 | |
| [O-]C(=O)C1C2C3[NH2+]C1C23,0.2567 | |
| CC1(CC1)CC(=O)NC,0.2721 | |
| CC1OC(=O)CC=C1C,0.2571 | |
| Cn1cnc(n1)CO,0.2566 | |
| O=CC12COC1COC2,0.2211 | |
| CCC1=CC2CC1(O)C2,0.2354 | |
| C#CC12CC3CC1C3O2,0.2656 | |
| c1cnn2c1NC(=O)C2,0.2093 | |
| CC1C2CC(=O)C12C#N,0.229 | |
| OC1C2OC3OCC2C13,0.3312 | |
| C1OC2CC1OC=NC2,0.2608 | |
| COc1ccncc1F,0.2297 | |
| CN1C=COC(=N)C1=O,0.1778 | |
| N=C1OC2CC1C1NC21,0.2783 | |
| CN=c1cccc(o1)N,0.1618 | |
| CC12C3C(O)C1C(=O)N23,0.2449 | |
| CCC#CC1OC1C=O,0.2139 | |
| CC1(CO)OCC11CN1,0.3023 | |
| C1CN1C1CC11COC1,0.2965 | |
| CC1OC(=N)C2CC1O2,0.269 | |
| COC1(CC1)C#CC#N,0.2164 | |
| C1CC2=CC3COC3C12,0.2432 | |
| CC1=CC(=O)OCC1,0.2184 | |
| O=CC1OC=NC1C#C,0.2198 | |
| CC1C=CCC2(C)CC12,0.2634 | |
| COC1C2CCC1N2C,0.3005 | |
| CC12CC(C#C)C1CO2,0.2853 | |
| C1C2OC3C4C3C2C14,0.3099 | |
| COC(=O)C(N)CCO,0.238 | |
| CC(CC#N)(C#C)C#C,0.2858 | |
| CN=C1OCC1C(C)C,0.2788 | |
| CC1C2CC1C2NC=O,0.2761 | |
| CC1(O)CC2CC12C#N,0.2846 | |
| C(COC=O)COC=O,0.2846 | |
| N=C1OCC2NC1C2=O,0.2198 | |
| OC1CC23CC12CCC3,0.2993 | |
| OC1C(=N)OCC11CC1,0.288 | |
| c1c([nH]c(n1)NC=O)O,0.1855 | |
| CCCC1=COC(=N)N1,0.2227 | |
| CC(N)C1(CN1C)C#N,0.2716 | |
| CC12OC3(C)C1OC23C,0.307 | |
| COCC#CC#CC=O,0.1789 | |
| C#CCC(C#C)C1CC1,0.3029 | |
| OC12CCC1CCOC2,0.3179 | |
| NC(=O)C1COCC=C1,0.2437 | |
| COCC12CC1CC=C2,0.2469 | |
| CCC1OC1C1(C)CN1,0.3184 | |
| O=C1CCC(N1)C1CO1,0.2736 | |
| CCCCOC(=O)C,0.2849 | |
| OCC1C2CC1C1CC21,0.3259 | |
| CC1OC2C(=N)NC12C,0.2519 | |
| OC1COC2CC2C1,0.2963 | |
| CC12CC(CO)(CC1)O2,0.3216 | |
| CCNC(=[NH2+])C([O-])=O,0.1978 | |
| OC1C(CC1=O)OC=O,0.2162 | |
| COC1(C)C=CCC1=O,0.216 | |
| NC1C2OC=NC12C#N,0.2308 | |
| CC(O)C(O)C1(O)CC1,0.3035 | |
| CC1=CCC2CCC=C12,0.1966 | |
| c1c([nH]c(n1)CC=O)O,0.1584 | |
| CC(C)c1[nH]cc(n1)O,0.2278 | |
| CC1C2CCC12C=O,0.2255 | |
| CC1C2C=CC11CCN21,0.2153 | |
| O=CCC1OCC2CC12,0.226 | |
| CC1OC(=O)C=CC1O,0.2124 | |
| CCN1CC1C1COC1,0.3059 | |
| OC1(C#C)C2C3CN3C12,0.2495 | |
| N#CC1OC1CN1CC1,0.2424 | |
| CC1(OCC(=O)O1)C#C,0.275 | |
| O=C1OC2(CC12)C1CN1,0.2459 | |
| OC1CN2CC(C#C)C12,0.2639 | |
| CCOCCCCCO,0.3284 | |
| OCC1C2CC2N2CC12,0.2971 | |
| OC1CC2=CCCCC12,0.2572 | |
| C#CC1=CCC2COC12,0.2086 | |
| C1COc2c1nc(o2)O,0.2263 | |
| CC12CC3C(O1)C23C#N,0.2611 | |
| Cc1cc(c(cn1)F)N,0.2182 | |
| OC12COC(C1)C=CC2,0.247 | |
| C1C2CC3CCCC12O3,0.317 | |
| CC1CC11OCC(C)=C1,0.2258 | |
| Cn1ccnc1N(C)C,0.2355 | |
| C1C2CCC3OCC12O3,0.3214 | |
| NC(=O)CC(=O)OC=N,0.2156 | |
| CCC(=O)OCC=O,0.2289 | |
| OCC1CN2C=CN=C12,0.2498 | |
| OC1CC1C1CC(=N)O1,0.2569 | |
| OC12CC3CCC1CC23,0.3247 | |
| C1CC1OCC2COC2,0.3303 | |
| CC1C2OCC22COC12,0.3034 | |
| c1c(ocn1)C#CC=O,0.1666 | |
| OC12C3NC1C3C2C#N,0.2773 | |
| CC1=NCC(CC#C)O1,0.2711 | |
| C1CC23CC4CC(C12)N34,0.2956 | |
| Cc1cc(=O)[nH]nc1N,0.1606 | |
| CC1OC2C3OC3C=C12,0.2308 | |
| COC1CCOC(C)C1,0.3318 | |
| N=C(CN1CC1)OC=O,0.2315 | |
| Cc1ccc(nc1)C=O,0.18 | |
| CCOC=NCC1CO1,0.267 | |
| CC(C)C1(C)CC2NC12,0.3079 | |
| OC1CC1C(=O)CC=O,0.2059 | |
| CN=C1NN=CC=N1,0.1386 | |
| OCC12OC1CC21CC1,0.3037 | |
| CC1=CC(=O)CNC1,0.1669 | |
| C1C2NC3C2N=COC13,0.2386 | |
| OC1CC1N1CC1,0.3086 | |
| CCOC(C)(C)CO,0.317 | |
| CC1C2C3N1C2C3=O,0.2345 | |
| CCC(C#C)(C#N)C#N,0.2923 | |
| COC(=O)C1(CC1)CO,0.2698 | |
| CC1C2C3CN2C13C#C,0.254 | |
| CCc1ccc(cn1)C,0.2218 | |
| FC1=NC(=N)OC(=O)O1,0.2423 | |
| C1C(CO1)(CC=O)C#N,0.2188 | |
| OC(COC=N)CC#C,0.2765 | |
| OC(CC#C)C1CC1O,0.2698 | |
| O=C1NC2CC2C11CN1,0.2593 | |
| CC1OC1CC1CC1,0.3515 | |
| CC1C(O)C(=O)C11CO1,0.1871 | |
| CCCCOCCOC,0.3363 | |
| OC1CC2C3OC1OC23,0.3104 | |
| CC12CC3C(CC13O)O2,0.3068 | |
| OCC1CC11CNC1=O,0.2794 | |
| c1ncnc(n1)N2CC2,0.212 | |
| CC12C=CC3C(C=C1)N23,0.2105 | |
| CC12C3CN1CC2OC3,0.2911 | |
| OC1=NC(F)=NC(=N)N1,0.2048 | |
| CCC(=O)C1(CC)CO1,0.2228 | |
| CC(C)(C)C(=NO)C#C,0.2063 | |
| CC(=O)C(CO)C1CC1,0.2241 | |
| C#CC12CC3(CO3)C1N2,0.2755 | |
| CC1=CCCC2OC2C1,0.2555 | |
| CC1(O)COCC1CO,0.3072 | |
| c1coc(n1)C2CCC2,0.2393 | |
| OCC12CC1C1CN21,0.2859 | |
| CC1CC2C(=N)OC12C,0.2843 | |
| CC1=CCCCN1C=O,0.2155 | |
| OC1C2CC(CC#N)C12,0.3044 | |
| N#CC1CC2CC(C2)C1,0.3333 | |
| CC(C)C1CC(=O)O1,0.2853 | |
| COCCc1[nH]ncn1,0.2694 | |
| C1OC11CC2C3CC1C23,0.3366 | |
| c1c(cn(n1)CCO)N,0.2193 | |
| CC1C2C(=O)OCC12O,0.2646 | |
| CCn1cc(c(n1)O)C,0.2386 | |
| O=CNC1C2CC(=O)C12,0.2277 | |
| O1C=C2C=NC=C2N=N1,0.1556 | |
| CC1C=CCOC1CO,0.2671 | |
| CC1C(N)C1(N)C#N,0.2565 | |
| CCCC#CCC(C)O,0.2933 | |
| CC1NC11C2CC1(O)C2,0.3036 | |
| N#CCC1CC=CC1,0.2662 | |
| C1C=C(C(=O)O1)CCO,0.2211 | |
| COCCC(O)C1CC1,0.3223 | |
| NC(C=O)=NC1CC1O,0.1764 | |
| CC(=O)N(C)C,0.2696 | |
| CC#CCCC1CC1,0.3044 | |
| CC1C=CCC1(C)C,0.2642 | |
| O=C1NCC1C1CCO1,0.2741 | |
| CC1CC2COC2C1O,0.2946 | |
| CC12CC1(CC#C)OC2,0.2777 | |
| CC12CC(C=C1)C=CC2,0.2354 | |
| CCCC1(C)C2CC1C2,0.3638 | |
| OC1C2CC(C#N)C1O2,0.2988 | |
| OC12C3CC1NC23C#C,0.2454 | |
| CCC(O)C1C2CC1C2,0.3342 | |
| CC1(C)COC(C1)C#N,0.2935 | |
| CC1CC2CCC1(O)C2,0.3208 | |
| C#CCC1CO1,0.3095 | |
| CC1(C)OC1(C)CC=O,0.2234 | |
| O=C1CC23OC4C2NC134,0.1744 | |
| c1cc(c(=O)oc1)N,0.1632 | |
| CC1(O)C2CC1(O)C2,0.3165 | |
| CC1OCOC2C(O)C12,0.3076 | |
| CNC1=NC(=N)N=NN1,0.1771 | |
| CC1C2(C)NC1(C)C2=O,0.2449 | |
| CC12CC3C(C1)C3C2O,0.3233 | |
| c1c(non1)COC=O,0.24 | |
| Cn1cncc1C#N,0.2151 | |
| c1c(c[nH]c1NC=O)N,0.1806 | |
| FC1=CC(=N)C=NN1,0.176 | |
| COC1C2C(C)N2C1=N,0.2369 | |
| O=COC1CC=CC1,0.2647 | |
| CC1C(O)C2C(C#C)N12,0.2618 | |
| CC1(COC(O1)(C)C)C,0.3219 | |
| CC1OC2CC2C(C)=C1,0.2453 | |
| CC12CCC1=CCCO2,0.2496 | |
| Cc1cc(c[nH]1)C(C)C,0.2415 | |
| CC(=O)C1OCCC1O,0.2077 | |
| COC12CC1N1CC21,0.29 | |
| CCC1=C(COC1)C=O,0.1824 | |
| C1OCC23C=CCC2C13,0.2388 | |
| Cc1cc(cc(n1)N)F,0.209 | |
| C#CC1=CC2COC2C1,0.2077 | |
| CC1CC2OCC12O,0.304 | |
| OCC1C=CCC1C#C,0.263 | |
| CC1CC2C(CCO)C12,0.3247 | |
| CC(CCO)C(O)C#N,0.285 | |
| CC12C3C1C1=CC3CC21,0.1963 | |
| N=C1CN=CNC(=O)O1,0.2416 | |
| CNC1=CC(=O)NC1,0.2159 | |
| CC1C2C3C(CO)C1N23,0.3029 | |
| CC(O)COCC(N)=O,0.2803 | |
| OC1C2C=CCC12O,0.2315 | |
| CC1=CC(CO)N2CC12,0.2342 | |
| OCC1NCC1=NO,0.2363 | |
| CCCNC(=O)C(=O)N,0.2111 | |
| CC12COC1C2N1CC1,0.2816 | |
| O=C1C2CC1C=CC=C2,0.1617 | |
| OC12CC1C(=O)C(=O)C2,0.1507 | |
| C1CC2CCCC2C1,0.3707 | |
| CC(=O)C1C2CC2C1=O,0.2151 | |
| CC1CCC2(CO)CN12,0.3052 | |
| CC(=O)C(=NC)NC,0.1798 | |
| CC1(COC1=O)C1CC1,0.2797 | |
| Cc1c(c(=O)nco1)N,0.1799 | |
| c1cc(c(cc1F)F)N,0.1984 | |
| CC12NC1C1C2NC1=O,0.2545 | |
| CCC12CC1OC2(C)C,0.2985 | |
| CC1C2C3OC2C(O)C13,0.3079 | |
| C1CC(=O)C(=O)NC=C1,0.1756 | |
| CCCC1(O)CC1CO,0.3225 | |
| C1CC(C1)n2nnnn2,0.2698 | |
| CNc1c([nH]c(=O)o1)O,0.2263 | |
| OC1CC=C2CCC=C12,0.1948 | |
| N#CCC1OC11CCC1,0.3076 | |
| CC1C2CC(=CC12)C#C,0.1979 | |
| CC(C)CCCCC#C,0.3164 | |
| CC(=O)C1=CN(CC1)C,0.1713 | |
| CC(=NO)c1ccc[nH]1,0.1775 | |
| CCCC1OC1CCO,0.3378 | |
| CC1OC(C2CC2)C1=O,0.2172 | |
| O=C1OC2C3CCC3C12,0.2746 | |
| OC1=CN=CC(=N)N1,0.1587 | |
| NC(=O)C1C(O)C1CO,0.2528 | |
| CCC1C2C(=O)CC12C,0.2297 | |
| CCC(C)OCC1CN1,0.3212 | |
| C#CC1C2C3OC3CN12,0.2518 | |
| C1OC2CCN3C1C3C2,0.2945 | |
| C#CCC1OCC=C1,0.2437 | |
| OCC12CC3C4C1N4C23,0.2925 | |
| O=CC12CN3CC(N1)C23,0.1715 | |
| CN=C1NC(CO1)C=O,0.1815 | |
| CCNC(=O)OC(C)C,0.3129 | |
| CC1NC(=O)C2COC12,0.2657 | |
| O=C1CCNCC11CN1,0.2124 | |
| OC1CC=CC(O)C1,0.2591 | |
| OC1CC(=O)C=CC1O,0.1893 | |
| N=C1OCC2CC(=O)C12,0.2135 | |
| CC1OC(=O)NC2CC12,0.2899 | |
| Cc1ccc(c(c1)N)O,0.2007 | |
| CC1C2OC1(C=O)C=C2,0.2128 | |
| O=CC1CC=C(C1)C=O,0.1895 | |
| CCOC(=NC)C1CC1,0.2719 | |
| CC(C)(C#N)C(=O)C#N,0.2071 | |
| CC(C)N1CC(=O)C1C,0.2076 | |
| COc1cc(n[nH]1)C#N,0.2183 | |
| CC1C2C3CC(C23)C1C,0.3283 | |
| CCC(O)C1COC1C,0.3047 | |
| C1C(CO1)OC2COC2,0.3085 | |
| CC(=O)N1CC12CCC2,0.2532 | |
| C(C(=O)NC(=O)CO)N,0.2165 | |
| CC1CN=C(O1)C1CC1,0.26 | |
| CCC1OC(C=C1)=NC,0.2008 | |
| CCc1c(cc[nH]1)C#N,0.2224 | |
| CN(CC1CC1O)C=O,0.2727 | |
| CC1N2CC(C2)OC1=N,0.2457 | |
| c1c[nH]c2c1CCN2,0.2252 | |
| CC1CC=CC1C1CC1,0.2634 | |
| CCC1OC2CC2C1C,0.3058 | |
| C1C=C(CO1)C(F)(F)F,0.2351 | |
| CC(OC=O)C1CC1O,0.2799 | |
| N=C1OC2C(NC12)C#N,0.252 | |
| C1CC11C2C3CCC1N23,0.309 | |
| CC(CC(C)=O)OC=O,0.2337 | |
| O=CC1=NCC2CCN12,0.1646 | |
| OCC1C2C3CC=C1C23,0.1793 | |
| C1CC(C1)COC(=O)N,0.3231 | |
| CC1C2C(=O)NCC12C,0.2669 | |
| CC1(O)C(CO)C1C#N,0.2877 | |
| [NH3+]CCC1CC1C([O-])=O,0.2495 | |
| CCC#CCOCC#C,0.2638 | |
| C#CC(C#C)(C#N)O,0.2584 | |
| C1C2OCC3=CCCC123,0.2314 | |
| Cc1cccc(c1)C=O,0.1918 | |
| CC#CCC1(C)CO1,0.2991 | |
| OC1CC1(C#C)C#N,0.2657 | |
| CC#CC(C=O)C(C)C,0.2157 | |
| Cc1c(c(n[nH]1)CO)N,0.2151 | |
| CC1(OC1C(N)=O)C#N,0.2451 | |
| CCC(C)C(CO)C#C,0.3031 | |
| NC1=NC(=N)C(N)=CO1,0.193 | |
| CC(=NCC=O)OC,0.2229 | |
| O=CC1C2CC3CC2C13,0.2207 | |
| CC1(CCC(=O)O1)C#N,0.277 | |
| CC1C(C=O)C2NC12C,0.2043 | |
| CC12CC(C)(O1)C1OC21,0.3213 | |
| CC1=CC(=O)C(=O)NC1,0.1647 | |
| OCC1(OCC1=O)C=O,0.1906 | |
| CC12CC34CCN(C13)C24,0.3019 | |
| O=CCOC1CCC=C1,0.2271 | |
| COC(C=O)C(C)=O,0.1936 | |
| OCC1CC(=O)OCO1,0.2692 | |
| CC12CN3CC1OC2C3,0.2862 | |
| CC12NC3C1N(C=O)C23,0.2514 | |
| CC(C#C)C1=NNC=N1,0.2601 | |
| CC1CC2(C)CCOC12,0.317 | |
| N#CC1CNCCO1,0.2473 | |
| CC(=N)OC1=CON=N1,0.2169 | |
| OC1CC2C1COC2=N,0.2777 | |
| CC1OC2(CCC2)C1O,0.3005 | |
| CC(C)(O)C1(CO)CO1,0.3341 | |
| Cc1cc(no1)CC#N,0.2439 | |
| CC1CCC(O)C2CN12,0.2871 | |
| OC12CNC1C2OC=N,0.2593 | |
| CC(C)C(C=O)C#N,0.2232 | |
| OCC1=CC2CC1C2O,0.2393 | |
| CCC1(C)CC=CC1=O,0.1885 | |
| C1C2C3C=CCC1C23,0.2472 | |
| COC(C)C1C2CC1C2,0.3347 | |
| c1c([nH]c(=O)[nH]1)CO,0.2335 | |
| OC1CC=C(C1)C#N,0.2226 | |
| CC1(O)CCC(C1)=NO,0.2502 | |
| CN1C2CCOC(=O)C12,0.2363 | |
| C(CO)C#CC#CC#N,0.1926 | |
| CC(C#N)N1C2CC1C2,0.2708 | |
| O=C1NCC11CCC=C1,0.2448 | |
| CC(=NO)c1ccn[nH]1,0.1891 | |
| COC1CC2(CC12)C#C,0.2713 | |
| Cc1cc(=O)nc(o1)O,0.212 | |
| CC1CC(C)(O1)C1CC1,0.3223 | |
| CNc1cc(n[nH]1)C#C,0.2081 | |
| CCOC1(C)COC1C,0.3178 | |
| C#CC1=CC(=O)OCC1,0.1875 | |
| COCCC(OC)C#C,0.2863 | |
| CC1(C=O)C(O)C1C#C,0.2209 | |
| Cc1cc(=O)cc([nH]1)O,0.2048 | |
| CCCC(C)CC,0.383 | |
| CC1C(OC1=N)C#C,0.2756 | |
| OC1CC2(CN2)CC=C1,0.254 | |
| OCC1CC2C3C1CN23,0.2959 | |
| CN1CC11C=CC2NC12,0.2164 | |
| Cc1c([nH]c(=O)[nH]1)CO,0.219 | |
| OCC12CC3C1C=CC23,0.2253 | |
| CC#CC1(C)CCCO1,0.2942 | |
| O=CC1OC11CC2CC12,0.2176 | |
| COc1cc(on1)C=O,0.1857 | |
| CC12CN1CC1CC2O1,0.3009 | |
| NC1=C(N)C(=N)OC=C1,0.158 | |
| COC1CC11CCO1,0.2842 | |
| N#CC12CCC1OCC2,0.2924 | |
| c1nc(c(o1)N2CC2)O,0.2092 | |
| CC1C(=O)NCC1(C)C,0.2727 | |
| C#CC1C2CC(C#C)C12,0.2798 | |
| N#CCCC12CC1OC2,0.278 | |
| CCOC1C2C3CN2C13,0.3057 | |
| NC1=CC(=N)NC(F)=N1,0.1867 | |
| CCC12CC1C(O)CO2,0.295 | |
| CCC12CC(=O)CC1N2,0.2226 | |
| CN=C1CCCN1C=O,0.2304 | |
| CC12NC3C1OC2C3O,0.2847 | |
| C1CC1C12C3CC1OC23,0.3111 | |
| CC1C=C2CN3C1C23C,0.173 | |
| Cn1cc(cc1O)CO,0.2352 | |
| O=CC12CCC(=O)C1N2,0.2041 | |
| CC(C)(C=O)NCC#N,0.2193 | |
| CC12C3CN(C13)C2(C)C,0.3041 | |
| N#CC1C2NC1C2C#N,0.2762 | |
| Cn1c(nc(=O)nn1)O,0.1728 | |
| c1c(c(on1)N)NC=O,0.2132 | |
| CC(O)CC1=NNN=C1,0.2566 | |
| CCCCOC(C)C#N,0.2965 | |
| CCCC1CC(C)C1=O,0.2177 | |
| CC(CO)C#CCO,0.2852 | |
| O=C1CC2(CC2C#N)N1,0.2792 | |
| CC12C=CCC1CC=C2,0.2465 | |
| c1coc(c1C2CC2)N,0.2197 | |
| CCCCCC1OC1C,0.3476 | |
| CCC12CC1(C)OC2C,0.3015 | |
| CCC1NCC(=O)C1=O,0.1249 | |
| CC1C2(O)CC(O)C12O,0.2883 | |
| CC1=COC(=C1)C1CN1,0.2199 | |
| N#CC12C3C4C3C1C24,0.2577 | |
| CC12CC3C4C3C1C24,0.3054 | |
| c1c(c(c([nH]1)O)O)C=O,0.1783 | |
| CC1CCC(C)C(O)C1,0.3314 | |
| OC1C2C3CN2CC13O,0.2728 | |
| CC1(O)C2CC1OCO2,0.3144 | |
| COC1C2OC1C2=O,0.2373 | |
| CC(C)C1C(C)C1C=O,0.2246 | |
| CC#CCc1c[nH]nn1,0.2473 | |
| CC1(O)C(OC1=N)C=O,0.2032 | |
| OC12CC3C4C1C2C34O,0.289 | |
| CC1C=C2C3C4C2C1N34,0.1612 | |
| CC(C([O-])=O)C(C)(C)[NH3+],0.2765 | |
| NC(CC#N)C(F)(F)F,0.2911 | |
| Cc1cc(=O)cc(o1)F,0.2031 | |
| c1cc(n(c1)C(=O)N)O,0.1802 | |
| O=C1C=C(C#N)C2NC12,0.1568 | |
| C1COC(=O)CNC1=O,0.2493 | |
| C1C2C3CCCOC2C13,0.3278 | |
| OCC12NC1C1CC21O,0.2661 | |
| CC1=NC2CC2C(=O)N1,0.2276 | |
| CC1CC11CCCC1C,0.3373 | |
| NC1=NCCC1(N)C#N,0.2371 | |
| C1CC23C=CC4C2N4C13,0.2271 | |
| CC12CC3OC1C2O3,0.3305 | |
| CC1=CC2OC2C=CC1,0.2268 | |
| OC12C3OC(C13)C2C=O,0.2042 | |
| CC1C2C3CC3C12C=O,0.2037 | |
| OC1C2CN=CN2C1=N,0.2326 | |
| CC1(CO)C2C3OC1C23,0.2982 | |
| CN=C1OC2CC1(O)C2,0.2791 | |
| CC1(C)CCCOC1=N,0.2774 | |
| CN=C1OCC(C)C1=O,0.1839 | |
| CC12C3C4N1CC2C34O,0.2798 | |
| OCCC12CCC1CC2,0.3362 | |
| CC1OC2CC3OC2C13,0.3132 | |
| CC1(C)CC(=O)C1CO,0.2201 | |
| c1c(c(n[nH]1)CCO)O,0.2282 | |
| NC1=COC([O-])=C1C[NH3+],0.1345 | |
| CCC(O)(CO)C#CC,0.2798 | |
| CNC(CO)C(F)(F)F,0.3017 | |
| OC12CCCC1OC2=N,0.284 | |
| O=C1OC2C3OC2C3O1,0.2935 | |
| Cc1cc(oc1)CC=O,0.1924 | |
| CC1CC2OC3C2C13,0.3085 | |
| CN1C=C(N)C(=N)N=N1,0.1604 | |
| c1cc([nH]c1)OCCO,0.2427 | |
| O=CC1CC2OC12,0.2163 | |
| CC(C#N)N1C=CC=C1,0.232 | |
| CC(C)OCCC1CO1,0.3361 | |
| COC1(CC1)C(=O)N,0.2663 | |
| CC12C3CC1C(C)(C)N23,0.3187 | |
| CCc1ccccn1,0.2276 | |
| C1OCC23OC(C=C2)C13,0.232 | |
| c1c2c([nH]n1)COCC2,0.2511 | |
| CCC(O)C=O,0.2365 | |
| CNC(=NC1CC1)C#N,0.1886 | |
| O=CC1CCC=CCC1,0.22 | |
| Cc1ncc(n1C=O)N,0.152 | |
| OC1C2COCOC12,0.3096 | |
| C1COCCC1CC#N,0.2906 | |
| CC(C)C1NC1(C)CO,0.3035 | |
| C#CC#CC#C,0.19 | |
| C1OC2C3C4OC(C34)C12,0.2992 | |
| CC1CNC=CC1=O,0.19 | |
| C1CCN(CC1)C(=O)N,0.2863 | |
| CC1(CC1C1CO1)C=O,0.2318 | |
| CC1CCC(=O)OC1=N,0.2568 | |
| CCC(C)C1C2CCC12,0.3303 | |
| CCC1=CC2NC2CC1,0.2371 | |
| N=C1OCC(CC#C)=C1,0.2137 | |
| OC1C2OC2C2CC1O2,0.2994 | |
| OC12CC1(CC#C)CC2,0.2998 | |
| OCCC1=CCC2OC12,0.2429 | |
| NC(=O)C1CC1(N)C#N,0.2376 | |
| CC1(CC2CC2)CC1O,0.3288 | |
| CC1C2C3OC1C23C#C,0.2562 | |
| CC(CO)(C#C)C#C,0.2925 | |
| CCC1CC2(CC12)C#N,0.2878 | |
| CC1(O)C2(O)CC1(O)C2,0.3064 | |
| CCC1C(C#C)N1CC,0.2561 | |
| CN(C=N)c1ncno1,0.2201 | |
| CN=C1OC2CNC12,0.2554 | |
| c1cnn(n1)CC#N,0.2559 | |
| O=C1COC(O1)C1CN1,0.2537 | |
| OCC(O)CNC=O,0.2814 | |
| CCCC12CC1(O)CC2,0.3194 | |
| OC12CCCC1C=CC2,0.2661 | |
| CC(=O)C1COC1C#C,0.2293 | |
| CC(CCO)(C#C)C#C,0.2926 | |
| C1C=Cn2c1nc(n2)N,0.1802 | |
| C1CC2COC3C1C3C2,0.2995 | |
| CC(C)C(OC=N)C#C,0.282 | |
| CC12C(O)C1CC1CN21,0.2859 | |
| CCC(C)OC=NC,0.2738 | |
| O=C1NC2C1COC2=O,0.25 | |
| CC1C=CC23CC(C2)C13,0.2486 | |
| COCC(=O)CNC=O,0.2141 | |
| CN1C(COC1=N)C=O,0.189 | |
| CCCC(C)(C)C#C,0.319 | |
| CC#CC1CC(O)C1=O,0.2069 | |
| CC1C(C)C1(C)C#C,0.2902 | |
| C1CC(C1)(CC#N)C=O,0.2231 | |
| CC#Cc1n[nH]nn1,0.2191 | |
| OC(CC=O)C1CC1O,0.2064 | |
| CN1CC11CCC1O,0.319 | |
| CC1CC(CO)C=C1C,0.2537 | |
| NC1(C[NH2+]C1)C([O-])=O,0.2597 | |
| COC(=O)CC(C)C#C,0.2706 | |
| C1C(=O)CN1CC(=O)N,0.2068 | |
| COC1C2CC(C2)C1=O,0.2066 | |
| COC1CCCNC1=O,0.2502 | |
| CC1OC2COCCC12,0.3114 | |
| CC12OC=NC1C1NC21,0.2651 | |
| OC12CCC1NC2=O,0.2564 | |
| c1cc([nH]c1)C(=O)CO,0.1878 | |
| CN(C=O)C(=O)COC,0.2279 | |
| COC1(CO)COC1C,0.3022 | |
| OC1CC2CC1N=CO2,0.2671 | |
| CC1CCC(C#C)C1C,0.3079 | |
| c1nc2c(o1)OCC2,0.2165 | |
| CC(O)C1COCC=C1,0.2517 | |
| N#CC12CC1C1NC21,0.2471 | |
| CC(CC#N)C(O)C=O,0.2347 | |
| O=C1OCC(O1)C1CC1,0.3292 | |
| CC1(CCO)CCO1,0.318 | |
| OC1C2CC2OC1=O,0.2635 | |
| CCc1cnc(o1)CO,0.2371 | |
| CCC1=CC2OC1C2C,0.2339 | |
| C1CC=C(COC1)C=O,0.1887 | |
| N#CC1OC2C3OC2C13,0.2583 | |
| CC1=CC(=N)N(C1)C=O,0.2022 | |
| N=C1OC(=O)C=C1C#C,0.1735 | |
| CC1C2N1C1C(C)C21O,0.2818 | |
| CC(O)C1=CN=CN=C1,0.2091 | |
| CC12CC3CCC(C1)C23,0.3369 | |
| COCC(=O)C#N,0.1998 | |
| CC1=CON=C(N)C1=N,0.1801 | |
| CCC1C(O)C(O)C1=O,0.2191 | |
| c1c[nH]c2c1[nH]c(n2)O,0.214 | |
| CC12CC(C)(C1)CCC2,0.3472 | |
| OC12CCOC1COC2,0.2995 | |
| c1nc(on1)C#N,0.2261 | |
| NC(N)=[NH+][C-](C#C)C#N,0.1407 | |
| c1coc(c1CO)C=O,0.185 | |
| OC1CCC(=O)C2NC12,0.2196 | |
| CC(CO)C([NH3+])C([O-])=O,0.267 | |
| C1CNC(=O)OC1,0.3078 | |
| COC(=O)CCC1CN1,0.2575 | |
| OCC12OC1C1C(O)C21,0.2756 | |
| CC(C)C(=O)CC1CN1,0.2198 | |
| CCC1OC1(C=O)C=O,0.1956 | |
| NC1=NNC(O)=NC1=N,0.1909 | |
| N=COC(=O)CNC=O,0.2197 | |
| [NH3+]CC1=C([O-])NC(=O)O1,0.205 | |
| OCC12CC1(O)C1CN21,0.3061 | |
| CCC12CC(O)(C1)CC2,0.3262 | |
| COc1nc(c(o1)N)N,0.2237 | |
| OC12CC3(O)CC1(O)C23,0.2798 | |
| Cc1cc(c(o1)OC)N,0.2116 | |
| CC(=O)n1cc[nH]c1=O,0.1938 | |
| CC1CC2(O)CC2(O)C1,0.2971 | |
| COc1ccc(o1)C=O,0.1727 | |
| O=CN1CC1C#N,0.2512 | |
| CN1C2C3NC3(C#C)C12,0.2586 | |
| COC(C)(CC#C)C#C,0.2875 | |
| O=C1OCC2CCC1C2,0.2736 | |
| CCC1C=CC2C(C)C12,0.2421 | |
| CC1CC2(C)CCC1O2,0.3244 | |
| O=C1OC2CCC2C1=O,0.1696 | |
| N=C1OCC2CC2O1,0.2881 | |
| C1CC1C(=O)CCC=O,0.2287 | |
| CC(O)C(=O)CC(C)=O,0.2072 | |
| O=C1OC23CCC2C1C3,0.2611 | |
| CCC1(CCCO1)C=O,0.2113 | |
| C#CC(=O)C(=O)CO,0.1498 | |
| N#CCC1C2COC12,0.2933 | |
| CC1C2CC3C2(C)C13O,0.3064 | |
| CC12C3OC1C(=O)C23,0.2242 | |
| CC12OCC1C2CC#N,0.2902 | |
| CC1=CCc2c1c[nH]n2,0.2075 | |
| CC12CC3OCC13CO2,0.3091 | |
| CCC12COC(CO1)C2,0.3211 | |
| COCc1ccoc1N,0.2169 | |
| CC12COC3CC1N2C3,0.3064 | |
| CN1CC1(C)CN1CC1,0.3125 | |
| CCC1C2CC1(CO)C2,0.3374 | |
| OC12CC1C1CC1C2,0.3196 | |
| C1OC2C1C1CC2CO1,0.3237 | |
| C1OCC11C2C=CCN12,0.2283 | |
| CN=C1OC2CC2C1C,0.2662 | |
| CN1N=CC(=N1)C1CN1,0.2214 | |
| c1cnc(nc1F)CO,0.2117 | |
| OCC1CNC1=O,0.2804 | |
| CC1CCOC(=N)CC1,0.2702 | |
| CC1(NC1C1CN1)C=O,0.2037 | |
| N#CC1CC(O1)C1CC1,0.2795 | |
| CCC#CC(C)C1CO1,0.2984 | |
| CC1C2C3OC(=N)N1C23,0.2661 | |
| OC12COC(C1)OCC2,0.3168 | |
| CC(C)C1CCC=C1C,0.2585 | |
| CC1N2CC1(C2)C(N)=O,0.2383 | |
| Cc1[nH]c(=O)nc(n1)O,0.2156 | |
| OCCC1=NCC(=N)N1,0.2303 | |
| CC1=CC(OC=O)OC1,0.2559 | |
| OC1C2C3C4COC13C24,0.2992 | |
| C1CC(C1)(C(=O)N)O,0.2758 | |
| CCC1CC1O,0.3338 | |
| CN=CNc1cnon1,0.2008 | |
| CC1(NCCC1O)C#N,0.2801 | |
| O1C2C3OC=NC2C13,0.24 | |
| COC12CC3NC1C23O,0.2749 | |
| CC(C)(C)NC=O,0.2781 | |
| CC(C)C(=O)CC1CO1,0.2278 | |
| O=CC12CC1C(N2)C#N,0.2198 | |
| CC1(CCCO1)C#N,0.3021 | |
| CNc1cc(oc1)OC,0.2282 | |
| N=C1N=CON=CC1=O,0.1724 | |
| CC(C)C(=O)C(C)O,0.2332 | |
| OC1CC2C3C=CC2C13,0.231 | |
| Cc1c(nccn1)OC,0.1994 | |
| OC1=NC(=O)N=NO1,0.2679 | |
| N=COCC1=CNC=C1,0.2404 | |
| C#CC1=CCC2NC12,0.2034 | |
| CC1(CN1)C1=NC=CO1,0.2387 | |
| c1cnc-2ccocc12,0.1563 | |
| NC(=O)OC12CN(C1)C2,0.2945 | |
| OC12CCC(CC1)C=C2,0.2633 | |
| CC#CC1(CO1)C(N)=O,0.2501 | |
| CC12CC(=O)CC1O2,0.2271 | |
| CC(C)(C(=O)CC#N)O,0.2319 | |
| CC1N=C(N)C(=O)C1C,0.1834 | |
| CN1CC1C#CC(N)=O,0.2116 | |
| Cc1nc(co1)CC=O,0.212 | |
| N#CCCC12CN(C1)C2,0.2728 | |
| CC12CCC1(C#C)C2O,0.2599 | |
| CN=C1N=CN(C)C=N1,0.1802 | |
| CNc1coc(c1N)N,0.2239 | |
| Cc1c(c[nH]c1O)CO,0.23 | |
| CC1C2CC1C(O2)C#N,0.2804 | |
| c1nc(=O)nc(o1)CO,0.2151 | |
| CC1=CC2(C)OC1C=C2,0.1995 | |
| COC1(C)CC1(C)C#N,0.3022 | |
| CC1OC2CCC(C2)O1,0.3305 | |
| COc1c(nc[nH]1)N,0.2256 | |
| Cc1cc(oc1C#C)N,0.1819 | |
| CC1(O)CC2CCCC12,0.324 | |
| CC1=CC2C(C#N)N2C1,0.2292 | |
| OC(C#C)C1(CC1)C#C,0.2667 | |
| CCC1C(C)N(C)C1=O,0.2762 | |
| CC12CC1(C)C(=O)O2,0.2725 | |
| CC1(O)C2NC1C21CN1,0.2981 | |
| CCCCN1CC1(C)C,0.3052 | |
| COc1cnc(cn1)O,0.1747 | |
| CC1(C)OC2C3CC3C12,0.3142 | |
| CC(O)C1(C)CCC1C,0.3201 | |
| OC12C3OC1C3CC2=O,0.2039 | |
| CC(=O)N1CCCC=C1,0.2131 | |
| CCOC(C)(C)C(=O)N,0.2777 | |
| N#CC1C2C3C1N=CN23,0.2333 | |
| CCCCC1COCO1,0.3391 | |
| C(c1c(oc(n1)O)N)N,0.2363 | |
| C1C2OC1C1=C2COC1,0.2259 | |
| N#CC1NCC2CNC12,0.2643 | |
| c1cn2c(n1)OCCC2,0.2412 | |
| CC(=O)c1cc([nH]c1)O,0.1816 | |
| CC(C)(C=O)C1CC1,0.2252 | |
| CCN(C)C(=O)C(C)O,0.2673 | |
| CCOCC1CCC1,0.3397 | |
| C#CCC(=NO)CC=O,0.2185 | |
| CC(C)C(O)CN1CC1,0.2975 | |
| CC12OCC1C1COC21,0.2858 | |
| CC1OC2CCC1(O)C2,0.3 | |
| CCC1C2NC2C1C#C,0.2789 | |
| Cn1c(ccc1O)N,0.2357 | |
| C#Cc1cnc(o1)CO,0.1991 | |
| CCC1OC2CN(C)C12,0.29 | |
| CC1(C)C2C3C(O)C3N12,0.2692 | |
| c1nc(n(n1)CC#N)O,0.256 | |
| COC1CCOC1C#N,0.2833 | |
| CC12C3OC4C3N1C24C,0.3027 | |
| N#CCNC1CC1C#N,0.2662 | |
| CC12CC3CC1CC2C3,0.3462 | |
| C1C2C1C1CCC2C1,0.3391 | |
| CC12CC(N1)C(=O)OC2,0.253 | |
| CCC1C2C(O)CC12O,0.3101 | |
| C1CC2C3COC2C1O3,0.3167 | |
| O=C1C2C3NC4C3N2C14,0.2112 | |
| COC1C(C)CC1C#N,0.2913 | |
| CC1C2COC12C1CC1,0.2989 | |
| CCN(CC#N)C(=O)N,0.2646 | |
| COCC1C2C=CC1C2,0.2363 | |
| CN1C2C(CO)C1C2=O,0.2442 | |
| CC1=CC(=N)ON=N1,0.1642 | |
| CC1CC2(CN1C2)C#N,0.2691 | |
| CC12OC1C1OCC1=C2,0.2313 | |
| C1CNC2=C(N1)ON=N2,0.1566 | |
| CC1=NC=NC=NC1=N,0.1702 | |
| CC1=CC(=N)N=NO1,0.1645 | |
| CC1CCC(CO)OC1,0.3291 | |
| CC12NC1C(O)C2=O,0.2016 | |
| COCc1c[nH]cc1O,0.2427 | |
| COC1(C)CC1CC#C,0.3107 | |
| OCC1C2CC1C2=NO,0.2707 | |
| O=C1C2C3N2C1C31CC1,0.2283 | |
| Cc1c[nH]c(c1NC)O,0.2404 | |
| Cn1cc(c(c1O)N)N,0.2217 | |
| Cc1c[nH]c2c1CCO2,0.2337 | |
| CC1CC2NC2(C)CO1,0.3084 | |
| OC1C2C3CN3C12C#C,0.2346 | |
| CC1COCC1(C)CO,0.3115 | |
| C#CC1(C#C)C2COC12,0.2528 | |
| OCC1=NC2CC2O1,0.2642 | |
| N#CC12CC1CO2,0.2541 | |
| CN1C=C2CCN2C1=O,0.2208 | |
| c1(nnon1)N=C(N)N,0.1829 | |
| CC1(O)CC1OCC#N,0.2626 | |
| N#CC12CC1OCC=C2,0.2417 | |
| CC12OC3C1C1CC1C23,0.3169 | |
| C1C2CC1C1OC1C=C2,0.2376 | |
| CC1=CC2CC1C(C)=C2,0.2147 | |
| CC12CC1C1CC2C1,0.3378 | |
| OC1CCC2(CO2)C=C1,0.2444 | |
| CC1CCC2CC2OC1,0.3139 | |
| CN1CC1(C)C1(O)CC1,0.3004 | |
| CC(=O)NC1(CC1)C=O,0.2197 | |
| CC(O)C(O)(C=O)C#C,0.1998 | |
| CC12CCOCC1(C)N2,0.3065 | |
| CCC(=O)C#CC,0.2094 | |
| OC12CC1C1OC2C1=O,0.2363 | |
| OCCC12NC1C1OC21,0.2742 | |
| c1[nH]nc(n1)NC2CC2,0.2261 | |
| CCC1(C)C(C)OC1C,0.3149 | |
| O=CC(=O)N1CC1C#C,0.1679 | |
| C#CC1OCC2CC1O2,0.277 | |
| C1CCN=C(C1)OC=O,0.2369 | |
| CC12COC1C1CC2C1,0.3228 | |
| CC1C(C)N1CC(C)=O,0.2171 | |
| OC1C(O)C1(C#C)C#N,0.2606 | |
| CC1CC(C)(C)CO1,0.3131 | |
| O=C1CC2C3C4C(C14)N23,0.2093 | |
| CC(C#N)C1=NCCO1,0.2625 | |
| CC1CC2(C)NC(=O)C12,0.2671 | |
| CC1(CNC1=O)C(N)=O,0.2561 | |
| C#CC1CC2CC1O2,0.2931 | |
| OC1C=C2CN3CC1C23,0.2039 | |
| CC(=O)C1(O)CCC=C1,0.2177 | |
| COc1c(con1)CO,0.2525 | |
| CN1C2CCC12CO,0.3289 | |
| CC(C)Oc1nnon1,0.2159 | |
| CCC1CC(C)=CCO1,0.2622 | |
| CC1C2C3OC4C3N1C24,0.2926 | |
| c1cnc(nc1)CCO,0.2086 | |
| CC(=O)NC(=O)NC,0.2407 | |
| COC12CC(C1C)C2C,0.3341 | |
| CC1=CC2CC3OC1C23,0.2357 | |
| CC1C(O)C2NC12CO,0.2982 | |
| C1C2CCOC=NCC12,0.2527 | |
| CC1=C(C=O)C2CC2N1,0.1741 | |
| NC(=O)CC1(CN1)C#N,0.255 | |
| CC1(O)C2CCC12CO,0.3017 | |
| OC1C2OCC2OC1=N,0.2738 | |
| CC1C2C3C(O)C1C23O,0.3058 | |
| CC1OC2C3C2C1C3O,0.3032 | |
| CN(C)C1CC1(O)C#N,0.2666 | |
| Cc1c(nc([nH]1)C=O)N,0.1536 | |
| CC1(CC1CC#C)C=O,0.232 | |
| C1OC11CC2C3OC2C13,0.3157 | |
| CC1(CC(C1)(C)C=O)C,0.227 | |
| CCC1C2COC2C1=O,0.1971 | |
| CCC1(O)CC1(O)CO,0.3007 | |
| CC1C=CC2(C)OC12C,0.2459 | |
| c1c(cn2c1CC2)CO,0.2445 | |
| CC1CC(CN2CC2)C1,0.3178 | |
| NC(=O)OC1CCCO1,0.3224 | |
| C#CC#CC(C=O)C=O,0.1802 | |
| Cc1cnc(o1)C(=O)C,0.1877 | |
| NC1=C(C=CN1)C1CN1,0.2331 | |
| C#CCC1CC2(CC2)O1,0.2789 | |
| CC12OCCC1C1CC21,0.3198 | |
| Cc1c(nc[nH]c1=O)C,0.1895 | |
| CC(C)C1(CN1C)C#N,0.2758 | |
| CC(=O)C1C2CN=CN12,0.2081 | |
| N#CC1OC1C1CN1,0.2467 | |
| O=CC1C2C3C2C(=O)C13,0.2084 | |
| CNc1c(con1)OC,0.2244 | |
| CN1C2CC1C21CC1O,0.2727 | |
| OCC12CCOCC1N2,0.3137 | |
| N=C1CCC(O1)C1CO1,0.2879 | |
| OC12CC(C1)OC2=O,0.2786 | |
| OCC1=NC(=N)C=NO1,0.1993 | |
| CC1(C)CC(=O)C1C=O,0.2117 | |
| CC1C(C)(O)C1(O)C#N,0.2662 | |
| CC(C)CC(=O)N(C)C,0.269 | |
| CC12CC(C)(O1)C2(C)C,0.3077 | |
| N=C1OCC1CC=O,0.2251 | |
| CC1(CN1)C1CNC1=O,0.2802 | |
| CC#CC(C)C1(C)CO1,0.2992 | |
| COCC(C)(C=O)C#C,0.2231 | |
| C1C2CC1C1OC2C=C1,0.2452 | |
| CC1CC2CC1(O2)C#C,0.2688 | |
| CC1=CC(=N)OC(=O)O1,0.2138 | |
| N#CCCNCC1CO1,0.2792 | |
| N#CCNC1C2CCC12,0.2574 | |
| C#CC1OC1C1CC1,0.2759 | |
| C#CC1OC(=O)C(=O)O1,0.2103 | |
| COC1CC1(OC)C=O,0.2149 | |
| CC1NC1(C)C#CCO,0.2576 | |
| CC(C)C1OC(=N)C1N,0.2685 | |
| CCC1=NC=NC(=N)N1,0.1783 | |
| NC(=O)C(CCO)C#C,0.2692 | |
| CN=CN(C=N)C=O,0.2253 | |
| c1cc(nc(c1N)F)N,0.1771 | |
| OCC12CCC1OC2=O,0.276 | |
| CC1CNC(=N)C(=O)N1,0.2058 | |
| CC1(CC(=O)C#N)CO1,0.196 | |
| CN1CC(C1)(C#N)O,0.2429 | |
| CC1CC23CC(O2)C3O1,0.3133 | |
| CC1C2CC3CC1CC23,0.3501 | |
| CC1OCCNC1=O,0.2607 | |
| OC1CC11COC1C=O,0.2089 | |
| COC12CCC1CC2=O,0.1972 | |
| OC1CNC(=O)COC1,0.2527 | |
| CCc1cc(oc1)C=O,0.1851 | |
| CNC(COC=N)C#N,0.2576 | |
| CC1N2C=NC3C2C13N,0.211 | |
| ON=C1CC2(CO2)C1,0.2455 | |
| Cn1cc(nc1C=O)N,0.1513 | |
| OC(C#N)C1OCC1=O,0.2255 | |
| CC1=CCOCC(=O)N1,0.2127 | |
| CC1OC(C#N)C2CC12,0.2961 | |
| C1CC2C3NC3C2CO1,0.3016 | |
| N=CN1CCC(=O)C1=O,0.1587 | |
| N=C1OC(=O)CCC1=O,0.1891 | |
| CC1(O)C=CCC1O,0.265 | |
| CC(C)(C)CC(C)(C)O,0.3194 | |
| NC=[NH+]CC(O)C([O-])=O,0.2586 | |
| CCOCC#CC,0.2843 | |
| c1c[nH]c2c1OCCC2,0.2272 | |
| CCC(O)C#CC#N,0.2378 | |
| OCC1(O)COCC=C1,0.2557 | |
| O=CNC1=CC2CC1C2,0.1958 | |
| CCC(=O)CN1CC1C,0.1962 | |
| CC12COC1CCC2,0.3216 | |
| COC(CC(C)C)C=O,0.2137 | |
| OC1C2C(O)C1C2=O,0.2291 | |
| O=CCNC(C=O)C#N,0.1984 | |
| COC(=O)C1CC2OC12,0.2748 | |
| CCC(=O)NC(C)C,0.2779 | |
| CC1CC(=O)C(O)C=C1,0.2107 | |
| COC(C)CC(F)(F)F,0.3365 | |
| N=C1NC=NCC2OC12,0.2225 | |
| C1C(O1)(CCO)CCO,0.3344 | |
| CC1OC23COC2C1C3,0.2823 | |
| CC1NC1(CC=O)C#C,0.2179 | |
| c1nc(c(=O)[nH]n1)C=O,0.1308 | |
| COC12COC1C=CC2,0.2514 | |
| CCOC1CC1(C)OC,0.3182 | |
| C#CC1(CCC1)CO,0.2977 | |
| OCC1CCOC(=O)N1,0.3022 | |
| C1NC1C1=NON=C1,0.2314 | |
| CC(C)CCC1CCO1,0.3254 | |
| NC(=O)OC1CCC1O,0.3071 | |
| COC(C)C(=O)CCO,0.2293 | |
| C1COC(O1)CCC#N,0.3081 | |
| CC1C2CC1(C)C2=NO,0.2702 | |
| C#CCNc1cnoc1,0.2132 | |
| CN1CCOC(=O)C1=N,0.1905 | |
| CC1=NCC2(CN12)C#C,0.244 | |
| COCC1C(O)C1(C)O,0.2983 | |
| CCC(=NC)NC=O,0.2306 | |
| OCCOC1CCC1=O,0.2031 | |
| OCC1CN1C(=N)C=O,0.1689 | |
| NC(=O)NC1CCC=C1,0.2537 | |
| CCOc1cocc1N,0.2286 | |
| CC12CN1C(C#N)C2N,0.2521 | |
| N=C1NC=C(O1)C#N,0.1791 | |
| CC12CCC11CC2C=C1,0.2277 | |
| C1C2OCCC=CC12,0.2515 | |
| O=CC12C3CC=C1CN23,0.1746 | |
| O=C1CCCC1C#C,0.2125 | |
| CC1(CN=C(C1=O)N)C,0.183 | |
| CC12C3C4C(N14)C23C#C,0.234 | |
| C#CC1=CC(=NO)CC1,0.1623 | |
| CC1(C)CC(N)C(=O)O1,0.2534 | |
| CC12OC3(C#N)C1OC23,0.2529 | |
| CC12CC1(C#C)C(=O)C2,0.2278 | |
| CCC1=NC=NC(=N)O1,0.1844 | |
| CC1(CC(=O)COC1)C,0.2116 | |
| CCNC1=NOC(=N)N1,0.2476 | |
| OC1C2CC(C2)C11CN1,0.3044 | |
| CC(=O)C1(CCC1)C#C,0.223 | |
| CC12CCN=C1OCO2,0.2686 | |
| COC1(C)C2CCC12O,0.3102 | |
| CC(O)C#CC1CC1C,0.2726 | |
| CC1CC(=O)C(=N)O1,0.1897 | |
| O=C1CC2C3CCC2C13,0.2282 | |
| COC1OCC(C)C1O,0.3319 | |
| OC1C2C3C2C2(CN2)C13,0.3132 | |
| Cc1cc(cn1C)CO,0.2375 | |
| NC12CCCC1OC2=O,0.2625 | |
| CC1(C)C2CC2C1=NO,0.2455 | |
| CN1CC2C3N2CC13C,0.2814 | |
| CC(C=O)C1(CO)CN1,0.2075 | |
| C#CC12CC(O1)C1NC21,0.25 | |
| Cn1c(cnn1)C2CC2,0.2465 | |
| C1C(=CC(=O)N1)C(=O)N,0.1883 | |
| CCC1CC2NC12C#C,0.2527 | |
| OCC1(CO)C2CC1O2,0.2907 | |
| CN1C2CC3C2N3C1=O,0.2593 | |
| C#Cc1cnc([nH]1)C#C,0.1799 | |
| C#CCn1cc(nn1)O,0.2239 | |
| CC1CC2C1N2CC=O,0.2232 | |
| CC(C)(C=O)N(C)C=O,0.2046 | |
| COC1CC(=O)NC1=N,0.241 | |
| Cc1[nH]c(=O)cc(n1)F,0.1981 | |
| CCn1ccoc1=NC,0.2143 | |
| CC1(O)CC1OCC#C,0.27 | |
| CC1C(N1C)C(C)=NO,0.2341 | |
| CC12NC(C1O)C2C=O,0.2025 | |
| CC#CC1CN1C1CC1,0.2632 | |
| CCC(=O)C(=O)N,0.1788 | |
| O=C1C=C2COC3C1C23,0.1683 | |
| CC1=CC2C=CC3C1N23,0.2125 | |
| COc1cc(c(o1)O)N,0.2166 | |
| CC1C(O)C1CCC#C,0.3033 | |
| C1CC1(C#N)O,0.2964 | |
| C1OC1C1=NON=C1,0.2397 | |
| OC1C2CN2C(=O)C1O,0.2403 | |
| CC1(CC1C=O)C#C,0.2173 | |
| CC(C)CC1CC1C#N,0.315 | |
| O=CCNC1CCC1=O,0.2025 | |
| CNC1(COC1)CC#N,0.2632 | |
| CC1(CO)C2C=CCN12,0.2267 | |
| CCC(COC)OC=O,0.2635 | |
| CC1(CC1)C2COC2,0.3207 | |
| OC12C3NC1CC23C=O,0.2172 | |
| CC12CC1(N)C(O2)C#N,0.2373 | |
| Cc1c(ncn1C=O)O,0.1642 | |
| CC1OC2C1C=CC2O,0.2551 | |
| CCC1=CC2C3CC1C23,0.2333 | |
| C1C2CC3COC2C1O3,0.3159 | |
| CC(CO)C(C)OC=O,0.276 | |
| CC1(OC(=N)C1O)C#N,0.2802 | |
| CN1C(C#C)C1(C)C#N,0.2459 | |
| CCCOCC(=O)CO,0.2245 | |
| CC1=C(C=CCC=C1)C,0.1819 | |
| CC(=O)C(O)C(=O)CO,0.2098 | |
| CC1C2CCC1(O)CC2,0.3246 | |
| C#CC(=O)c1ccco1,0.1714 | |
| CC1=C(COC1)NC=O,0.2062 | |
| CC(C)OC1CC1C#N,0.2943 | |
| C1CC2=CCCC=CC12,0.2468 | |
| CC1(C)CC1C(O)C#C,0.2915 | |
| Cn1cc(cc1C#N)N,0.1812 | |
| CC12CC3CC1C23CO,0.2933 | |
| COC(C)C1CC=CC1,0.2654 | |
| Cc1c(=O)ccccn1,0.1522 | |
| C(=O)N,0.2845 | |
| CC1CC2CC(O)CC12,0.3159 | |
| OCCC1(CN1)C1CN1,0.3029 | |
| CN=C1CC(O)CO1,0.2759 | |
| C1CC12CN(C2)C=O,0.2653 | |
| CC12CC3C4C1N4C23,0.3019 | |
| CC12CCN3CC(O1)C23,0.279 | |
| C1C(=O)CN1CCC#N,0.2139 | |
| C1C2OC3=C(ON=N3)C12,0.1855 | |
| CC(C)(C)C(=O)C#C,0.2025 | |
| Cn1ccc(c1)CO,0.2417 | |
| CC12CC=CC=CC1N2,0.1805 | |
| C1CC1(C2OCCO2)O,0.3196 | |
| CC1CC=CC(C1)C#N,0.2647 | |
| O=C1NC2COCC2N1,0.3008 | |
| C[NH2+]C(C)C(=O)C([O-])=O,0.1736 | |
| CC12OCC3(O)C1NC23,0.2853 | |
| CC1NC1(CO)CCO,0.3135 | |
| O=CCC1COCC1=O,0.2074 | |
| C1CC1C#CCC(=O)N,0.2665 | |
| CC1C(CC#C)C1C#C,0.2876 | |
| CC1OC2CC(=O)C=C12,0.1906 | |
| O=C(C#N)C1CC2CC12,0.1888 | |
| CCOC(C)(C)C#CC,0.2936 | |
| CCc1ccoc1,0.2423 | |
| OC1C2CC(OC12)C=O,0.2126 | |
| O=CC(=O)C1=NCCN1,0.1335 | |
| OC1CC2OC(=N)C=C12,0.2049 | |
| CC(C(O)CO)C(C)=O,0.2312 | |
| Cc1nc(n(n1)C)C#N,0.2168 | |
| OC1CC2(CC2)C2NC12,0.3051 | |
| CCC12OCC1C2(C)O,0.2973 | |
| Cn1cc(cn1)NC=N,0.2146 | |
| COC(=O)C(O)C(N)=O,0.2576 | |
| CC1CC1C(=O)CC=O,0.2082 | |
| CCCC12CN(C1)C2C,0.3017 | |
| CC1N2C3CC1(CO)C23,0.2887 | |
| CC(=O)NC1CC1,0.2717 | |
| CC1(C)CC2(CC2)C1O,0.3179 | |
| CCC1CC2(O)CN1C2,0.2928 | |
| CCOC1(C)CC=CC1,0.2653 | |
| CN=C1ON=NC=C1N,0.1655 | |
| CC(=NO)C1NCC1O,0.2426 | |
| CC1NC1CC#CCO,0.2778 | |
| CC1CC(=NO)C1C#N,0.2467 | |
| CC1(CN2CC12)C1CC1,0.3093 | |
| COC1(C)C2CN2C1=O,0.2157 | |
| CC(N)(C#N)C(N)=O,0.2622 | |
| CC12CC=CC1OC=N2,0.2524 | |
| CC#CC12NC3C1OC23,0.256 | |
| CCC(COC)C#C,0.3134 | |
| CC(C)C(O)(CO)C#C,0.2814 | |
| CC1N=COC(=O)C1N,0.2214 | |
| CC1CC2=C(NN=C2)O1,0.2418 | |
| CC1C2C3C2C2(CC2)N13,0.3092 | |
| c1coc(c1CC=O)N,0.161 | |
| CC(CC(C)=NO)C=O,0.2214 | |
| OC1CC1(O)C1CO1,0.3013 | |
| OC12C3CC1CCC23,0.3119 | |
| [NH3+]C1CC2(OC12)C([O-])=O,0.1391 | |
| OC1CC(C1)C#N,0.308 | |
| Cn1cc2c(n1)CCN2,0.209 | |
| CC(=O)N1CC1CC#N,0.2523 | |
| N=C1OC(C=O)C1C#C,0.2216 | |
| CC1OC2(CC2)C11CC1,0.3022 | |
| CCC12CC1OCC2,0.3097 | |
| CC1(O)CC1(C)C1CN1,0.3 | |
| O=CC12CC1C(=O)N2,0.2099 | |
| C#CCOC(=O)CCO,0.2798 | |
| O=CC1C2CC1(O2)C#N,0.2073 | |
| CC1C(=O)CC=C1C#C,0.2084 | |
| CC12C3C4OC(=NC14)N23,0.1485 | |
| c1c(=O)onc(n1)N,0.1474 | |
| CC1(COC(=N)O1)C#C,0.2716 | |
| CC1(CC2(O)CC12)C=O,0.2256 | |
| OC1C2C3CN2C3C1O,0.3059 | |
| O=CC1C2OCC(=O)C12,0.2057 | |
| CC1CC2OCC12,0.3165 | |
| CC1(O)CCC(=O)C=C1,0.1825 | |
| C(CC(=O)N)CO,0.2796 | |
| CC(C)OCC1CCC1,0.3321 | |
| N=C1NC(=N)C(O1)C#C,0.2497 | |
| C#CCc1[nH]ncn1,0.2712 | |
| CC1(C)C2CC(=O)CN12,0.2017 | |
| CC1CC11NC(=O)C=C1,0.2033 | |
| CC1(NC11COC1)C=O,0.2077 | |
| c1c(=O)cn[nH]c1N,0.1869 | |
| OCC1CC(CO1)C=O,0.2246 | |
| C1NC1C1=CNC=C1,0.2461 | |
| C#CCOC=NCCO,0.2544 | |
| OCC12OCC1N1CC21,0.2768 | |
| CC(C)OC(=O)CC#N,0.2863 | |
| CC1(C)CC2COC1C2,0.3141 | |
| CN(C=N)c1ccoc1,0.2139 | |
| C1NC11C2C3C4C3N2C14,0.291 | |
| O=C1C=CC2C3CC12N3,0.1734 | |
| CC1C(O)C1NCC#N,0.2564 | |
| C1CCC(C1)CCC#N,0.3497 | |
| CC1COC1C(N)=O,0.2624 | |
| CC1(C=O)C2CCC12,0.2321 | |
| CC(=O)CC(O)CC#N,0.2317 | |
| COC1C2COC2C1=O,0.1813 | |
| OC12CC=CC1NC2=N,0.2417 | |
| O=CNCC1OC1C#C,0.2651 | |
| CCOC(=N)C(O)C#C,0.2796 | |
| C#CCc1ccc(o1)N,0.2151 | |
| O=C1CNC1C#CC#N,0.2095 | |
| Cc1c[nH]c(c1N)CO,0.2176 | |
| CC1(C)CC1CO,0.3355 | |
| C1Cn2c(noc2=O)N1,0.2599 | |
| NC(=O)C1NCCC1=O,0.1983 | |
| N=COCC1=CNN=C1,0.2585 | |
| C1C2C=C3C=C1C1C3N21,0.0376 | |
| CC(=NO)CC1(CC1)C,0.2546 | |
| CCCC1C2OCC12C,0.3044 | |
| C#CC12CC=CC1N2,0.231 | |
| CN1C(=N)C=C(C)C1=O,0.1798 | |
| CCC(COC=N)C#N,0.2832 | |
| OCC1C2OC1C1NC21,0.3104 | |
| CCC12CCC1OC2,0.3041 | |
| CC1(O)C2C=CC(=O)C12,0.1818 | |
| NC(=[NH2+])C(O)CC([O-])=O,0.2621 | |
| Cc1c(cc(cn1)O)O,0.2032 | |
| O=C1C=CCC2NC12,0.1874 | |
| CCc1c(oc(n1)N)N,0.231 | |
| OC12CC3(C1)CCCC23,0.3324 | |
| OC12CN3CC=C(C1)C23,0.1917 | |
| CN1CC2OCC12,0.2866 | |
| CCCC(C)C(O)CO,0.3181 | |
| CC(CC#N)C(N)=O,0.274 | |
| CC1(CNC(=O)OC1)C,0.3022 | |
| CC(C)n1ncnn1,0.2653 | |
| O=C1CC23CC=CC12N3,0.2133 | |
| N#CC1C2C3N=CN1C23,0.2253 | |
| C1C2C1C13CCC21CO3,0.2823 | |
| C#Cc1cocc1N,0.198 | |
| O=C1NC2C3CC(O1)C23,0.2964 | |
| CC1C2C3CC2C13C#N,0.3171 | |
| CC12OCC=CC1C2O,0.2207 | |
| CCC1OCCOC1=N,0.2717 | |
| NC1=C(F)ON=NC1=N,0.078 | |
| C1NC11CC2CC2C=C1,0.229 | |
| C#CCOC(C#C)C#C,0.2601 | |
| N#CC1CNC=N1,0.249 | |
| OCC1(OC1C#C)C#N,0.2609 | |
| CC1(O)C2C=CC1C2O,0.2422 | |
| CC12CCOC(O1)C=C2,0.2515 | |
| OCC(O)C(O)CC=O,0.2309 | |
| C1CC(C=C1)(C=O)C=O,0.1921 | |
| CN(C)c1c[nH]cn1,0.2145 | |
| c1[nH]c(c(n1)OC=O)O,0.2133 | |
| OC(CC=O)C#CC#C,0.2083 | |
| CCCC1(C)CC(C)C1,0.3534 | |
| OC1C2C3NC3C12C=O,0.2079 | |
| OC12CN(CC1)C2C=O,0.2044 | |
| CC(=O)N(C)CCCO,0.2662 | |
| CCC1OC(=O)NC1C,0.3128 | |
| CC1C(O)CC(=O)C1=O,0.146 | |
| CC1OC1C#CCC#C,0.271 | |
| N#CC12CN1C1CC1C2,0.2692 | |
| CC1=CC2=C(ON=N2)O1,0.1365 | |
| CCC(C)(CC#C)C=O,0.2211 | |
| N=C(C#N)N1CCC1=O,0.2083 | |
| CC(CCO)N(C)C=O,0.2718 | |
| CC(=O)CC(=O)NC,0.2116 | |
| CCOC(C#N)C(N)=N,0.2515 | |
| CC1(CCC1)CO,0.3367 | |
| Cc1ccccc1,0.2407 | |
| CCCC(=O)C(O)CC,0.2382 | |
| CC1CCC=CC1CO,0.2643 | |
| OCCC12CC3C(C1)C23,0.3237 | |
| ON=C1CC2C3CC2C13,0.251 | |
| OC1C2CCC2=CC1=O,0.1864 | |
| O=C1CC2OC1OC2=O,0.2151 | |
| CC12OC3(C)C1C(O)C23,0.2967 | |
| C1COCC(=N1)OC=O,0.2259 | |
| CC12CC(C)(C1)C1NC21,0.3101 | |
| CC1NC(C=O)C1C#N,0.2088 | |
| COC12CC1N=COC2,0.2433 | |
| Cn1c(ncn1)N(C)C,0.2399 | |
| c1nc(c(c(=O)o1)N)N,0.1666 | |
| CCC1C(O)CN1C=O,0.2621 | |
| CCC1(C)CC(O1)C=O,0.2119 | |
| CCOC1C(C)C1OC,0.3011 | |
| CC1C=CCC2OC12,0.2677 | |
| CC1=CCC2(CO)OC12,0.2438 | |
| COC1CC11CC2OC12,0.3186 | |
| CC1CCC(C)(C)C1=O,0.219 | |
| CCC#CCCC=O,0.2194 | |
| N=C1OCC2C3CC1N23,0.2576 | |
| COC1C2(C)CC1(C)C2,0.3276 | |
| CC1C=CCC(=O)C1=O,0.1597 | |
| C1COCCC1OC=O,0.2729 | |
| CC1(CCC1C#C)C#N,0.286 | |
| CC(CO)C#CC1CC1,0.2831 | |
| CC(OC=N)C(=O)C=O,0.1453 | |
| CC1(CN1)C1CC2CN12,0.3009 | |
| CCC(O)(C=O)C#CC,0.2117 | |
| CCc1c(nn[nH]1)CC,0.2437 | |
| CC1CCC2(CO2)C1,0.3303 | |
| CC12CC1C1C(CO)C21,0.2804 | |
| CC(O)C(=O)NC(N)=O,0.2455 | |
| OCC1(O)C2NC1C2O,0.2937 | |
| N=C1OC(C#N)C2NC12,0.2644 | |
| COC1CC2CCC12C,0.3225 | |
| CCC1OCC(C)C=C1,0.2639 | |
| CC(CC#N)OCC#N,0.2967 | |
| c1cc(oc(=O)c1N)N,0.151 | |
| CC1CC11CNC(=O)C1,0.2738 | |
| O=C1NN=NC(=C1)C#C,0.1698 | |
| CC1(C)C2CC2OC1=O,0.2768 | |
| OCC(O)(C=O)C#C,0.2036 | |
| O=C1NC2C3NC2C13,0.236 | |
| CC(C)(C#CCO)OC,0.2782 | |
| C1COc2c1n[nH]n2,0.2202 | |
| NC1C2NC2C=C1C#N,0.1902 | |
| O=C1NN=NC=C1,0.1775 | |
| OC12CC3C4C1C4C23O,0.2948 | |
| O=C1NC2CC2OC1=O,0.2074 | |
| CC(=NO)c1cc[nH]c1,0.2001 | |
| CC1CN2CC2CCO1,0.312 | |
| CC1CN1CC(N)C#N,0.2709 | |
| OC1C2C1C1C3CN1C23,0.2968 | |
| C#CCC#CC=O,0.2048 | |
| CC1C2C(N=CN12)C#N,0.2351 | |
| OC1CNCC(C1)C#N,0.2612 | |
| c1nc2n(n1)CC(=O)C2,0.2149 | |
| c1nc(c(=O)[nH]n1)CO,0.173 | |
| N#CCC1CC2CCN12,0.2506 | |
| CN(CC(O)CO)C=O,0.2728 | |
| CC1C(C)C1CNC=O,0.2811 | |
| OC1(COC1)C1CCO1,0.312 | |
| C1C=CC2C3C4OC3C124,0.2415 | |
| CCC1=CCOCC1=O,0.1804 | |
| CC12CC1N(CC#N)C2,0.2556 | |
| OCCC1=NC2CC2O1,0.2616 | |
| OCC(O)C1OC1C=O,0.2138 | |
| OC1C2CC(=O)CC1O2,0.2263 | |
| CCC(C)(C#C)C1CO1,0.3084 | |
| Cc1cc(n(n1)C=O)N,0.1921 | |
| OC1CC(O)C2OCC12,0.3091 | |
| OC1CC(O)C1C1CN1,0.3037 | |
| c1nc(on1)CC=O,0.2229 | |
| C1C2OCC3OC13C=C2,0.2278 | |
| CC1(CCCC1)OC=O,0.2772 | |
| OC1C2OC3C(O)C2C13,0.2975 | |
| O=CC1C(C=O)C1C#N,0.21 | |
| C1C2C3C1OCCCN23,0.3078 | |
| NC1(C#N)C(O)C1CO,0.2758 | |
| OCC1C2CCC12,0.3227 | |
| c1cn(cc1N)C2CC2,0.2206 | |
| CCC1=COC(=N)N1C,0.2177 | |
| O=C1COC2OCC=C12,0.1784 | |
| CNc1cc[nH]c1,0.2278 | |
| CCC(N)C1(CN1)C#N,0.2901 | |
| C1N=COC2C3OC2C13,0.2684 | |
| CC(CO)(CO)NC=O,0.2728 | |
| CC1C(CC#N)C1C#N,0.3143 | |
| OCC1CCC(=N)O1,0.2828 | |
| N#CC12OCC3C1CC23,0.278 | |
| CC1C2OC(=N)OC12C,0.2993 | |
| C1CC2C3CCOC23C1,0.3081 | |
| OC1C2OC2C1C1CN1,0.304 | |
| NC(=O)C1CCC(=O)C1,0.223 | |
| ON=C1CC2(CN2)C1,0.2446 | |
| CC1C(CO)COC1=O,0.2773 | |
| N=C1N=CNC(=O)C=N1,0.1734 | |
| O=C(C#C)C1=NCCN1,0.146 | |
| CCN=C(C#N)N(C)C,0.192 | |
| OC12CC3CCC(C1)C23,0.3171 | |
| C1CC23CC4OC2C4C13,0.3164 | |
| COCC1(C)CN1C,0.3 | |
| Cc1c(oc(=O)n1C)N,0.2348 | |
| O=C1CC2C3NC3C2C1,0.2279 | |
| Cc1c(n[nH]n1)CO,0.2511 | |
| OC1CC1(C=O)C=O,0.2123 | |
| Cc1noc2n1ccn2,0.212 | |
| Cn1ccc(c1C#C)N,0.1863 | |
| OC1(C=O)C2OC=NC12,0.1983 | |
| OC12CC3=CCC1(O)C23,0.1818 | |
| NC1=NOC(OC=N)=N1,0.2188 | |
| COC=NCC(=N)OC,0.2606 | |
| C1CC2(CC2)CC13CC3,0.3451 | |
| C1CC11CC=CC2OC12,0.2377 | |
| C1CC2COC=NC2C1,0.2688 | |
| CC1=CCCN1C(=O)N,0.2225 | |
| CC1CCC2OCC12C,0.3166 | |
| C1CC2=CC3NC3C12,0.2373 | |
| CC1C(C)C1OCCO,0.3074 | |
| [NH3+]C1(CC2CC12)C([O-])=O,0.268 | |
| CC(=O)N(C)C(=O)C#N,0.1898 | |
| C#CC12CC1OC=N2,0.251 | |
| N=C1C=COC=NC1=N,0.1927 | |
| C#CCN=C1CCO1,0.2681 | |
| O=CCCC1(CO1)C#N,0.2289 | |
| CCC(C)OCC=O,0.2284 | |
| CC(C(O)C#C)C1CC1,0.2915 | |
| COc1cc(c[nH]1)C=O,0.1729 | |
| CCCCC12CC(C1)C2,0.3732 | |
| CCCC(C)(CO)C#C,0.306 | |
| CC(=O)C12CN1C(=O)C2,0.2119 | |
| CC(C)(CO)C(C)(C)O,0.3243 | |
| CC1(CC1CC=O)C=O,0.218 | |
| CC1OCC11CC1C#N,0.279 | |
| CC1(C=O)C2CC2C1=O,0.1986 | |
| N=COC1OCC=C1,0.2585 | |
| CC12CC3CN1C23C,0.3193 | |
| COC1COC11CC1C,0.2937 | |
| CC1C2(C)NC2C11CN1,0.2939 | |
| CC1(C=O)C2CC1C=C2,0.2109 | |
| C1C2COCC1C1OC21,0.3342 | |
| COC1CC2(CO2)C=C1,0.2514 | |
| CCC#CC(C)(N)C#N,0.2784 | |
| COC1C(=N)NC11CC1,0.2526 | |
| CC1(CCCCC1)O,0.3235 | |
| OC(CC1(O)CC1)C#N,0.2725 | |
| CN(C)Cc1cnn[nH]1,0.2398 | |
| C1C=C(C(=O)C1=O)CO,0.1411 | |
| CC(OCCCO)C=O,0.2268 | |
| O=CC1CC(=O)C1C#N,0.2131 | |
| C1C2NC2C2=CN=CN12,0.2381 | |
| CC12CCC3=CCC1C23,0.2184 | |
| C[NH2+]CC(C)(O)C([O-])=O,0.2643 | |
| CC1(C=O)N=CN2CC12,0.2149 | |
| CC1(C(=CC(=O)N1)N)C,0.2206 | |
| COC1=NCCN1C=O,0.2288 | |
| O=C1C2C3C1NC23C#N,0.2178 | |
| CC1CC11CNC1C#N,0.2607 | |
| C1CC1CNC(=O)CO,0.2765 | |
| CC1OC(=N)C11CN1C,0.2603 | |
| O=CCC1C2CCC12,0.2249 | |
| O=C1CC2NC3COC123,0.1938 | |
| CC12OC3C1NC23C#C,0.2563 | |
| CC12OC=NC11CC2C1,0.2569 | |
| COC12COC1(C)C2C,0.2936 | |
| CCC1(CC1)OCCO,0.3305 | |
| CC#Cc1cc[nH]c1,0.2192 | |
| N#CC12CC3=CCN1C23,0.1672 | |
| CC1(N)COC1=O,0.2671 | |
| c1c2c(n[nH]1)OCCC2,0.2377 | |
| C1CC1C12OC1CC=C2,0.2454 | |
| CC1C(CCC1=O)C#C,0.219 | |
| C(C(=O)N)C(F)(F)F,0.2757 | |
| C#CCCC(CO)CO,0.3107 | |
| CC(C)n1ccc(n1)O,0.241 | |
| COC1C(C#C)C1C#C,0.2614 | |
| CC1(CO)C2NC2C1O,0.3083 | |
| CCC(C=O)C(O)CO,0.2244 | |
| CN1CC(C1)C(=O)C=O,0.1253 | |
| COc1ccoc1C=O,0.1811 | |
| O=C1NC(=O)C2CC1C2,0.2332 | |
| CC1(OC(=N)C=C1)C#N,0.2174 | |
| CC12C3C4C(N13)C24C#C,0.2332 | |
| CC1C2OC1(C)C1OC21,0.3093 | |
| O=CCC1CC2CC1O2,0.2276 | |
| CC1(CCC1)C(=O)N,0.2721 | |
| CN1CC1C(=O)NC=N,0.2072 | |
| Cc1ncc(c(n1)O)O,0.2061 | |
| c1nc(on1)CC#N,0.2629 | |
| O=C1OCC1C#CC#N,0.2271 | |
| CC(O)(C#N)C1(C)CC1,0.307 | |
| C1OC2C3OC1C23,0.2921 | |
| CCNC(=O)C(=O)C=O,0.1264 | |
| CC(C)C1CC2OC12,0.3276 | |
| ON=C1CC2OCC12,0.243 | |
| OCC1COCC11CN1,0.3053 | |
| CC1CNC(=O)C(=N)O1,0.2225 | |
| N=C1OC=NC(=O)C=C1,0.1856 | |
| NC1=CC=COC1=N,0.1604 | |
| CCCC(O)COCC,0.3283 | |
| C1C(=NO)CNCC1=O,0.1945 | |
| CC(=N)OC(C)(C)C#N,0.29 | |
| CN1C2C3C4OC4C2C13,0.2839 | |
| COC1C2COC12C,0.3078 | |
| NC1=[NH+]C(=N)N=C(O)[N-]1,0.2056 | |
| N=COC1C2CC1C=C2,0.2434 | |
| CN1C2C3CC(O3)C12C,0.2873 | |
| CC1C2OCC12C#N,0.2719 | |
| C#CCC#CCC1CC1,0.2875 | |
| CC1C2OC(C)C1C2C,0.3254 | |
| CC(C)C(=O)C1CCO1,0.214 | |
| O=CCC1NC1C#C,0.2199 | |
| [NH3+]CC1(CC(=O)[N-]1)C#N,0.2723 | |
| CC12CCC(CO1)C2O,0.3133 | |
| CC1NC1(CC#N)C#N,0.2847 | |
| COCC(CO)C(C)C,0.3255 | |
| CCC1=C(C)NC(=N)O1,0.2204 | |
| Cc1cc(c([nH]1)CO)N,0.2103 | |
| C#CC1=CCCC11CN1,0.1995 | |
| CC1CC1C1CC1C=O,0.2273 | |
| Cc1c(c(ccn1)O)F,0.2364 | |
| CC1(C)CC2CC2C1=O,0.2226 | |
| C1OC23COCC2CC13,0.3013 | |
| CCN1C2CC(C2)C1=O,0.2575 | |
| CN1CCC(=N)NC1=O,0.2503 | |
| CC12CC(=O)C(O1)C2O,0.2117 | |
| Cn1cc(c(=O)nc1)N,0.1858 | |
| C1CC1N2C=NCC2=O,0.2189 | |
| CC12OC3C(CC13)C2O,0.3002 | |
| CC1C2OC3C(O)C3C12,0.304 | |
| Cn1c(c(nn1)OC)N,0.2138 | |
| Cc1ncco1,0.2453 | |
| CN1C=CC(C=O)C1=O,0.192 | |
| C#CC#Cc1c[nH]nn1,0.1912 | |
| O=CC1(NC1C#C)C#N,0.2165 | |
| CC12CC(C)(C=O)C1N2,0.2156 | |
| C1CC2CCC3C1C23,0.3379 | |
| CC1CCOC11COC1,0.3135 | |
| C1C2C1C1C=CC3C2N13,0.214 | |
| CC(C)CC1CC=CC1,0.2648 | |
| CC12NC1C(C#C)C2=O,0.209 | |
| CC(C)CCCO,0.3422 | |
| OCC1NC1C1COC1,0.3133 | |
| CC1=CCC2COC12,0.2551 | |
| N=C1NC(=O)C(O1)C#C,0.2519 | |
| CC1(CCCC(=O)N1)C,0.2695 | |
| Cc1cc(c([nH]1)C=O)O,0.1698 | |
| C1CC23OC4CC12NC34,0.2898 | |
| CC1OC11C2OC1C2O,0.3078 | |
| OC1CC(=O)C2CC12,0.227 | |
| COC1CC(=O)C1C#C,0.2144 | |
| CCC1OC1(CC)C#C,0.2853 | |
| CC1COC2(CC12)C#N,0.2696 | |
| CC1C2CCC2=CC1=O,0.1928 | |
| COC12CC3C(C13)C2O,0.2866 | |
| CC1(O)C2C3CC1N23,0.31 | |
| c1cn[nH]c(=O)c(=O)n1,0.1639 | |
| CC1(C)CC(=O)N2CC12,0.24 | |
| OC12CCC11CC(C2)O1,0.3081 | |
| CC1OC1C#CC(C)=O,0.2044 | |
| N#CC1C2NCCNC12,0.2545 | |
| OC(CC#N)C#CC=O,0.2026 | |
| C1CC2(C1)C3(O2)COC3,0.3166 | |
| CC#CC(=O)C1CCO1,0.1937 | |
| CC12NC1CC1OC21,0.3072 | |
| OC1CC1(C#C)N1CC1,0.2739 | |
| CC(=O)C1CC11CCC1,0.2309 | |
| C1C2CC11C3NC3CN21,0.2797 | |
| O=CC12C3CC4C1N4C23,0.2148 | |
| CC1C(O)C2NC2C1=O,0.2141 | |
| CC(C)C1C2CCOC12,0.3147 | |
| CC1CNC(=O)CO1,0.264 | |
| C1CC(=O)OCOC1=O,0.2626 | |
| OC1CCC11CC(=O)N1,0.2855 | |
| c1cc-2cnonc2c1,0.1396 | |
| N#CC1C2C3OCC1C23,0.2673 | |
| CC(=O)C1=CN2CC2C1,0.1839 | |
| Cc1cc[nH]c(=O)c1C,0.175 | |
| CC12CC(C1O)C2C=O,0.217 | |
| NC1=NOC(=C1)C1CN1,0.2223 | |
| CC12CCNC1C(=O)O2,0.2461 | |
| C1C2CC3CCC3OC12,0.2873 | |
| CCC(C)CC(=O)CO,0.2402 | |
| CC1C=C(C)C(=O)N1C,0.2161 | |
| Cc1cc(on1)C#C,0.2054 | |
| CC1C2C3COC1CN23,0.3023 | |
| CNC1(C)CC1(N)C#N,0.2559 | |
| OC1CC2(CC2)C11CN1,0.309 | |
| CCCC1(CC1O)C#C,0.2895 | |
| OCC(CCC=O)C#N,0.2272 | |
| CC1OC2C=CC1C=C2,0.2205 | |
| O=CC12CC(C1)(O2)C#C,0.209 | |
| OC(C1CC1)C(=O)C=O,0.1564 | |
| CC1OC2CCC2C1=O,0.2136 | |
| OCC1(CC(O)C1)C=O,0.2219 | |
| CC12C3OC(OC13)C2=O,0.1996 | |
| CC1OC2(C)C(O)C12C,0.3031 | |
| Cc1c(nc([nH]1)C#C)O,0.1781 | |
| O=C1NC2C3CC=C1C23,0.1863 | |
| OC1COC2CC2(O)C1,0.2875 | |
| C#CC1(CC2CN12)C#N,0.2479 | |
| CC1NC(C2CO2)C1=O,0.2179 | |
| CCC(C)C1CCCC1,0.3762 | |
| OC1C2COCOCC12,0.3108 | |
| CCc1cnoc1C=O,0.1895 | |
| OC1CC2C3CC12OC3,0.2887 | |
| CC1=CC2OC3C2C13O,0.2205 | |
| O=C1C2OC2C1CC#N,0.2137 | |
| c1c2c(c(o1)N)OCC2,0.22 | |
| c1c(c2c([nH]1)cn[nH]2)N,0.1991 | |
| CC1(C)CC(O)C1(C)C,0.3158 | |
| c1c(oc(=O)o1)OC=O,0.226 | |
| CCOC(=O)C(C)(C)O,0.2644 | |
| CC1C2C3COC1C23O,0.2972 | |
| CC1OCC1C(O)CO,0.3013 | |
| c1c(=O)nnn(n1)C=O,0.147 | |
| C(CO)N=COCCO,0.2568 | |
| O=C1C2C3CN4C(C23)C14,0.2116 | |
| CC1OC2OCC1C=C2,0.2429 | |
| CCC(O)C(CO)OC,0.3201 | |
| COCC1C2COC12C,0.3134 | |
| N=C1CNC(=O)OCO1,0.263 | |
| CN=CNC(=N)C(=O)N,0.1924 | |
| CCC1C2CN2C1CO,0.3059 | |
| CC(=O)C1COC(=N)O1,0.2177 | |
| CC12CC(C)(COC1)O2,0.3205 | |
| CC1CC2CC2(O)C1,0.3126 | |
| CC12CC3=NCC1(C)N23,0.1945 | |
| N=C1OC2(CC#N)CC12,0.281 | |
| C1C2C3CC=CCC1C23,0.2658 | |
| CC1C2C(C3CN23)C1=O,0.1993 | |
| CCC1CN1C(=O)C#N,0.2169 | |
| CC(O)C1OC2C(C)C12,0.3016 | |
| CC1(CO)COC=N1,0.2631 | |
| OCC1CC(O)C(=O)O1,0.2729 | |
| C1CN1c2c(n[nH]n2)N,0.2117 | |
| OCCOCC(O)CO,0.3247 | |
| OCC1OC(=N)C2NC12,0.2584 | |
| CC(CCO)C1OC1C,0.3337 | |
| CN1C2C3COC2(C)C13,0.301 | |
| CC1CN2CCOC2=N1,0.2724 | |
| Cc1ccc(c(c1)F)F,0.2256 | |
| CC1(CN(C1)C=O)C,0.2673 | |
| CC1C2C(=O)NC12CO,0.2521 | |
| O=CC1=CNC2CC1C2,0.1794 | |
| CC1(C)CC(CC#N)O1,0.2915 | |
| C[NH2+]CCC(C)C([O-])=O,0.2743 | |
| CC(O)C#CC1CC1O,0.2702 | |
| FC1=CC=COC1=N,0.169 | |
| CC1=CC2C3OC2C13C,0.2233 | |
| CC1=C(O)NC(=N)O1,0.2279 | |
| CN1CCC2OC(=O)C12,0.2346 | |
| CN=C1NN=C(F)C=C1,0.1497 | |
| Cc1c(cn[nH]1)CCO,0.2516 | |
| CCCC12C3C4C3C1C24,0.3026 | |
| Cc1c(ncoc1=O)F,0.1932 | |
| CN=C1CC(N)C(=O)O1,0.2424 | |
| CC#CCCNCC#N,0.2695 | |
| COCC(C=O)C(N)=O,0.2125 | |
| O=C1C2NC1C1NC21,0.2366 | |
| N#CC1CC2COC12,0.2859 | |
| CC1=NC=C(N1)OC=N,0.2187 | |
| CC1NC11CC2OCC12,0.3088 | |
| COC1C2CN=COC12,0.278 | |
| CC(O)C1=CN=NN1,0.2537 | |
| CC[NH2+]C(C#C)C([O-])=O,0.2661 | |
| CC1C2C=CC1(C)C2=O,0.244 | |
| CN1C2CC1(CO)C2=O,0.2475 | |
| OC1C2CC(C12)N1CC1,0.3051 | |
| C1CC23CC(OCO2)C13,0.3031 | |
| CC(NC(=N)CO)C#N,0.2625 | |
| CCn1c(cc(n1)N)N,0.2356 | |
| CN(CCO)C1COC1,0.2922 | |
| CC12NC1C1(CO)NC21,0.265 | |
| CCC1OC1CCOC,0.3457 | |
| COC1COCC1(C)O,0.311 | |
| CC1CC1C(C#N)C#N,0.303 | |
| CC1CN(C=N1)C(C)=O,0.2219 | |
| COC1C2C3C1CN23,0.3137 | |
| CCC1(C)COC1C#C,0.2701 | |
| N#CC12CC(C1)C1OC21,0.2947 | |
| COCC1(C)NC1C#N,0.2801 | |
| CC1(C)CC2C(O)C12,0.3199 | |
| CC1(CCC1)OC=NC,0.2706 | |
| CC(C)CC1COC1=O,0.2803 | |
| C1CC1(CCO)O,0.3023 | |
| CCc1c(oc(n1)N)C,0.23 | |
| CN(C)C1C2NC2C1=O,0.1759 | |
| COC1C2NC2C1C#C,0.2754 | |
| CCC12C3CC3N1C2C,0.2791 | |
| CCCC(=O)C1CC1,0.2341 | |
| OC12C3CC1N3CC2=O,0.2049 | |
| Cn1ccnc1N(=O)=O,0.1755 | |
| CC1N2CCC12CCO,0.302 | |
| COc1nccc(n1)F,0.2208 | |
| C1C2N1CC21CCOC1,0.3022 | |
| c1c(c[nH]c(=O)c1F)N,0.1592 | |
| CC1NC11CN(C)C1,0.2883 | |
| c1c(nn[nH]1)C=O,0.2037 | |
| C1C(COCO1)CCO,0.3311 | |
| OCC1OCC=C1,0.2445 | |
| N=COC12CC3C1NC23,0.2621 | |
| CC1CC11OCC1CO,0.2899 | |
| CCC1CC(=O)C(=N)O1,0.1894 | |
| CC(O)C1=C(O)NN=C1,0.2497 | |
| CC12C3C1C1(C#C)C2N31,0.2307 | |
| C#CC1CC11COC1,0.2827 | |
| CCCCN=COC,0.2697 | |
| CC(C)C1C2NC(=O)C12,0.2525 | |
| CCC1CC=CCC1=O,0.2236 | |
| CC1OCC2CC=CC12,0.2632 | |
| CC1OC1(C)C,0.3468 | |
| CC12C3C4C(CN14)C23O,0.2798 | |
| CC1=NOC(=N)NC1=N,0.1933 | |
| CC1CN=C(N1)C1CO1,0.2334 | |
| C1C=CCOCC=C1,0.229 | |
| CC(C)(C#N)OC=NC,0.2738 | |
| CC1C2C(C)C(O)CN12,0.2736 | |
| CC12CCC(O)(CC1)C2,0.3235 | |
| C1C2NC1C1=C2NN=N1,0.2182 | |
| CC1C2CC(O2)C1C#N,0.2966 | |
| C(C1CN1)C1=NC=CO1,0.2439 | |
| COC1CCC2OC12,0.3291 | |
| CC1CC2CCC12O,0.3183 | |
| CC(C)CC1OCC1O,0.306 | |
| CC1C(O)C11C2CN1C2,0.2908 | |
| CC1OC=NCC1(C)O,0.2653 | |
| O=C1CC2C3OCC3N12,0.2375 | |
| CC12CC3(C#N)C(O1)C23,0.2688 | |
| CC(C)(C#N)N=COC,0.2666 | |
| N=C1OC2CCCC1O2,0.2859 | |
| O=C1CC2(CN12)C#C,0.2309 | |
| CC12CC(O1)C2C#N,0.2776 | |
| COCCC(C)(O)C#C,0.2875 | |
| C#CCCC12CC(C1)C2,0.3162 | |
| CC1C2OC1C2C#C,0.2773 | |
| OC1CC23OC4C2C1C34,0.2957 | |
| CCOC(C#C)C(C)O,0.2959 | |
| O=C1C2CNC(=O)C1O2,0.2091 | |
| CC1(NC1CO)C1CO1,0.3261 | |
| CCC12CC3(O)C1NC23,0.2941 | |
| Cc1cc(ccc1N)N,0.1844 | |
| COc1nc(=O)[nH]nn1,0.1739 | |
| NC1C2OC(=O)C12N,0.2338 | |
| CC12CC(C1O2)C(N)=O,0.2676 | |
| C1C(=O)C(=O)CC12CN2,0.1448 | |
| CN1C2C3C4CC4C2C13,0.3044 | |
| CC1=CC2CC1C2O,0.2422 | |
| Cn1cnn(c1=O)C=O,0.21 | |
| NC1C2NC(=NC12)C#C,0.1918 | |
| CC12NC1C1(CO1)C2=O,0.201 | |
| FC1=C(F)C(=N)C=CN1,0.188 | |
| Cc1nc(cc(n1)F)N,0.2259 | |
| OC1CC2C3C4C1C2N34,0.306 | |
| CC1=CC(C)(NC1)C#N,0.2365 | |
| CCC(=O)CC#N,0.2373 | |
| c1c(ncnc1O)C=O,0.1789 | |
| C1NC11C2C3COC2C13,0.3215 | |
| CC1C(O)C1(O)CCO,0.2874 | |
| OCC1OC2CCCC12,0.3166 | |
| OCC1N2CC2C1=NO,0.2329 | |
| CNC(C)C1=NOC=N1,0.199 | |
| CCC(OC1CC1)C=O,0.2135 | |
| C#CC1(CC1)C(=O)C#N,0.1801 | |
| CCc1c(=O)cnon1,0.1672 | |
| OC(C=O)C1C2CCC12,0.2212 | |
| C1Oc2c([nH]nc2O1)N,0.2272 | |
| CN1C2COC(C2)C1=O,0.2518 | |
| CC(O)C1(C)CCCO1,0.3218 | |
| OC12COCC1OC2=N,0.2718 | |
| CNC1=[NH+]C(=N)C=N[N-]1,0.1765 | |
| C#Cc1cc(c(o1)N)O,0.1721 | |
| CC1=CC(O)CNC1=O,0.2106 | |
| CC1(CO)C2OC2C1=O,0.2108 | |
| CNc1ncnc(n1)N,0.2207 | |
| CC1(O)CCOC(=N)C1,0.2777 | |
| CC(=O)Cc1ccno1,0.2107 | |
| COC1CC2COC12C,0.2908 | |
| CC1C=CCCC2OC12,0.2644 | |
| c1cc(n(c1)C=O)N,0.1763 | |
| CC1COCC(O)C1=O,0.23 | |
| O=CC1C2CN1C21CC1,0.2084 | |
| OCC1CC2CC2C1,0.3366 | |
| O=C1NC2C3CC(N1)C23,0.2907 | |
| OC1CC23CC4C2C1N34,0.2959 | |
| CC(=O)OC=NC,0.2435 | |
| CNC(=N)NC(=O)C#C,0.1688 | |
| CC(C)C1N(C)CC1=O,0.2066 | |
| CCCC1CC1,0.3661 | |
| CC(C)(C#CCO)O,0.2893 | |
| CN(C)c1ccoc1O,0.2301 | |
| C1C2C3C4CCCC13C24,0.355 | |
| CC12C3C4C1OC4C23C,0.3245 | |
| OC(C#N)C#CC=O,0.2016 | |
| COCC12CCC1C2C,0.3264 | |
| OCC1=COC(=N)N1,0.2211 | |
| CC(CO)CC1CCC1,0.3395 | |
| CC(=O)NC(=NC)C=O,0.1817 | |
| C1C2C3CC3C3(CO3)C12,0.3085 | |
| O=C1C=CCNC1C#C,0.1765 | |
| OCCC12CC3C(O1)C23,0.305 | |
| O=C1CN2C3CCC2C13,0.2088 | |
| CC1C2OC1C1CC2C1,0.3126 | |
| CC(C)n1c(=O)[nH]cn1,0.2343 | |
| CC12C3C4C(N14)C23C#N,0.2389 | |
| CC(O)C12CC1CC2C,0.315 | |
| [NH3+]C1(CCC1)C([O-])=O,0.2692 | |
| CC1N2CC2C1(C)O,0.2912 | |
| CN=COC(CO)C=O,0.2107 | |
| CC1=C2COCC2CC1,0.2463 | |
| CC12CCC3NC3C1O2,0.3073 | |
| C1CC1CCC#CCO,0.2772 | |
| c1c(cnc(n1)O)C#N,0.207 | |
| CN1CC=CNC1=O,0.223 | |
| C1C2NC3CN=COC123,0.2344 | |
| CN(C=NCC#C)C=O,0.2355 | |
| CCC1=CNCC1=NO,0.1772 | |
| Cc1c(non1)CO,0.2505 | |
| CCC1=CCC2OC2C1,0.2615 | |
| CC1OCC2COC1C2,0.3139 | |
| CCCC1COCCO1,0.3243 | |
| O=C1OCCC11CN1,0.264 | |
| CC(C)(CC1CC1)O,0.3228 | |
| CC12CCCC(=O)C1N2,0.2209 | |
| CCC1C2CC(C#N)N12,0.2589 | |
| CC12OC3C1C1(CN1)C23,0.3051 | |
| CC(CC=O)NC=O,0.2288 | |
| CC(C)CC1CC(=O)O1,0.2858 | |
| OCC1OC(=O)C11CN1,0.2555 | |
| CCc1nc(on1)N,0.251 | |
| Cc1c(ocn1)CC#C,0.239 | |
| CC1C2OC1C2(O)CO,0.2915 | |
| CCC(C)C(CO)C#N,0.3093 | |
| c1(=O)c(=O)onc(o1)N,0.1777 | |
| C#Cc1c(c[nH]n1)N,0.1987 | |
| CC12C(O)C1C1C(O)C21,0.2701 | |
| Cc1cn[nH]c1C2CC2,0.2367 | |
| N#CCC12CC3CC1C23,0.2973 | |
| CC(=O)C#CC(O)C=O,0.1971 | |
| c1c2c(ncn1)CCC2,0.2102 | |
| CC1(CN2CC12)NC=O,0.2599 | |
| CC(=O)C1CC(C1)=NO,0.2249 | |
| CC12C(O)C3(O)C1CC23,0.3097 | |
| OC1C2CCCC2C1=O,0.2182 | |
| COC12CC(C1)C21CO1,0.3457 | |
| OC1(CC1C#N)C=O,0.2146 | |
| CCC1CN=C(CO)O1,0.2752 | |
| CC1(CN1)C1=NOC=C1,0.2451 | |
| OC1CCCC2OC2C1,0.3306 | |
| N=C1CC2C(O1)C2C#N,0.2703 | |
| OC1CN2CC2C=C1,0.2277 | |
| CC1CC11OC(=O)C1N,0.248 | |
| C1C2CC3N=COCC123,0.27 | |
| COC=NC(C)CC=O,0.2211 | |
| C1CC1C1C2CCOC12,0.3137 | |
| CC12CC(O)CCC1N2,0.3017 | |
| OC1C23CC=CC12CO3,0.2163 | |
| CC12NC3C1OC23C#C,0.243 | |
| O=C1C=CC2OC12C#N,0.1748 | |
| CN1C(CO)C1(C)C,0.2882 | |
| CC1(C#N)C(N)C1C#C,0.2481 | |
| O=CC1CCC2CN1C2,0.1989 | |
| C(Cn1nnnn1)CO,0.2446 | |
| CC1OC2(CO)CC12,0.3016 | |
| CCC(C)COC(C)=O,0.2848 | |
| CN1C2C3CC3C12CO,0.2709 | |
| FC1=CC(=N)NN=C1F,0.1591 | |
| OCC#CC1CC(=O)N1,0.2657 | |
| O=C1C2C3NC1C23C#C,0.2186 | |
| CC12OC3C1C2C3C#C,0.2783 | |
| CCC12CC(O1)C21CO1,0.3258 | |
| OCC1CC(C=O)C1O,0.2151 | |
| CC1OC(C#C)C(=N)O1,0.2754 | |
| CC1C2CC3CC1C23O,0.3053 | |
| C1C(=O)COC(=N1)C#N,0.202 | |
| CCC1OCC(C)=C1,0.2489 | |
| CC1OC2(C)C1CC2=O,0.202 | |
| CCC12NC1CN1CC21,0.2915 | |
| NC1(CC1C#N)C#C,0.2716 | |
| CCCC(C)CCC,0.3796 | |
| C1C2N1C1(CC1)C21CC1,0.3074 | |
| O=C1OC2C1NCC2=O,0.1935 | |
| OCC1=CCC(C1)C=O,0.2198 | |
| OC12CC1OC(=N)C=C2,0.1967 | |
| O=CC12NC1C1NC21,0.1897 | |
| C1C2CC11CCOCC21,0.3344 | |
| CC(C=O)C1=CCCC1,0.2049 | |
| CC1CNC(=O)C1C#C,0.2581 | |
| O=C1CC2CN2C(=O)N1,0.2389 | |
| N=CN1CC1(C#C)C#N,0.2388 | |
| OCC1OCOCC1O,0.3291 | |
| CC1=C(F)OC=NC1=N,0.2001 | |
| COCCC(C)NC=O,0.279 | |
| CC1C2CC2(C=O)C1O,0.2203 | |
| OC1C2C3CC1(C#C)C23,0.2751 | |
| OCCC1OC2CC12,0.315 | |
| CC1CC1OC(=O)C#N,0.2232 | |
| CC1(C)C(CO)OC1=N,0.2885 | |
| CC1C2C3CCC3C12O,0.3041 | |
| CC1CC(O)C1OC=O,0.2691 | |
| C1C2C3C2C2C4C1C4C32,0.3069 | |
| CCCCC(C)C1CC1,0.3606 | |
| N#CCC1CO1,0.3149 | |
| CC12OCC1C1OC21,0.3002 | |
| CC1C2C3CN3CC12O,0.2905 | |
| COC(C)(C=O)C1CO1,0.2087 | |
| NC(=O)C1C2CC1(O)C2,0.2715 | |
| CCn1ccc(n1)C=O,0.2001 | |
| Cc1c(c(on1)C#N)N,0.1849 | |
| CC1(N)C(=O)OC11CC1,0.2511 | |
| CCCC1=NCC(=N)N1,0.2307 | |
| C1COC(O1)CC(=O)N,0.2734 | |
| C1C2CC1N=CO2,0.2649 | |
| C1OC2OCC1C=C2,0.2443 | |
| [O-]C(=O)CC1CCC[NH2+]1,0.2762 | |
| CN=C1CNC(=O)N1C,0.2411 | |
| C#CC1C2OCC3C2N13,0.2591 | |
| c1c(oc(=O)c(n1)O)F,0.1664 | |
| CCC(=O)NC1COC1,0.2746 | |
| N#CC1OC2CC2O1,0.273 | |
| COC12C3C4N3C1C24C,0.2731 | |
| CC1C2C(O)C1C2=O,0.241 | |
| CCOC1(C)OCC=C1,0.2625 | |
| CCN=CN(C)C(=O)C,0.2282 | |
| CC1CC(NC=O)C1=O,0.2191 | |
| c1c(n[nH]c1NC=O)N,0.1946 | |
| CCOC1(C)C2COC12,0.2981 | |
| ON=C1C=CCC2NC12,0.1911 | |
| CC1(CCCOCC1)C,0.3152 | |
| O=C1CN2C3CC(C3)C12,0.203 | |
| OC12C3C1C1N=C2OC31,0.1775 | |
| C1C2OCCCC=CC12,0.2367 | |
| OCC1COC(=N)C1=O,0.1866 | |
| CC12CC(O)(C1)C21CO1,0.3257 | |
| CC1OC(=O)NCC1O,0.2958 | |
| OCC1CCC=CC1O,0.2579 | |
| OC(C=O)C1CC(=N)O1,0.221 | |
| CC#CCC12CC1CC2,0.2961 | |
| COC(C)C1(C)CC1O,0.2934 | |
| CC(O)C(C)(C)C1CC1,0.3319 | |
| CN1CCOC2C(O)C12,0.2814 | |
| c1cncncc1=O,0.1579 | |
| CC#CC1CC2CC12,0.2942 | |
| OC1COC2CC12,0.3056 | |
| CC1CC1(N)C#N,0.281 | |
| CCCC1(C)CN2CC12,0.3082 | |
| c1nc([nH]n1)NC=N,0.218 | |
| C#CC(=O)c1ccn[nH]1,0.1815 | |
| C1CC(=O)NC(=O)C1,0.2349 | |
| CC(C)C(C)(C=O)C#N,0.2215 | |
| OC1CN2CC1(C2)C=O,0.2024 | |
| CC1(CC(=O)C=O)CN1,0.1607 | |
| C#CCOc1c[nH]nc1,0.2327 | |
| CC(=NO)C1COC1,0.2507 | |
| CC1OC1C12CN(C1)C2,0.3106 | |
| OC12CCC3C(C=C1)C23,0.2416 | |
| CC1(O)C2C3OC3C12,0.2815 | |
| O=C1OCC2OC1C=C2,0.2196 | |
| c1cc(=O)[nH]c(c1O)N,0.166 | |
| O=C1OC2(CC1C2)C#C,0.2756 | |
| OCC1=CC=NNC1=N,0.1634 | |
| CC(C)C1=CC(=O)CC1,0.1939 | |
| O=CCC1CC1CC#N,0.2263 | |
| CC(O)C12OC1C1OC21,0.2931 | |
| c1c(nnn1CCO)O,0.2244 | |
| CC1OCC2NC12C#N,0.2709 | |
| CC(C)(C#C)C1CCO1,0.2979 | |
| C1CC1C(=O)CCC#N,0.2351 | |
| CCC12CN1CC2OC,0.2991 | |
| CC(=O)C1CC2OC2C1,0.2353 | |
| C1CC1C2=CCC(=O)C2,0.2162 | |
| CN1CC(O)C1C1CO1,0.2928 | |
| OC1C2CC2CC1C#N,0.301 | |
| CC(O)C1(N)COC1=N,0.266 | |
| OCC1(CO)CC1C#N,0.2853 | |
| CC12CCC(O1)C2C#N,0.2937 | |
| CC12OC3(C=O)C1OC23,0.2009 | |
| CCC1(O)CC(C)(O)C1,0.3149 | |
| O=C1CC2CC3C2C13,0.2228 | |
| O=COC12CC(C1)OC2,0.2583 | |
| CC(=O)OC1CCC1O,0.2702 | |
| CC1CC2CC(C#C)C12,0.2952 | |
| COC12CC1(C)CC=C2,0.2452 | |
| N=COCC1CN1,0.2756 | |
| CNC(=O)C1CNC1=O,0.2602 | |
| CC12CC1(O)C(O2)C#N,0.2506 | |
| N#CCC1C2CN1C2,0.2761 | |
| OC12CC(C1)CC1OC21,0.3294 | |
| CC(C#N)C(O)C1CO1,0.3201 | |
| CCN=COC(=O)C=O,0.1674 | |
| CC1C=CC2=CCCC12,0.1933 | |
| CC1CCOC1OC=O,0.278 | |
| CN(CC1CN1)C(N)=O,0.29 | |
| Cc1ncc(n1C)OC,0.237 | |
| CN1CC2(C)C(C=O)C12,0.1988 | |
| O=CC1NC11CC2NC12,0.2181 | |
| c1coc(c(c1=O)F)N,0.1931 | |
| CC(O)(CN)C#N,0.2957 | |
| NC(=[NH2+])OC1=NC=N[N-]1,0.2542 | |
| O=C1CC2C3CC12C=C3,0.2082 | |
| CC(=O)C(C(=O)C)OC,0.2104 | |
| CCC1NC1C(=O)C#N,0.189 | |
| OC1(CC1)C1CN2CC12,0.2854 | |
| CC1OC(=O)OCC1=O,0.2153 | |
| CC1=CCC(O)C2OC12,0.2382 | |
| CNc1c(n[nH]n1)C=O,0.1719 | |
| OC1C2CCOC=NC12,0.2467 | |
| NC1(C#N)C2C3CC1N23,0.2751 | |
| O=CC1CC2CC1CO2,0.2168 | |
| C1CC1OC=NCC=O,0.2207 | |
| CN1CC2(O)C1C2(C)O,0.2548 | |
| CC(=O)CCNCC#N,0.2285 | |
| CCC(C)(C=O)C1CO1,0.2236 | |
| CC1CC1C(O)CO,0.3164 | |
| NC1=CC(=N)N=NN1,0.1622 | |
| CC(C1CCO1)C(N)=O,0.2634 | |
| c1cc(n(c1)CC=O)O,0.1594 | |
| O=CC1(CN1)C#CC#C,0.1957 | |
| CCC1(C)OCC11CO1,0.3252 | |
| CN(C=N)C(=O)CC#N,0.2352 | |
| CCCC1(CO)CN1,0.3117 | |
| N=C1NC(=CCO1)C#C,0.1837 | |
| Cc1c(oc(=O)[nH]1)CO,0.2289 | |
| CC1CCC(O)CC1,0.3179 | |
| CC1=CC(=NC)OC1=O,0.1896 | |
| CC1C[NH2+]C1CC([O-])=O,0.275 | |
| COC1CCC2(CO2)C1,0.3213 | |
| CC1N=C2NCC2C1=O,0.2071 | |
| O=CN(CC1CN1)C=O,0.2149 | |
| COCC(=O)C(C)OC,0.2293 | |
| OCC(=O)C1(CO1)C=O,0.2081 | |
| COC(=O)C(C)N,0.2491 | |
| CC1=CC2C3C=CC2C13,0.194 | |
| CC#CC1CC1CCO,0.2824 | |
| CN1C2CC1(C#N)C2N,0.2356 | |
| CCC#CC(N)CC#N,0.2713 | |
| CC(=O)CN1CCC1=O,0.2152 | |
| C1C2COC3C=CCC123,0.2601 | |
| C1C2CCN=COCC12,0.2648 | |
| Cn1cc2c(n1)OCO2,0.2188 | |
| Cn1ncc(n1)C2CC2,0.2377 | |
| CC(=O)Oc1cnco1,0.231 | |
| C#CC1C2NC2C11CO1,0.2808 | |
| C1C2CC3CCCC13O2,0.3175 | |
| COC1CC=C(C1)C=O,0.1943 | |
| C1COCC(=O)N1,0.2644 | |
| N=C1OC2CC3C1N3C2,0.2545 | |
| CCC12CC1(C)CC2,0.3217 | |
| N=COCCC1CCO1,0.2797 | |
| CCCC(C)CCC#C,0.3158 | |
| c1c2n(c(n1)C#N)CC2,0.2088 | |
| O=C1C2CN2C1CC#C,0.2172 | |
| C1C(=O)N(C=N1)C=O,0.2213 | |
| CC1(O)C2COCC12,0.3206 | |
| CCC12CCC1(C)OC2,0.3059 | |
| OCC1OC(CO)C=C1,0.2413 | |
| c1cn(nn1)CC#N,0.2539 | |
| CC#CCC(=O)C=O,0.1481 | |
| CCN1C2CCOCC12,0.3016 | |
| CCC1CC1(C)C,0.3443 | |
| OCC1OC=NCC1=O,0.2022 | |
| CC(C)(C)c1c[nH]cn1,0.2528 | |
| CC1C2C3(C)NC3C12C,0.2772 | |
| CC12CC1OCC2(C)C,0.2983 | |
| NC(CC#C)C(O)C#N,0.2901 | |
| O=C1OC2CC3C2N13,0.2837 | |
| OC(CC(F)(F)F)C#N,0.3176 | |
| NC1=CNC=C(O)C1=N,0.1676 | |
| CC12CN3CC3CC1N2,0.2987 | |
| C(C=O)C(=O)NCC=O,0.2159 | |
| O=C1OC2CNC12C#C,0.2323 | |
| CC1=C2C3OC3C2OC1,0.2256 | |
| CC1C(N)C1(CO)C#N,0.2645 | |
| CC(CO)OC(C)CO,0.3167 | |
| CCC1CC2OC12C#C,0.2625 | |
| COC1(C)C(O)C1(C)O,0.2961 | |
| CCc1c(ocn1)NC,0.2148 | |
| CC(O)CC12CN(C1)C2,0.2846 | |
| CC1CN=C(CC#N)O1,0.2619 | |
| CCC1(CN1)C(=O)CO,0.2268 | |
| Cc1ncc(cn1)N,0.19 | |
| NC(CO)C1=NC=CO1,0.2409 | |
| N=C1OCOCC2OC12,0.2603 | |
| NC1(CC(C1)C#C)C#N,0.2779 | |
| COC1CC2CCC2=C1,0.2486 | |
| CN=C1C=C(CO1)C#C,0.1759 | |
| O=C1COCC2NC2C1,0.2108 | |
| OCCC1C2OCOC12,0.3271 | |
| CC1=CC(=NO)C(=O)N1,0.1466 | |
| c1cc(c(cc1N)F)F,0.2005 | |
| C1OC2OCC=CC2=C1,0.1997 | |
| CC12NC3C(NC13)C2O,0.2856 | |
| OC1C2COC1C2C=O,0.2129 | |
| CC1(NC1C=O)C1CO1,0.2192 | |
| CC1=C(C)C(O)CC1O,0.254 | |
| NC(=O)C1CC(=N)O1,0.2665 | |
| CC1CCCC(=C1)C#C,0.2112 | |
| CC1(C)CCC2OC12,0.338 | |
| CN=C1CCC=CCO1,0.2394 | |
| NC(=[NH2+])[C-](C#N)C#N,0.201 | |
| CCC1(O)CCOC1=N,0.2862 | |
| CC1(C)CC2C(O)C2O1,0.3014 | |
| CC1OCCO1,0.3439 | |
| CNc1cc(co1)C#N,0.1863 | |
| O=C1CC23CC2(CN3)O1,0.2247 | |
| c1c[nH]c(=O)c(c1F)F,0.1841 | |
| CCN1C(CC1=O)C#C,0.2717 | |
| C1NC1C1=CC2NC2C1,0.2318 | |
| COC1CC(C)N2CC12,0.3109 | |
| Cc1cc(oc1C=O)N,0.169 | |
| O=CC1=CCC2OC12,0.1891 | |
| C1C2OCC3COC12C3,0.3068 | |
| c1[nH]c(c(n1)N)CO,0.2136 | |
| CCC(C=O)N(C)C=O,0.2054 | |
| C1CC11OC2CC1CO2,0.3192 | |
| CNC(C#N)C(=O)C#C,0.1673 | |
| Cn1ccc(c1)N2CC2,0.2276 | |
| OCC12CC1C1CC21O,0.2641 | |
| NC(=[NH2+])NCCC([O-])=O,0.2577 | |
| CC12NC1C1OC1C2O,0.2986 | |
| Cc1cccn1C(=O)N,0.2026 | |
| N=C1NC(=O)CNC=C1,0.1855 | |
| CC(=O)C(=O)C#CC#N,0.1411 | |
| CN1CC(=O)C2(CO2)C1,0.1777 | |
| N=C1N=CC(=O)NN=N1,0.1689 | |
| C1C2C1C1OC2C2CC12,0.3417 | |
| CC1C2C3OC3C2C1=O,0.2143 | |
| CC1OCC1(C)C,0.3176 | |
| CC1(CN1)C1(O)CC1O,0.2965 | |
| CN1CC2NC(=O)C=C12,0.2064 | |
| COC(=O)C(=O)N,0.2059 | |
| CN(C(=N)N)C(=O)OC,0.2463 | |
| CC12CC(=O)C1(O2)C#N,0.2147 | |
| CCC1(O)CC(C)C=C1,0.2588 | |
| OC1CCC1OC1CC1,0.3147 | |
| CN(C)c1cnn[nH]1,0.2247 | |
| C1CC23C4CC2(C4)OC13,0.2968 | |
| N#CCC12CC1C1NC21,0.2525 | |
| C1CN1C12C3C4C3C1C24,0.3004 | |
| CC12COC1C2(O)CO,0.2943 | |
| CCC12CN1C(C2)C=O,0.2158 | |
| COC(=O)COCC#C,0.2754 | |
| CC1(CCCC1)OC,0.3244 | |
| NC1=CC=C(N1)C1CN1,0.2263 | |
| CC1CC(C=O)C1(C)C,0.2182 | |
| C#CC1(OC1C#N)C#N,0.2468 | |
| C1CCC(C1)C(=O)CO,0.239 | |
| O=C1CC2CCC1CC2,0.2216 | |
| OC1CC(=N)OC(=O)C1,0.2521 | |
| [O-]C1=CC(NC=[NH2+])=CO1,0.0709 | |
| CN(C=N)c1cc[nH]n1,0.21 | |
| CC1C2CC1C(=O)CN2,0.2072 | |
| CC1C2NC2C1C(N)=O,0.2633 | |
| CC1(OC2CC1C2)C#N,0.287 | |
| N1=CC2=C(N3CC2C3)N1,0.2395 | |
| CC1CN2N=NC(C)=C12,0.2501 | |
| N#CC12OC1CC21CC1,0.2699 | |
| C1OC23C4C5C2CC13N45,0.2473 | |
| CC1OC1C1=NOC=C1,0.2441 | |
| O=C1CCC11C2CCC12,0.2087 | |
| OC12C3C1C1C3C2C1=O,0.2146 | |
| CC1CN(C=O)C1CO,0.2656 | |
| CC1CC2(O)C3CC2C13,0.3294 | |
| CC12NC1C1C(C=O)C21,0.227 | |
| CC(=O)C(=O)NC(=O)N,0.1693 | |
| OC1CCOCC1=O,0.2122 | |
| Cc1cnoc1C(C)C,0.2391 | |
| CC1C2CC2C1C,0.3364 | |
| C#CCn1c(=O)onn1,0.2314 | |
| c1coc2c1ocn2,0.2014 | |
| CC(C)(CCCO)C#N,0.317 | |
| CC1CC1C1=NOC=C1,0.2464 | |
| CN=C1NCC1(N)C#N,0.2399 | |
| C1OC2C3NC22C1OC32,0.1985 | |
| COC12CN3C1C2C3=O,0.2389 | |
| CC12C3NC3C3C1OC23,0.3096 | |
| OC1CCC2(O)COC12,0.2976 | |
| CC12CC(NC=O)C1N2,0.275 | |
| [NH3+]CCC1(CN1)C([O-])=O,0.2642 | |
| N=C1N=COC=C1C#N,0.1903 | |
| Cc1cnnnn1,0.1686 | |
| C#Cc1c(nno1)C=O,0.177 | |
| COCc1c[nH]nc1,0.2603 | |
| CCCC(CC)CCC,0.384 | |
| CC(C1CN1)C(=O)C#C,0.1823 | |
| CC1C(C)C2=CN=NN12,0.2602 | |
| CC1C=C(CC1=O)C#N,0.2066 | |
| c1c([nH]c(=O)[nH]1)CC=O,0.1646 | |
| NC(=O)C1=CC2OC2C1,0.2074 | |
| C1C2CC34CC(O3)C4C12,0.3118 | |
| CC#CC(=O)CCO,0.2092 | |
| NC1=NC2CC2O1,0.2715 | |
| OC12CC1CCCCC2,0.3245 | |
| CC1=NNC(F)=CC1=N,0.1842 | |
| O=CC1COC(C1)C#C,0.2279 | |
| N=C1NC(CC#C)=NO1,0.2311 | |
| c1(c([nH]nc1O)N)N,0.2442 | |
| c1c2c(on1)CNC2,0.223 | |
| CCC(=O)NCC#C,0.2718 | |
| C1C=C2C3C4C3C2C14,0.1625 | |
| CC1=CC2CC11OCC21,0.232 | |
| CNC(=O)CC(C)OC,0.2754 | |
| CCCC1CC(=N)O1,0.2899 | |
| CCC(C)(O)CO,0.3155 | |
| c1cc(ncc1O)O,0.188 | |
| COCC1CC(C1)=NO,0.2488 | |
| CCC12NC1(C)CC2=O,0.2203 | |
| COCCc1cocn1,0.2459 | |
| CCc1c(c[nH]n1)N,0.2259 | |
| CCC1OC11COC1=N,0.2719 | |
| CCC1(CO1)C(C)C=O,0.2197 | |
| C1OCC11C2C3C1CN23,0.316 | |
| CC1(C)C2C3C1CN23,0.3159 | |
| CC1(C)C2N1CC2=NO,0.2278 | |
| c1c(oc(n1)N)C(=O)N,0.1972 | |
| CC12NC(=O)C1(N)C2O,0.2376 | |
| OC1C2NCC(=N)OC12,0.2508 | |
| CC1CC11C(O)C2CN12,0.2963 | |
| CC12CC1C(=N)O2,0.2797 | |
| O=C1C2CC2OC11CC1,0.2122 | |
| CCC(C#N)C(=O)OC,0.2804 | |
| CCN(C)C(=O)C1CO1,0.2504 | |
| OC(C=O)C1CC(O)C1,0.2187 | |
| CC1C2CC2C11CCO1,0.3094 | |
| NC(=[NH2+])C1=CNC=C1[O-],0.1848 | |
| CC1OCC11CC(=O)N1,0.2811 | |
| CC12CC3OCCN1C23,0.3055 | |
| CC1CC(C2CO2)C1C,0.3403 | |
| CC1=CC2OC3CC2C13,0.2461 | |
| OCC12CC=CCC1O2,0.2696 | |
| CC12COC3C1N2C3=O,0.2261 | |
| COC1C(C)C1(O)CO,0.3021 | |
| OC1CC1(O)CCC=O,0.227 | |
| CC12CCC(O1)C2=O,0.2333 | |
| CC(O)C1COC1(C)C,0.3056 | |
| COC12CC1C(C)C2,0.3324 | |
| CC1NC1CN1CC1,0.3082 | |
| N=COCC1(CN1)C=O,0.2235 | |
| OC(C=O)C1CN2CC12,0.1981 | |
| OC1CC2=CON=C2C1,0.2399 | |
| CCCOC1CCCC1,0.3263 | |
| CC12OCC1C2(O)CO,0.2959 | |
| c1c(non1)NC=N,0.2072 | |
| CC1COC11C2CCC12,0.2909 | |
| OCC1CC1N1CC1,0.3148 | |
| O=CC12CC(C1)(N2)C#N,0.2149 | |
| CC1C2C1C1OC2C1O,0.3334 | |
| CC12CC1C(C2)C#N,0.3028 | |
| CC1NC1COCC=O,0.2251 | |
| CC#CC1CCN=CO1,0.2694 | |
| CC12CN1C(C2)C=O,0.216 | |
| CC12CC1C(=O)CNC2,0.2014 | |
| C#CC1NC2COC12,0.2661 | |
| c1c(nn[nH]1)C2CCC2,0.2465 | |
| O=CC#CC1NC1C=O,0.1895 | |
| CN1C(=O)CC12COC2,0.2778 | |
| CC1NC11COC1C=O,0.2062 | |
| N=COC(C=O)C#C,0.207 | |
| CCOC1COCC1O,0.312 | |
| OC1=NC(=N)N=CN1,0.2006 | |
| COc1c(nc(o1)N)N,0.2151 | |
| CCOC12CC1N(C)C2,0.2958 | |
| CC(O)C1(CCO)CO1,0.3361 | |
| CC(=O)Nc1cnon1,0.2198 | |
| CC12CC3C(C=C1)N23,0.2177 | |
| CC1OC2(CC12O)C#C,0.2405 | |
| CC1(C)OC(=N)NC1=N,0.2539 | |
| N#CC12NCC1CC=C2,0.2323 | |
| O=COC1CNCC1=O,0.1921 | |
| CCC1CCC(=O)C=C1,0.1876 | |
| COCC(=O)OC1CC1,0.2772 | |
| CC1C(CO)N1C=O,0.2553 | |
| CC1(CO)C2C3CN2C13,0.2973 | |
| COC(=N)NC(=N)CN,0.2448 | |
| CC1(CC#C)C2CC1C2,0.3138 | |
| CC1(C)C(CO)C1(C)O,0.3052 | |
| NC(=O)C12CC1COC2,0.2714 | |
| CCC1(O)C2C3CC3C12,0.2754 | |
| CN=CN(C)C(=O)OC,0.2431 | |
| c1[nH]c(c(n1)C=O)N,0.1932 | |
| CC1C(=O)C2CN2C1=O,0.2064 | |
| CCC1OC2(CC12)C#N,0.256 | |
| OCC(O)C(F)(F)F,0.3313 | |
| CC1CCCC=C1C=O,0.1963 | |
| CC12C3OC(C13)C2C=O,0.2061 | |
| CC1(O)CC1C(F)(F)F,0.3374 | |
| CC(C)C1(CN1C)C=O,0.214 | |
| CC(=O)C12C3CC1CN23,0.2182 | |
| OC1C2NC1C2C#C,0.2884 | |
| CC1(O)CCCN2CC12,0.2807 | |
| COC1C2CC2OC1=O,0.2441 | |
| OCC1C2NCC(=O)C12,0.1996 | |
| COC(C#C)C#CCO,0.2717 | |
| OC1CC2NC2C1=O,0.2105 | |
| OC1CN2CC12C1CN1,0.2916 | |
| C1CCOC(OC1)C=O,0.2248 | |
| CCc1cn(cn1)CC,0.2481 | |
| OC1CC2CC3OC3C12,0.3242 | |
| CCC1C(C)N1CC#N,0.2682 | |
| CC1(C)C2CC1N=CO2,0.2577 | |
| Cc1c(nc([nH]1)C#N)C,0.1976 | |
| C1C=C(COC=N1)C#N,0.213 | |
| CC12CC1C1=NC=NN21,0.2385 | |
| CC(C=O)(C=O)C1CO1,0.2074 | |
| CCCC(=NO)C,0.256 | |
| C#Cc1c[nH]c(=O)[nH]1,0.1858 | |
| OCCC#CC(O)CO,0.279 | |
| NC1=CON=C(F)C1=N,0.158 | |
| CC(=O)CC1(CC1)O,0.2179 | |
| CCc1coc(c1C)N,0.2315 | |
| C1CCC=CC=CC1,0.2059 | |
| OC12CC3C1C(C#N)C23,0.3035 | |
| CC12OC=NC1(C)C2O,0.2498 | |
| NC(C#N)C(N)C1CC1,0.2641 | |
| CC(C)C1CC1(C)C#N,0.3153 | |
| CC1OC1(C#N)C1CN1,0.2578 | |
| O=C1CCCC1C1CO1,0.2193 | |
| CCC(CC)NC=O,0.2825 | |
| OC1CCCC(C1)C=O,0.2252 | |
| CNC(=O)C(C)(O)C=O,0.2136 | |
| CN(CC#N)C(=O)C#C,0.2268 | |
| NCC1(NC1C#N)C#N,0.2386 | |
| OC(CCC#C)C1CN1,0.2929 | |
| CCC1(O)C2OC1C2=O,0.2449 | |
| C1CC23CC=CC2(C1)N3,0.2434 | |
| CNc1c(nn[nH]1)NC,0.2195 | |
| CC12CC1NC(=O)NC2,0.2885 | |
| CC1NC1C1=CC=CN1,0.2335 | |
| COC(C)C1CN1C,0.291 | |
| CCC1(NC1(C)C)C=O,0.2228 | |
| CC1CC(CC=C1)C#N,0.2644 | |
| CC1CCCC1C=O,0.2256 | |
| CCCC1CC=CCO1,0.2675 | |
| CC1OCC1OCC#N,0.2629 | |
| N=C1OCC2=C1OC=N2,0.2064 | |
| CCC1(O)CC(C)C1=O,0.2014 | |
| CCc1c[nH]c(c1C)N,0.2442 | |
| N#CC1COCC2CN12,0.2686 | |
| c1c(=O)ncn(n1)C=O,0.1716 | |
| CC1(CC(=O)NC=N1)C,0.2339 | |
| CN=C(C=O)N1CC1,0.1638 | |
| CC(O)CN1N=CC=N1,0.2469 | |
| CC1(O)CNC(=O)C1=O,0.1668 | |
| NC1=NC=NC(=O)C=N1,0.1647 | |
| CCc1c(cno1)C=O,0.2061 | |
| CC1C2C3CC3C1C2O,0.3196 | |
| CC(C)OC(C#C)C#N,0.2733 | |
| Cc1c[nH]cc1C(=O)C,0.1986 | |
| C1C=CC2CC=CC1O2,0.2652 | |
| FC1=CNC(=N)C=C1F,0.158 | |
| CC12CCC1C(O2)C=O,0.2127 | |
| c1c(n(c(n1)N)C=O)N,0.1653 | |
| CC1C2(C)C3CN3C12C,0.2845 | |
| C1C(=CNC(=O)O1)C#N,0.1954 | |
| OC1COC11CN2CC12,0.2835 | |
| CCCC(CC)COC,0.3378 | |
| c1c[nH]c2c1COC2,0.2401 | |
| COC(CO)(C#C)C#N,0.2658 | |
| CC1C2C3C2C2CC3C12,0.3483 | |
| O=CCC1CC=CCO1,0.2226 | |
| CC12CC3NC1C23C#N,0.2434 | |
| N#CCC12C3CC1OC23,0.2739 | |
| COC12CC(O)C1C2O,0.2811 | |
| O=CC1OC2C3OC1C23,0.2054 | |
| [NH3+]C1C[C-]2OC(=O)C=C12,0.1782 | |
| CCC(CC)C#CCO,0.2762 | |
| CC1C(NC=O)C1(C)O,0.2615 | |
| CC(C=O)C1OC1CO,0.2254 | |
| CC(CO)(C=O)C#N,0.2209 | |
| CC(C)(C)CCC(=O)N,0.2788 | |
| CC(=O)OCCC1CO1,0.2839 | |
| CC1CC=C(C#N)C1=O,0.1835 | |
| O=C1C2CC3(CN3)C1O2,0.2243 | |
| OCC1CCCC(O)C1,0.3361 | |
| CC1NC1CC#CC#N,0.2276 | |
| OCC1(NCC1O)C#N,0.2712 | |
| OCCC1C2CCC1O2,0.3179 | |
| NC(C#N)C1CC1C#N,0.2899 | |
| CCC1OC2C(C)C2O1,0.3336 | |
| CCCCOC1CC1C,0.3303 | |
| C1CC23CC(C2)OCC13,0.324 | |
| OC1CNC2=C1OC=C2,0.2058 | |
| c1cnc(=O)n2c1CC2,0.1849 | |
| OC1C2COC1C2O,0.2955 | |
| CC(=O)C(C)(O)C1CC1,0.227 | |
| C(C=O)NC(=O)C=O,0.1729 | |
| Cc1c(cnnc1N)O,0.1953 | |
| COC1C2CN2C1C,0.3045 | |
| O=C1NC2CC2N2CC12,0.2468 | |
| C(C=O)OC(C=O)C=O,0.1989 | |
| N=COCC1=CCOC1,0.2421 | |
| C#CCC1=NCC(=O)N1,0.2351 | |
| CC1CC=CC11COC1,0.258 | |
| O=C1NC2C3C4OC13C24,0.2489 | |
| CC1C2N1CCC21CO1,0.3113 | |
| CC1CC2CC(C)OC12,0.3206 | |
| Cn1ccnc1O,0.2485 | |
| COC1CC1(C)O,0.3153 | |
| CC12CNC1C2(O)C#N,0.2609 | |
| CCC(=O)CCOC=N,0.2354 | |
| CC1CN2CC2(C)C1=O,0.2149 | |
| O=C1OCCCC2CN12,0.2697 | |
| O=CC1OC2CC12C#N,0.2156 | |
| C1CC23NC12CCC=C3,0.2174 | |
| OC1C2OC2C1C1CC1,0.3196 | |
| CC1OC1C(CO)C#N,0.3016 | |
| CC1(OC1CCO)C#N,0.286 | |
| C#Cc1cnc(nn1)N,0.1647 | |
| O=CC12CCC3CC1C23,0.2251 | |
| CC1CN(C)C(=N)C1=O,0.1687 | |
| CC#CC1(C)CC1CO,0.2852 | |
| OCC1CC2(O)CCC12,0.3178 | |
| C#Cc1nccc(n1)F,0.2036 | |
| CCOCC(=O)C1CO1,0.2239 | |
| CC1C2C(O)CC12C#N,0.2842 | |
| CC(C)C1C2CCCC12,0.3306 | |
| CCN1C(C)C(=O)C1C,0.2083 | |
| CC#CC#CC(C)(C)C,0.2283 | |
| Cc1c(cncc1F)O,0.2113 | |
| CNCC[NH2+]CC([O-])=O,0.2529 | |
| NC(CO)(C#N)C1CO1,0.2842 | |
| CCC1=COC(=N)O1,0.2369 | |
| CC1(CC1)C1OC1(C)C,0.342 | |
| C1CC2(CC=CC2)O1,0.2668 | |
| CCC1CC2(CO)OC12,0.3265 | |
| CC1CN=C(CC=O)O1,0.2284 | |
| CCC1C2CC(CO)C12,0.323 | |
| C1C=Cn2c1c(nn2)N,0.1772 | |
| CCCn1ccnc1,0.2535 | |
| CC12OC3CC1C2C=C3,0.2371 | |
| c1nc(n(n1)C=O)O,0.216 | |
| OC(CN1CCC1)C#N,0.2699 | |
| OCC(O)(CC=O)C=O,0.2046 | |
| O=C1C2C3C2N2CC1C32,0.2146 | |
| CC1=CC2N3C1CC23C,0.215 | |
| CC(C)C(=O)OC=NC,0.2426 | |
| CC1C2C3C4C1CC4N23,0.2957 | |
| CCC1C(O)C1(C)CC,0.304 | |
| ON=C1CCC2(O)CC12,0.2429 | |
| CC1(CN1)C1OCC1=O,0.2149 | |
| OC1CC11NC2CC12O,0.2926 | |
| Cc1c(cno1)CC#N,0.2403 | |
| N=C1NN=C(N1)C#N,0.1673 | |
| c1c([nH]cn1)C(=O)N,0.2118 | |
| NC(=O)C1COC(=N)N1,0.2396 | |
| CC1(O)C(CO)CC1=O,0.2166 | |
| COC12CCC1C2C#C,0.2799 | |
| CC12C3CC(C13)N2C=O,0.2481 | |
| CC1=NOC(=O)C(=N)N1,0.1966 | |
| C1OC23C4CC12CC3O4,0.2807 | |
| COC(C)COC(C)=O,0.2765 | |
| OCC1C2CC3CC1N23,0.2851 | |
| CC1CCC2CC2C1O,0.3171 | |
| Cc1c2c(nc[nH]2)n[nH]1,0.2081 | |
| OCC12C3OC1CC23O,0.2879 | |
| Cc1nc(=O)n(nn1)C,0.1638 | |
| C1CCC2(C1)CCC2,0.3572 | |
| CC1CCCC(=O)C1=O,0.1663 | |
| CCC1=CCC(C)(O)C1,0.2587 | |
| N=C1OCCOC1=N,0.2249 | |
| N#CC1C2C3N2CC=C13,0.1631 | |
| CC(C#C)C(O)C#C,0.2827 | |
| CC1(CC1)C(=O)C#C,0.2034 | |
| C1COc2c(nno2)N1,0.193 | |
| c1ccnc(=O)nc1,0.1591 | |
| O=CNC1C2CC2C1=O,0.2175 | |
| CC1(C(=O)NC(=N1)N)C,0.2401 | |
| CC1OCC(C)(O1)C#C,0.2917 | |
| Cc1c[nH]cc(c1=O)N,0.1795 | |
| CNc1nc(nn1C)N,0.2317 | |
| CCC12NC(C1O)C2O,0.3113 | |
| OC1CC=CC11CC1,0.2492 | |
| c1c(c(on1)N)C=O,0.2016 | |
| CCC1=C2CC3C(C1)C23,0.1733 | |
| CC1(O)COCC=C1,0.2537 | |
| OCC1(O)CC1NC=O,0.248 | |
| COC1CNC=C1C=O,0.1847 | |
| COC(C#CC)C1CC1,0.2886 | |
| CC(CC#C)OCCO,0.3102 | |
| C1OC1C12C3C4C3C1C24,0.2964 | |
| c1c2c(n[nH]1)NC=NC2,0.213 | |
| C1C2CC3=CON=C3C12,0.2443 | |
| OC1(COC=NC1)C=O,0.1982 | |
| CCn1ccc(n1)N,0.2304 | |
| OCC1=CC(=N)N=NN1,0.1695 | |
| OCC1NC1(C#C)C#N,0.2522 | |
| O=C1CC2(CC1N2)C#N,0.2235 | |
| CC1(C)CC(O)C1C=O,0.2231 | |
| OC1CCC(CC1)C#C,0.3163 | |
| CC1NC11C2CC1C2=O,0.2514 | |
| COc1cn[nH]c1CO,0.2273 | |
| N=C1OC2CC2CC1=O,0.1889 | |
| CC1=CC2C3C1OC23C,0.2242 | |
| CN1CC23CC(O2)C13C,0.2678 | |
| COC(=O)C(C)(N)C#N,0.2535 | |
| OC(CC1CC1)C1CN1,0.3094 | |
| CC(O)C#CCC(C)=O,0.2295 | |
| O=CN1CC2C1C1CN21,0.2581 | |
| O1C2C3OC4C=CC13C24,0.2226 | |
| CC1(OC=O)C2COC12,0.2491 | |
| CCCC1=NCCO1,0.273 | |
| COC1C(C)C11CCC1,0.3062 | |
| CC1OC=NC1C,0.2696 | |
| NC(=O)C1COC1C=O,0.2217 | |
| N=C1NC2(COC12)C#C,0.2435 | |
| C1C2CC11CCC=CC21,0.2622 | |
| NC(=O)CC1NC1C#N,0.2704 | |
| C1OC2C3COC2C1C3,0.3208 | |
| CNc1c(cc[nH]1)C#C,0.2049 | |
| CN1CC11CCOC1,0.3146 | |
| CCC1(C)C(C=O)N1C,0.1942 | |
| CC1C(O)CCC1=O,0.2198 | |
| Cc1ccn(c1)CC#N,0.2249 | |
| C#CC#CC1(CN1)C#N,0.2078 | |
| CCCc1cn(cn1)C,0.2481 | |
| CCC#CC1(O)CC1O,0.2647 | |
| CC1C2C=CC1C2CO,0.238 | |
| C#CC(C=O)(C#N)C#N,0.2203 | |
| CC(C)(C#C)OCC#C,0.2792 | |
| CCC1NC1C1OC1C,0.3183 | |
| C#CCC#CCOC=O,0.2689 | |
| NC12COCC1NC2=O,0.2529 | |
| NC(COC=N)CC#N,0.266 | |
| CC1CC2OCC2O1,0.3305 | |
| O=C1C2CCC1(N2)C#C,0.2291 | |
| CCc1concc1=O,0.1835 | |
| O=CC1=CCC2CC12,0.1916 | |
| Cc1c(oc(n1)C#N)C,0.1938 | |
| CCC12CC3C1C2N3C,0.2874 | |
| CCOC(=NC)NC=O,0.2352 | |
| CC1C(NCC1=O)C=O,0.193 | |
| OC1CC2(OC12)C1CC1,0.3207 | |
| CNc1c(nc([nH]1)N)O,0.225 | |
| CN1CC1CCO,0.2991 | |
| CC1CCC2CC1(O)C2,0.3248 | |
| CC1(C#N)C2CC1N2,0.2758 | |
| CC1=C(F)N=COC1=N,0.1794 | |
| CCC12OCC1C2C,0.3042 | |
| N#CC1C2CC1N1CC21,0.2767 | |
| C#CC#CCC1CC1,0.2308 | |
| CC1CC2(CC2)OC1=O,0.275 | |
| Cc1c(cc([nH]1)N)N,0.2218 | |
| Cc1c(c(c([nH]1)N)O)N,0.2213 | |
| CN1C2C3C(=O)C1C23C,0.2155 | |
| CC1(CC1)C(=O)C(=O)N,0.1745 | |
| CC1C2C3C1C=CC23C,0.2355 | |
| C1C(CO1)C#CCO,0.2744 | |
| CC(CO)C1OC1(C)C,0.3203 | |
| C1CC1C1C2CCCC12,0.3228 | |
| CCC1(C)C2CCC12,0.3334 | |
| c1nnnn1C(=O)N,0.2395 | |
| NC1(C#N)C2CC1N2,0.271 | |
| CC1=CNCC=CC1=O,0.1622 | |
| COC1C2CC(=NO)C12,0.2414 | |
| CC1C2C3CC2C13CO,0.3326 | |
| CC1OC(=O)C1C1CN1,0.2563 | |
| CN1C=CN=C(F)C1=N,0.1624 | |
| OCC1C2CCC12C#C,0.2676 | |
| N#CC12CC3CC(C1)N23,0.2497 | |
| C1CCOC2(C1)CC2,0.3254 | |
| NC1=NC=NC=CC1=N,0.1628 | |
| COC12CC1(C)OC2=N,0.2727 | |
| CCC1CC(C)(CO)O1,0.317 | |
| C(=Nc1nc([nH]n1)N)N,0.2044 | |
| CC1C=CC2(CN2)C1C,0.2359 | |
| OCC1CC(O)(C1)C#C,0.288 | |
| CC(N)(CC1CO1)C#N,0.2863 | |
| CC1C(=O)CC11CC1,0.219 | |
| OC12C=CC3C4C1N4C23,0.2367 | |
| O=C1C2C3C=CC1CN23,0.1975 | |
| CC1(C(N1C=O)(C)C)C,0.2542 | |
| OCC12CC1NC2C#N,0.2527 | |
| CC1OC2(CC2)C=C1,0.226 | |
| CC(N)C1=NC=NO1,0.2329 | |
| CC1(COC1C#N)C#C,0.2692 | |
| Cc1c(c(n[nH]1)OC)N,0.2373 | |
| C1C=CC=CNC(=O)N1,0.1763 | |
| O=C1CCC2OCC1O2,0.2134 | |
| OCC1C2C=CC1C=C2,0.2164 | |
| CCC1CCC1,0.3752 | |
| C1CC2COCC(C1)C2,0.3102 | |
| OC1C(=O)NC=C1C#N,0.1877 | |
| N=C1CCCC(=O)O1,0.2562 | |
| O=C1CC2C3CC=C1C23,0.203 | |
| OC1C2CC1(O)CO2,0.2878 | |
| OC1C2CC3NC3C1O2,0.298 | |
| N=C1OCCC2OC12,0.265 | |
| N1C2C1C1NC3C2NC13,0.2793 | |
| N=C1CCC2CC(=O)N12,0.2381 | |
| CC(C(O)C#C)C(N)=O,0.2539 | |
| c1cn2c(n1)OCC=C2,0.1871 | |
| O=C1C=CC2C(C#C)N12,0.19 | |
| C1C2N=C3NC=NC3C12,0.2162 | |
| CC12CC(=O)C1N=CO2,0.2056 | |
| Cc1c(cn[nH]1)C(=O)N,0.2362 | |
| CC1CC(C)OC(=N)O1,0.2882 | |
| CN=C(NC=O)C(C)O,0.2156 | |
| OC1C2CC2(C#N)C1O,0.2816 | |
| CC1C2OCCC(O)C12,0.3122 | |
| CC1OC2CC(=O)C12O,0.214 | |
| CC12OC3C1OC23C#C,0.2493 | |
| N=C1OCC(=O)N1C=O,0.2224 | |
| C1CC(=O)C(=C1)C(=O)N,0.1814 | |
| CCC1CC(C)(O1)C=O,0.2126 | |
| O=C1C2CC1C(=C2)C#N,0.2068 | |
| O=C1CC23CC2(CC3)C1,0.218 | |
| CC12CCC1=CCC2O,0.2445 | |
| CC1CC2=CC=CN12,0.2493 | |
| COC1CC(C)(O)C1C,0.3167 | |
| c1c(nc(o1)CN)C#N,0.2204 | |
| N#CC1=CC2C3CC2C13,0.1922 | |
| CN1C2CC(C)(C2)C1=O,0.2573 | |
| CCC12CCCC1C2O,0.3043 | |
| Cn1cc(c(=O)nc1)F,0.205 | |
| CCOC1CC1C(N)=O,0.2655 | |
| CCCCCN=COC,0.2694 | |
| CN1CC(NC1=O)C#N,0.2612 | |
| CCC1C(C2CC2)N1C,0.2879 | |
| CC1C2NC2C=C1CO,0.2425 | |
| CC#CC1(OC1C)C#N,0.2519 | |
| O=C1COC(C#C)C1=O,0.1347 | |
| CC(C#C)C1(O)CC1O,0.2953 | |
| CC1(CN(C1)C)NC=O,0.2453 | |
| CN1CC1(C#C)C1CO1,0.2647 | |
| CC1C2CCCC=CC12,0.25 | |
| CCCOCC1(CC1)C,0.3344 | |
| CC1OC11C2CC1C2C,0.3507 | |
| C#CC1NC11CCOC1,0.2736 | |
| O=C1CNC2CNC=C12,0.1735 | |
| O=CC12CC(CN1)C2=O,0.1941 | |
| CC(=O)n1ccc(n1)N,0.1889 | |
| CNC(C)C(O)C#N,0.2792 | |
| OC(C#C)C1CC(=N)O1,0.276 | |
| O=CC(=O)C1(CO1)C#C,0.1471 | |
| O=C1OCC11C2CCN12,0.2502 | |
| CC1(C)C2N3CC3C12C,0.2821 | |
| CC1CC1(O)C#N,0.2942 | |
| O=C1OCC2(CN12)C#C,0.2671 | |
| CC(C)C(=O)C(C)CO,0.226 | |
| c1cc2n(c1)CCCC2,0.2358 | |
| CC1N(C)CC11CO1,0.286 | |
| CC1(CCC1=O)C,0.2174 | |
| OC1C2CC3COC1C23,0.312 | |
| C#CC1(CN=CN1)C#C,0.2418 | |
| O=CC1=CCC(C1)C#C,0.1928 | |
| C1CC=C(C1)C2CC2,0.2471 | |
| CC12CC3C(OC1=O)C23,0.2712 | |
| CC1(O)C2OC2C1(C)O,0.3038 | |
| CC1CN(C)CCC1=O,0.2112 | |
| CC1C2CC1(C)C2C#N,0.3252 | |
| CC#CC1COC2CC12,0.2851 | |
| CCN1C2CC1C21CO1,0.3023 | |
| O=C1OC=NC2CC12,0.2427 | |
| CC1CCC(CCO)C1,0.3403 | |
| C#CC1C=CC2CCN12,0.2283 | |
| ON=C1CC2CC2(O)C1,0.2488 | |
| CN1CC(C1)C(O)C=O,0.179 | |
| CC1(C#N)C2CC=CC12,0.2392 | |
| CC1C(O)C11CCC1,0.308 | |
| CCOC1C2CCOC12,0.298 | |
| CC(O)C12CC1C(=O)N2,0.2538 | |
| COC12CC1(O)CC2=O,0.2209 | |
| CCOC12CC1C1CC21,0.295 | |
| C1OC23CC4CC2C4C13,0.3169 | |
| C1C2CC3=COC=C3N12,0.2315 | |
| COCC([NH3+])C([O-])=O,0.2725 | |
| C#CC(=O)c1ncco1,0.1776 | |
| c1c([nH]c(n1)CO)N,0.2257 | |
| CCC1C2OCC12CO,0.2966 | |
| NC(=O)CC(O)C1CN1,0.2465 | |
| Cn1c2c(nn1)CCN2,0.2175 | |
| CC#CC1CN=C(C)O1,0.2681 | |
| O=C1OC2=C(OCO2)O1,0.1952 | |
| CCC1CC2CC1(O)C2,0.3295 | |
| OCC12C3C4CN1C2C34,0.3028 | |
| CCC1C2CC=CC1O2,0.2372 | |
| O=CC1CC1C=O,0.2155 | |
| O=CC1C2OC1C2C=O,0.1919 | |
| COc1c(c(c[nH]1)O)O,0.2279 | |
| C1COCC1(C=O)C=O,0.2178 | |
| CN1CC2CN2C1=O,0.2773 | |
| C#CC1CCOCCO1,0.2863 | |
| CC1OC1(C[NH3+])C([O-])=O,0.2555 | |
| CC1NC(=O)C(C)=C1N,0.2137 | |
| OC1C2CC2C1(O)C#C,0.2731 | |
| CC1C2C(O)C(C)CN12,0.2712 | |
| CC(=O)C(O)C(=O)C#C,0.1858 | |
| CCC(=O)C#CC1CO1,0.2053 | |
| OC12C3C4C3C1C4C2=O,0.2118 | |
| CCC12CC3C(C=C1)C23,0.2385 | |
| N#CCC1C2CCC1O2,0.2912 | |
| Cc1c2c(co1)CCC2,0.2261 | |
| CC12CC=CC1C(=N)O2,0.257 | |
| CC1(C#N)C(O)C1C=O,0.216 | |
| CC1OCC(=NO)C1O,0.2482 | |
| CCC1C2CC=CC12O,0.238 | |
| O=CC12NC3C1OC23,0.2003 | |
| c1cn(cn1)CCO,0.2532 | |
| C#CC1CN=C(N1)C#C,0.2049 | |
| OC1CC=CC2(CC2)C1,0.2508 | |
| CC(C=O)N1C2CCC12,0.2239 | |
| CC1=C(C(=O)NCC1)C,0.2127 | |
| C1CCN(C1)C=O,0.2656 | |
| Cc1c(occ1C#N)C,0.2115 | |
| O=CC12OC1C1OCC21,0.2048 | |
| COC(C)CC#CCO,0.2841 | |
| Cc1c(c(on1)NC)N,0.224 | |
| COCCC(C=O)C#C,0.2203 | |
| OC1COC23CC12OC3,0.276 | |
| CC(C=O)C1(C)CC1O,0.2249 | |
| CCCc1cc([nH]c1)O,0.2437 | |
| C#Cc1c(c(c[nH]1)O)N,0.1849 | |
| c1c(c([nH]n1)C2CC2)N,0.2196 | |
| CC1(CO1)C(O)C1CN1,0.3128 | |
| C1CC(O1)C1=CN=CN1,0.2398 | |
| N=CNC(=O)C1CN1,0.2339 | |
| CCCC1CC1C(C)C,0.3486 | |
| CCC(C)C1(O)CC1C,0.3226 | |
| CC12CC3C1C(O2)C3=O,0.201 | |
| C1OC2C3C4C=CC12C34,0.2255 | |
| N=C1OC(=O)C2NC12,0.2386 | |
| CCCCC1C(C)C1C,0.3358 | |
| CCCNC(=O)C(C)C,0.2765 | |
| CCC1OC1C(=O)NC,0.2655 | |
| CC1=CCC2CC=CC12,0.2472 | |
| C1C2C3C2N2C1C32,0.3016 | |
| CCC(C)C1(C)COC1,0.3098 | |
| N=C1CC=C(CO1)C#N,0.2137 | |
| N=C1CCO1,0.2907 | |
| CC1=CC(=N)C(F)=CN1,0.1864 | |
| COC1(CC1)C(F)(F)F,0.3594 | |
| CC1N2C3C2C1(O)C3O,0.2925 | |
| COCC1(C)C(C)C1O,0.3156 | |
| c1cncn2c1ccn2,0.1824 | |
| Cc1nccc(=O)o1,0.1951 | |
| CC1CCC(=O)C(N)=N1,0.1717 | |
| CCOC(=O)C1CC1C,0.279 | |
| CCC(O)C1=NON=C1,0.2314 | |
| CC1NC(=O)C(C)C1O,0.2717 | |
| CC12OC3C1C1(CO1)C23,0.3171 | |
| C1CC23CCCC12O3,0.3286 | |
| CC12NC3C1OC23C#N,0.241 | |
| N#CC1CC1CC1CC1,0.3106 | |
| CCC1(C)COC(N)=N1,0.2807 | |
| OC1C2OCC11CCC21,0.3209 | |
| CN1C(=O)CN=C1C#N,0.1933 | |
| CC1=CC(O)CC1,0.2583 | |
| CC(=NO)C1CC(O)C1,0.2399 | |
| C(COCC(=O)N)O,0.2391 | |
| c1nc(=O)c(c(o1)N)N,0.1771 | |
| OCC(O)C(=O)C=O,0.1487 | |
| CC(=O)C1CCCCO1,0.2296 | |
| N=C1NC(=NO1)C#N,0.1768 | |
| CC12OC(=O)C1C1NC21,0.257 | |
| C1C(=NCC=O)OCO1,0.2248 | |
| OCC1C(O)C=CC1O,0.2386 | |
| OC1CC=C2COC2C1,0.2518 | |
| COCC1(C)COC1=N,0.2767 | |
| COCc1c(nn[nH]1)O,0.2248 | |
| O=CC1=CON=NC1=O,0.1899 | |
| Cc1cc(cnc1)C=O,0.182 | |
| CC1CC2=NNC=C2N1,0.2134 | |
| NC(=[NH2+])C1=CC(=O)N[CH-]1,0.0886 | |
| N#CC12CCOCC1O2,0.2749 | |
| OCC1C(O)C1(O)C#C,0.2533 | |
| CC(C(O)C=O)C1CO1,0.2226 | |
| CCC1CC(C)C1(C)O,0.3189 | |
| CC#CCNC(=O)N,0.2845 | |
| CC12CCN1C1CC21O,0.2801 | |
| CCc1c(cccn1)N,0.1979 | |
| CC1NC2COC12C=O,0.1929 | |
| c1ccc(cc1)CO,0.2384 | |
| CC1=CCOCC(=O)C1,0.2028 | |
| C1CC2COCCC1O2,0.3162 | |
| CCCC12CC1CC2O,0.3187 | |
| C(C#CCO)C#CC#N,0.2249 | |
| C1C2C3CC4C1N4C23,0.3202 | |
| c1cn(cc1N)CC#N,0.2018 | |
| c1c(c(nc(n1)O)N)F,0.2043 | |
| OC1COC2CC12O,0.2896 | |
| CC(NCCC#N)C#N,0.2776 | |
| COC1(CC1(C)N)C#N,0.2796 | |
| C1CC2C1C1C3OC1C23,0.3028 | |
| CC1(OCC=CCO1)C,0.2635 | |
| COC1CCC(=N)O1,0.291 | |
| CN1C=NC(=N1)C1CO1,0.2545 | |
| C#CC1CN1,0.2744 | |
| CC1COC2CCCC12,0.313 | |
| C1Cn2c1n[nH]c2=O,0.2384 | |
| O=C1CCC1NCC#C,0.1999 | |
| CCC1CN=COC1C,0.2746 | |
| CCOC1CC1C1CC1,0.3284 | |
| CC1(O)C2C3NC3(C)C12,0.3159 | |
| CC1CC11C(O)CC1=O,0.2166 | |
| Cc1c[nH]cc1N(C)C,0.2314 | |
| CC1(O)C2COC=NC12,0.2469 | |
| CC12CC(=O)CC1N2,0.2226 | |
| CC1=C2NCC2CC1=O,0.1982 | |
| c1c(nc([nH]1)C=O)C=O,0.1787 | |
| CC1(C)OCCC2OC12,0.3314 | |
| COC1C2C3CC2C13C,0.3406 | |
| C#CCC#CC1CO1,0.2691 | |
| c12c([nH]nc1O)[nH]nn2,0.2154 | |
| Cc1ccc(cc1)C,0.2322 | |
| C1CNC(=O)C1=NO,0.1957 | |
| Cc1nc(on1)N2CC2,0.2423 | |
| COC(C)C1COCO1,0.338 | |
| CC1=CC2(C)OC2(C)C1,0.2421 | |
| CC1(C)CC2(CC2O)O1,0.2939 | |
| c1c[nH]c2c1C(=O)CN2,0.1897 | |
| O=C1CCC1N1CC1,0.1906 | |
| CC1(NC11COC1)C#N,0.2686 | |
| COC12C3OC1C(O)C23,0.2971 | |
| CC1N=COC1C(C)=O,0.2196 | |
| CC1OCC2CC1(C)C2,0.3258 | |
| O=CC1CCOC(=O)N1,0.2112 | |
| CC12COC(C#N)C1O2,0.2916 | |
| CCC1C2C(=N)OC12C,0.2766 | |
| O=C1CC2C3CC3C2N1,0.2757 | |
| CC1(O)CN(C=O)C=C1,0.2107 | |
| C#CC12CC3C1CN23,0.2553 | |
| N#CC1(CN=CN1)C#N,0.2396 | |
| N=CN1C(CC1=N)C=O,0.1917 | |
| CCOC(C#C)C(C)C,0.2999 | |
| c1[nH]nc-2ncnc2n1,0.1738 | |
| OC1CCC=CCC=C1,0.2381 | |
| CCC#CC1(CCC1)C,0.2949 | |
| CC1(CC=CC1)C=O,0.2235 | |
| C1C2C3CC1OC23,0.3266 | |
| C1NC11C=CC2CC12,0.2369 | |
| CC(C)C1(C)CN1C=O,0.2542 | |
| CC1OC(=N)OCC1O,0.2986 | |
| C#CC1=NC2(CC2)CO1,0.1991 | |
| OC1C2NC3C2NC13,0.281 | |
| CC1CC2(C)C3CN3C12,0.2903 | |
| O1C2C1C1C3C4C3N1C24,0.2903 | |
| C(CC(=O)N)CC(=O)N,0.2708 | |
| CC1CC2C3CC1C23O,0.31 | |
| O=CC1CC11COC=N1,0.2104 | |
| CCOCC(N)C#N,0.2851 | |
| CC(=O)CC1OC1CO,0.234 | |
| C(C=O)OC(=O)CC#N,0.2301 | |
| CC1NC(=N)C(=O)C1C,0.1779 | |
| O=C1CCN2CC2C1=O,0.1607 | |
| NC(=[NH2+])CNCC([O-])=O,0.2087 | |
| CC1OCC11OCC1=O,0.2132 | |
| COC1C2CCC1CC2,0.3221 | |
| CNC1=CNC=NC1=N,0.1815 | |
| CC(C#N)C1CCN1C,0.2663 | |
| N=C1OC2CC3OC1C23,0.2621 | |
| N=C1N=CNC=NC1=O,0.1828 | |
| C1c2c(nno2)N=CO1,0.1826 | |
| CCCC(=NO)C#CC,0.2077 | |
| CC12C(CC1O)C2C=O,0.2158 | |
| CC1C(C)N(C)C1C#N,0.2554 | |
| CC#CC(C)(C=O)C=O,0.2049 | |
| CC1CC2C3CC(C1)C23,0.3276 | |
| O=CNC12CC1OC2,0.2534 | |
| CC1C=CCC2OCC12,0.2571 | |
| O=CC1OC11CCC=C1,0.2073 | |
| CN1CC1(C#C)C1CC1,0.2613 | |
| CCC12CC1C=CC2O,0.239 | |
| CCC1=CC2OC2C1O,0.2377 | |
| OC1C2NC1C21CCO1,0.308 | |
| CC1CN1C(=O)C(C)=O,0.1724 | |
| CC12OC1C1OC2C1=O,0.2427 | |
| CC1(CCC1=NO)C=O,0.2102 | |
| O=CC(C#N)N1CCC1,0.2043 | |
| C1OC11CC2CN2C1,0.3108 | |
| CC1C2NCC(=N)OC12,0.2552 | |
| C1C2CC3OC12CC=C3,0.2595 | |
| C1CC23CCC2=CCC13,0.2425 | |
| N#CC12NCC1N1CC21,0.2423 | |
| CC1=CC2(C)NC1C2=O,0.2331 | |
| CCC1OC(C#N)C1=O,0.2204 | |
| CC1C2OC3C(C)C2C13,0.3222 | |
| CCC1C2CC2C1C#N,0.3055 | |
| CC1NC(C#N)C11CO1,0.2706 | |
| CC1=CCC2CC12C#N,0.2463 | |
| O=CC12CC3(CC3)C1O2,0.2142 | |
| CC(C)N=C1OC2CC12,0.2644 | |
| CC#CC1C2C3CN1C23,0.2581 | |
| CC(C)C1C2CN2C1=O,0.2322 | |
| CCC1C2CC1(O)C2C,0.3314 | |
| Cc1c([nH]c(=O)[nH]1)N,0.2291 | |
| Cc1c([nH]nn1)OC=O,0.2296 | |
| CC1CC(CC1O)C#N,0.319 | |
| NC1CC1([NH3+])CC([O-])=O,0.2714 | |
| c1c([nH]c(=O)[nH]c1=O)N,0.2147 | |
| CC(C)C(C#C)N1CC1,0.2822 | |
| COC(CO)C#CC#N,0.2264 | |
| CCC12CC(C1)(O2)C#C,0.2559 | |
| CC1C2C3C(O)C3C12C,0.2684 | |
| Cc1cc2cn[nH]c2[nH]1,0.2201 | |
| OCC1C2CC1(O)C2O,0.3106 | |
| NC1=CC(=O)CC1C#N,0.2052 | |
| CCC(CO)CC#N,0.2898 | |
| CC1(CCO)CN=CO1,0.2729 | |
| N=C1OCOC(=N)C=C1,0.1872 | |
| OC1CC(OC1=O)C=O,0.222 | |
| N=C1OC2CCC2=C1,0.2067 | |
| OC1C(O)C11CCOC1,0.2846 | |
| c1cnc([nH]1)OC2CC2,0.2515 | |
| OC1(CC1)C1CC1C#N,0.2853 | |
| CC12CC1C1(CC1)OC2,0.3168 | |
| CC(=O)C#CCCCO,0.2083 | |
| OCC1CC1CO,0.3308 | |
| C#Cc1cnc(cn1)N,0.1729 | |
| O=CC(CC#C)C#N,0.2177 | |
| O=C1CC23CC4C2CC134,0.2087 | |
| COC12CCC1(C)OC2,0.3031 | |
| CN1C(=N)OCOC1=O,0.2619 | |
| c1cc(oc1)N2CCC2,0.2153 | |
| c1c2c(no1)OCO2,0.2303 | |
| C1CC(C1)CNCC#N,0.2692 | |
| C1C2OC1C1=C2OC=N1,0.2166 | |
| COC(=O)C(O)CC#C,0.2503 | |
| CN1N=CC=C1C1CO1,0.2406 | |
| O=C1CCC(CO1)C#N,0.2697 | |
| CC1CC(O)CC1C=O,0.2218 | |
| C#CCC1=CCOCC1,0.259 | |
| CC1CC(=O)C1CO,0.219 | |
| CC1OC2C(=N)OC12C,0.2629 | |
| CC1N(C)C2CC12O,0.2732 | |
| Cc1c(cc([nH]1)CO)N,0.2109 | |
| CN=COCCC1CC1,0.2728 | |
| CC1CNCC(=O)C1C,0.1965 | |
| CNC1C(O)C1(N)C#N,0.2538 | |
| C(CO)COCC#N,0.2846 | |
| NC(=O)C1C2OC1C2=O,0.2264 | |
| NC(C#C)C1=CC=NO1,0.2364 | |
| C1OC2COCCOC12,0.305 | |
| CC1C(O)C1C1(C)CC1,0.3065 | |
| O=COC12CC3CC1C23,0.2631 | |
| C1CC23COC12CC=C3,0.2554 | |
| COCC1=NCC(=O)N1,0.2349 | |
| C1C(=NO)C=CN1C=O,0.1679 | |
| CCNC(=O)NC,0.3042 | |
| CCC#CCC(O)C#C,0.2718 | |
| CC1(C)NC1(C)CC=O,0.2154 | |
| C1CN2C1C21CCOC1,0.3098 | |
| CC(C)C1CC(=O)C=C1,0.1917 | |
| CC(C)(CC#C)OC=N,0.2824 | |
| CC1OC(=N)C2C1N2C,0.2548 | |
| c1cc(c(nc1)F)F,0.2221 | |
| COCC1CCC(O)C1,0.315 | |
| C1CC23CC4CC12CC34,0.3306 | |
| CC(C)CCOC=NC,0.2728 | |
| c1ccc2c(c1)cno2,0.2032 | |
| CC(C)NC(=O)N1CC1,0.2828 | |
| OCC1CC2C3CN3C12,0.2912 | |
| C1CC1c2c(nn[nH]2)O,0.213 | |
| C1C2NC3=NCCN1C23,0.2044 | |
| OC1CC11CC2CN12,0.3024 | |
| CCC1CC11COC1=N,0.2807 | |
| CCC12OC3CCC1C23,0.3023 | |
| O=C1CNC2CCC2O1,0.2545 | |
| Cc1c(cco1)C(=O)C,0.1936 | |
| CC1CC1(CO)CCO,0.3152 | |
| CC1C2C3OC1C(C)C23,0.3187 | |
| Cn1cnc2c1[nH]nc2,0.2282 | |
| CCC1C2CC3(CC3)C12,0.331 | |
| COC1COC(=N)C1,0.2847 | |
| CC1C2NC1(C=O)C=C2,0.1935 | |
| C(COCCOC=O)O,0.2806 | |
| c1cnc-2coccc12,0.161 | |
| CC1OC(=O)C1(C)C=O,0.2177 | |
| CN1C(=O)CCCC1=O,0.2352 | |
| NC1=NON=CC1=N,0.1648 | |
| CC1CC2C(NC=O)C12,0.2705 | |
| c1c(onn1)C#N,0.212 | |
| C1C(CC1=O)CCO,0.2233 | |
| Cc1cc(co1)OC,0.2292 | |
| CC1CC(=O)C1C1CC1,0.2171 | |
| CC1(C)CC(O)CC=C1,0.2677 | |
| CC(C)(C#C)C(=O)OC,0.2756 | |
| COC(=O)C1=CCCC1,0.2167 | |
| COCC1CCNC1=O,0.2702 | |
| CC1C2C3CC(N23)C1=O,0.2154 | |
| FC1=C(F)C(=N)C=CO1,0.1938 | |
| O=C1CC2CCC(=O)C12,0.1967 | |
| CC(C#C)(C#N)C1CC1,0.298 | |
| CNc1cnc(nc1)N,0.1636 | |
| C1C2CC11C=CC3C1N23,0.1731 | |
| N=C1C2C3N=CN1C23,0.2152 | |
| OC1(CC#C)CC2NC12,0.2709 | |
| CC1C2CC(O)CC1O2,0.3062 | |
| O=C1C2CC=CC1O2,0.2165 | |
| CC1(COC=O)CCO1,0.272 | |
| C1CC1C12CC(C1)C2,0.3595 | |
| [O-]C(=O)C12[NH2+]C3C1CC23,0.2121 | |
| CC(C)(C)CC(=O)OC,0.2814 | |
| CCOC1(CC1)C#N,0.2922 | |
| Cc1c(n(c(=O)o1)C)N,0.2332 | |
| CCc1cc(oc1)CO,0.2322 | |
| OCC1C(C#N)C1C#N,0.2747 | |
| N=C1NC=C(C=O)N=C1,0.1606 | |
| CN=C1N(CCO1)C=O,0.2337 | |
| CC12CC3C(OC13)C2=O,0.2084 | |
| CN=COc1[nH]ccn1,0.2243 | |
| CC(NC1CC1C)C#N,0.256 | |
| CN1C(=N)CN=C1C,0.22 | |
| CC1CC2=CCC(C)C12,0.2488 | |
| Cc1c2c(no1)C=CC2,0.2121 | |
| CC1=C(NC=C1)C1CN1,0.2392 | |
| CC#CC(=O)C(C)(C)C,0.2034 | |
| CC12C3CC1CC(=O)C23,0.2211 | |
| c1c([nH]c(c1N)O)CO,0.2208 | |
| CCCC1(C)CC1CC,0.3402 | |
| Cn1cc(cnc1=O)F,0.166 | |
| OC1CC(C#C)C1=O,0.2112 | |
| CC1C2CC1(C)CC2,0.3586 | |
| CN=C(C=O)N(C)C,0.1629 | |
| O=C1C2C=CC3OC2C13,0.2021 | |
| O=CCC1COCC=C1,0.2223 | |
| OC12CN3CC1(O)C23,0.266 | |
| OC(CC#CC#C)C=O,0.2053 | |
| CC(CCO)C=O,0.2273 | |
| C1CC1OC(=O)C(=N)N,0.2002 | |
| N=C1C=NC=NOC1=O,0.173 | |
| CC1COCC2OC12,0.3302 | |
| FC(F)(F)C12CN1CC2,0.3192 | |
| C1C2CC1C1=CCOC21,0.2433 | |
| CC1=NOC(=N)C=C1N,0.1606 | |
| OCC1=CC2CN3C2C13,0.2324 | |
| CC(=O)C(CO)OC=N,0.223 | |
| CC(C)(C)CC#CCO,0.2762 | |
| C#CCC12OC1C1NC21,0.2666 | |
| CC(C)c1conn1,0.2318 | |
| C1CC2(C1)CO2,0.3343 | |
| ON=C1C=CNC1C=O,0.164 | |
| C1C2OC11COCCC21,0.3125 | |
| OC1(CCN2CC12)C#N,0.2548 | |
| OC1C=CC2(CO2)C1=O,0.1996 | |
| COC12CC3(O)CC1C23,0.3123 | |
| CCC(=NO)C(C)(C)C,0.2522 | |
| CC1C2CN2C1(C)CO,0.3184 | |
| CCOc1c[nH]c(=O)o1,0.242 | |
| CC1COCC2OC12C,0.3296 | |
| CC1(O)CCC2CC12,0.3312 | |
| CCC12CN1CCC2=O,0.2166 | |
| CC1=CC2(O)CC2C1O,0.2382 | |
| COC(C#C)C(N)C#N,0.2812 | |
| CC1CC(C#C)C11CN1,0.2879 | |
| CC1=CCC2=CCOC12,0.2478 | |
| CC1(C)C=CC2CC1O2,0.2393 | |
| CCCC(=O)CC(=O)C,0.207 | |
| O=CC12C3OC(C13)C2=O,0.2003 | |
| COC12CCOC1C2O,0.3027 | |
| CC1CC(=O)C(O)C1=O,0.1922 | |
| CCC1(C)C2NC(=O)C12,0.25 | |
| CC1CCC1(O)CCO,0.3194 | |
| COCCCCCC#N,0.2955 | |
| N=C1CC=CC(O1)C#N,0.2464 | |
| Cc1c(c(no1)N)N,0.2267 | |
| CC#CC#CC(=O)C#C,0.1622 | |
| CC1CC1CN1CC1C,0.305 | |
| C1CC2(C1)CNC(=O)N2,0.302 | |
| CC(=O)C1CC=CC1,0.2297 | |
| CC(C)(C=O)C(=O)CO,0.202 | |
| CC1=CC(CC1O)C=O,0.2167 | |
| CC(C)(CCOC)O,0.3117 | |
| CN(C)c1c[nH]c(=O)[nH]1,0.231 | |
| CC1COCC1C,0.3197 | |
| COCC12CCC1N2C,0.3218 | |
| c1cnc(cn1)OC=O,0.1993 | |
| C1CC1(CC=O)CO,0.2125 | |
| CC12N=CN3C=NC1C23,0.1991 | |
| CC1(C#N)C2CCOC12,0.2838 | |
| CC12CCC(C1)OCO2,0.3291 | |
| c12c(onc1onn2)N,0.1729 | |
| CCC1N2CCC12C#C,0.247 | |
| CC1OC2(CC#N)CC12,0.277 | |
| N=COCC(C#C)C#C,0.277 | |
| CC(CC#C)CC#C,0.2958 | |
| C1COC(=O)C(=O)CO1,0.1731 | |
| C1CC2OCC1CO2,0.3193 | |
| OC1CC=CC2NC2C1,0.2444 | |
| CC1CC2(C1)NC2CO,0.3166 | |
| Cc1c[nH]c(=O)nc1O,0.1912 | |
| CC1(CO)OC2CC12,0.3143 | |
| CC(=O)CC(CO)CO,0.2342 | |
| OCC1(CN1C=O)C#C,0.2479 | |
| CC1CC(C#N)C11CN1,0.2863 | |
| O=C1C2CC3(C#C)C2N13,0.2426 | |
| CC(=O)C1OC1CC#N,0.2206 | |
| CCC12C3C4N3C1C24O,0.2675 | |
| CN=C1C=NON=N1,0.1641 | |
| OC1CCC=CC=C1,0.1925 | |
| O=C1C=CNCC2CC12,0.1914 | |
| CCC1CCCOC1,0.327 | |
| CC12NC1C1NC1C2O,0.2839 | |
| COC1(C)CC1OC=O,0.2781 | |
| c1c([nH]c(n1)CO)CO,0.2369 | |
| [NH2+]=C1C=N[N-]C=C1C=O,0.1527 | |
| COC1C2NC1C21CO1,0.3183 | |
| CC1OC1C1=NOC=N1,0.2393 | |
| C1CC(C1)C#CCCO,0.2941 | |
| NC1C(OC1=N)C1CN1,0.2604 | |
| CC12C3CC1(OC23)C#C,0.2494 | |
| OC1CC1N1C=CC=C1,0.2424 | |
| CN1CC2(C1=O)COC2,0.2706 | |
| O=C1CC2CC(=O)OC12,0.205 | |
| C1C2C3C4C5OC13C2C45,0.3331 | |
| C#CC1=CC2CC1C=C2,0.1864 | |
| OCCC(CO)C#C,0.3046 | |
| CC#CC1(NC1C)C#N,0.254 | |
| C#CC(=O)CCC(=O)N,0.196 | |
| NC(=O)C1C2CC1C=C2,0.2286 | |
| NC1=NCC(OC=O)O1,0.2373 | |
| C1OC23CN(C2)CC13,0.3105 | |
| c1c(onc1N(=O)=O)N,0.1583 | |
| N#CC12C3NCC1OC23,0.2401 | |
| OCC12CN1CC1NC21,0.2984 | |
| CC1=CC2C3CC2(O)C13,0.225 | |
| CCC1C2CC1(O)CC2,0.3251 | |
| O=C1CC2(CC3NC23)O1,0.262 | |
| O=CC1NC1C1CCO1,0.2209 | |
| C1OC23COC12C1OC31,0.2797 | |
| O=C1OC2C3CC(O3)C12,0.2764 | |
| CN=c1cc(onc1)F,0.1696 | |
| CCC([NH3+])C1=NC=N[N-]1,0.266 | |
| OC12CC1OCOCC2,0.3131 | |
| c1c(c(on1)C=O)C#N,0.1792 | |
| N#CC1=CC2NC2CC1,0.2041 | |
| CC1(CC1C=O)C(N)=O,0.2208 | |
| CCOC1C2CC1C2O,0.3199 | |
| CCC1=CCNC1=O,0.2224 | |
| COc1c(n[nH]n1)C#N,0.212 | |
| CC1CCC=C1C1CO1,0.2432 | |
| NC(=[NH2+])C1=C([O-])C=NN1,0.1461 | |
| CC1C2CN3CC3C12C,0.2944 | |
| CC(=O)N1C2C3CC2C13,0.2494 | |
| CC(O)C(O)C(O)C#N,0.2761 | |
| CCc1c(cc[nH]1)C#C,0.2159 | |
| OC12CC34COC(C13)C24,0.315 | |
| C1COC12COCOC2,0.3124 | |
| CN1C(C=O)C2CC12C,0.1858 | |
| CC1=NNC=C(O)C1=N,0.1745 | |
| O=C1CNC2C3CC1C23,0.1893 | |
| CC12CC3CC1C3O2,0.3313 | |
| CC1(C)CC1(C)NC=O,0.2736 | |
| CC1CCCC(O)C1,0.3372 | |
| OCC(C#C)C1CN1,0.2797 | |
| NC(CNC=O)C#N,0.2707 | |
| CC(C#N)C1CCCO1,0.2969 | |
| CC1(CC1O)C(O)C#N,0.2814 | |
| OC1C2(O)CC1(O)C2,0.3093 | |
| OCC1N2CCC12C#C,0.2495 | |
| OCC1OCC1C#N,0.2785 | |
| CC1C2CC1C2CCO,0.3432 | |
| CCn1ccnc1OC,0.2475 | |
| CC1CC2(CC12)C(C)=O,0.2255 | |
| N=C1OC2COC1C=C2,0.2324 | |
| C1OC2CCOCC=C12,0.2439 | |
| CN1C(CO)C1C1CN1,0.2862 | |
| CCC1(CO1)C1CN1,0.3286 | |
| C#CCC1OCC2OC12,0.3092 | |
| CC1CN(C=C1)C(C)=O,0.2074 | |
| CC(C)Nc1nnon1,0.1895 | |
| Cc1ccncn1,0.2122 | |
| COc1c[nH]c(c1N)O,0.2453 | |
| CC(O)C1N=CNC1=N,0.2222 | |
| C1CC23C=CC4C2OC134,0.2001 | |
| CC1(O)CC11OCC1=O,0.2163 | |
| CN1CC1(C#N)C(C)=O,0.2161 | |
| CC1OC2C3COC3C12,0.2936 | |
| CCCNC(=O)C#CC,0.2324 | |
| COCC12OC3CC1C23,0.2967 | |
| CN1CC1C1(C)CN1,0.302 | |
| CC#CCCOC=O,0.2642 | |
| N#CCCC1(CN1)C#N,0.2947 | |
| CC(=O)C1(C)OC1C=O,0.2083 | |
| C1OC2C1N1C=CN=C21,0.2397 | |
| N#CC#CC12CCC1N2,0.2198 | |
| OCC1(C#C)C2COC12,0.2713 | |
| CC1=CN=CC=NC1=N,0.1485 | |
| CC1(CC(CO)O1)C#C,0.2761 | |
| CNC(=O)CC(=O)CO,0.209 | |
| O=C1CC2CCC2CN1,0.2705 | |
| CC(C)(O)C1CC1C=O,0.2244 | |
| CC12CC1(OC2=N)C=O,0.2137 | |
| C1CC2C1C21CCOC1,0.3332 | |
| CC12CCC1CN1CC21,0.3036 | |
| C1NC1C1=NC2CC2O1,0.2455 | |
| Cc1ccoc1C=O,0.1888 | |
| CC1C(C)C2(O)COC12,0.3029 | |
| CC#CCCCCC=O,0.2232 | |
| Cc1c(nco1)C(=O)C,0.2046 | |
| C1COC2(C1)OCC=C2,0.2591 | |
| CC1(COC1=N)C1CN1,0.2608 | |
| CC(O)(CO)C#CCO,0.2785 | |
| COC12CC(C1O)C2=O,0.2268 | |
| Cc1c(c([nH]n1)C#N)N,0.1891 | |
| CC1CCC2C1OC2=N,0.2874 | |
| OC1C2CCCC1C=C2,0.2557 | |
| OC1C2OCC22COC12,0.2874 | |
| c1c(cn[nH]1)C#N,0.2433 | |
| CC(O)C1C2OCOC12,0.3176 | |
| CC1CC2=CCOC2O1,0.2513 | |
| CNC(=O)CC1CC1,0.2749 | |
| OC1(CC1CC#C)C#C,0.272 | |
| N#CC1CC1N1CCC1,0.2458 | |
| c1c[nH]cc1CC2CC2,0.2499 | |
| c1c2n(cnc1=O)CC2,0.199 | |
| N=CNC(=O)CC1CO1,0.2373 | |
| CC1(C)C2CC1(O)C2O,0.316 | |
| COC1C2NC1C2(C)O,0.2936 | |
| O=CCC#CC1CO1,0.2204 | |
| CC12CC1(C)OC2,0.3117 | |
| CC1(C)CC1(C)CC#N,0.3116 | |
| Cn1cncc1CC#N,0.2447 | |
| CCn1cnc(n1)C,0.2648 | |
| C1CC2=CCOCC2=C1,0.1971 | |
| OCC1NC1CC1CO1,0.3207 | |
| OCC12NC=NC1C2O,0.2374 | |
| OC1C2CN2C1CC#N,0.2869 | |
| c1c(cnc(c1N)N)O,0.1829 | |
| C1C2C=CC3=C2N1C=N3,0.1763 | |
| COCC(CC#C)C=O,0.2274 | |
| CC1OC1CC(C)(C)O,0.3236 | |
| CC1C2OC1C(O)C2O,0.2866 | |
| CCC(CO)C(N)C#N,0.272 | |
| C1CC11COCC2OC12,0.3312 | |
| COC12CC3C4C(C14)C23,0.3176 | |
| c1conc1N2CC2,0.2342 | |
| N=C1N=CON=C1C=O,0.1612 | |
| c1c[nH]nc1N,0.2353 | |
| OC1CC2=CCC(=O)C12,0.2202 | |
| CC1NC(CC#N)C1=O,0.2164 | |
| CC1OCOCCC=C1,0.2515 | |
| O=CCC1CC1C1CO1,0.2261 | |
| CC1CC1C1OCCO1,0.3434 | |
| CC(C)C1OC1C1CC1,0.3367 | |
| CC1C2CC1(C)C2C#C,0.297 | |
| CC#Cc1c(nno1)C,0.1918 | |
| CC12CC(O1)C1(CN1)C2,0.3174 | |
| CC1C(CO)C1OC=N,0.265 | |
| CN1CC2CCC12C#N,0.2397 | |
| O=CC#CC12CC(C1)C2,0.2017 | |
| CCC1CC11OCC1C,0.3036 | |
| O=CC1CC2CC2C1=O,0.2066 | |
| Cc1cc(n2c1CC2)N,0.2217 | |
| CCNc1nnon1,0.1919 | |
| COc1cc(oc1)C#N,0.1917 | |
| CC1C2CN(C12)C(C)=O,0.2579 | |
| O=C1CC2N1C21COC1,0.2346 | |
| C1CN1C1C2C3OC3C12,0.2708 | |
| OCCN1C2C3CC3C12,0.2795 | |
| CC1CC2=C(NN=C2)N1,0.2308 | |
| OC1(CN2CCC12)C#C,0.2386 | |
| OC1=C(OC=N)C=CN1,0.1764 | |
| C1CC1C12CC1CC2,0.3202 | |
| CC(O)C(=O)C1CN1C,0.2001 | |
| CC12CC3CC=C(C1)C23,0.2171 | |
| [NH3+]CCC1=N[N-]C(=N)O1,0.1593 | |
| OC1C2C3C(C=O)C1N23,0.2191 | |
| CC1C2(C)CC1(CO)C2,0.3379 | |
| Cn1c(c[nH]c1=O)O,0.2311 | |
| CC(C)CC(=O)C(=O)C,0.1571 | |
| N#CC#CCC1CN1,0.2222 | |
| N#CC12CC3CC(O1)C23,0.2648 | |
| C1CN(C(=N1)CO)C=O,0.2248 | |
| CCN(C1CC1)C(=O)N,0.2795 | |
| COCC1CCCCO1,0.3317 | |
| CCC1C2CC1(C)C2O,0.3199 | |
| O=CCOCC1CO1,0.2292 | |
| CCN=c1occo1,0.2318 | |
| OC1C=CCC2CC1O2,0.2606 | |
| CC1OC2CC(C2)C1O,0.3048 | |
| CCNc1nc(on1)N,0.2405 | |
| c1c(cn[nH]1)CC=O,0.2181 | |
| CC1C2COC1(C)C2O,0.3052 | |
| CCC#CC#CCCO,0.2242 | |
| O=CC1CCCN=CO1,0.2103 | |
| CCC1C2N3CC3C12O,0.2828 | |
| CC1CCN1CC#N,0.257 | |
| C1OC2C=CCC22NC12,0.2509 | |
| CNC(C#N)C1CO1,0.2775 | |
| C1OC2C3C4C5C3C12N45,0.2872 | |
| CC(O)C(O)C(F)(F)F,0.3266 | |
| NC1C(O)CC1C#N,0.2749 | |
| COc1ccnc(=O)[nH]1,0.1861 | |
| CC1C(=O)NCC1(C)O,0.2745 | |
| CCCC(C)(C=O)C#C,0.2189 | |
| CCC1(CO)NC1C#C,0.2755 | |
| CC1CCC2CC12C,0.3367 | |
| CC1OC2C=CC1C2O,0.2465 | |
| CC12OC3C4CC4C1C23,0.2931 | |
| NC(C#C)C1=NNC=N1,0.2448 | |
| COC12CCC1C2(C)O,0.2992 | |
| Cc1c[nH]cc1C#C,0.2204 | |
| C1CC12COC23CC3,0.2966 | |
| COC12CC1C1(C)NC21,0.2853 | |
| CC1(C)CCC2(CO2)C1,0.3307 | |
| CCCCOCC#CC,0.284 | |
| N#CCN1CC2CC2C1,0.2597 | |
| O=C1OCC11NC1C#N,0.2537 | |
| CC1=CCC2NC2C1O,0.2614 | |
| OC1CC2(COC2=O)C1,0.2703 | |
| CCN1N=NOC1=N,0.2049 | |
| CCNC(=O)C#CC,0.2333 | |
| Cc1cc(c([nH]1)O)NC,0.2127 | |
| CC1CC2COC(=O)C12,0.2687 | |
| CCC#CCC(O)C#N,0.2671 | |
| CC1(C)CC2(CO)CN12,0.2991 | |
| CC1=CCC(C)(O)CC1,0.2606 | |
| C1C2C=C3CC4C2N1C34,0.1786 | |
| CC12CCC(C)(C1)OC2,0.3114 | |
| CC12CC1(O)C1(CN1)C2,0.2877 | |
| CC(O)(C#C)C1CC1O,0.3023 | |
| C1OC11CCOC=NC1,0.2645 | |
| CC1C2C(O)C2C1C=O,0.2042 | |
| CCC1(C)OC11COC1,0.3165 | |
| CNc1c[nH]nnc1=O,0.1635 | |
| NC12C(CC1O)C2C#N,0.2793 | |
| CC1COC(C)C11CC1,0.3164 | |
| CCC1(C)CC(C)C1C,0.3429 | |
| CN=C1NN=CC(N)=C1,0.1546 | |
| CC1(C)OCOC1C#N,0.2862 | |
| CC1OC=NC1(C)CO,0.264 | |
| COC12C=CC3CC1C23,0.2355 | |
| C1NC1C12COC1CO2,0.2982 | |
| CC1=CC2COC(C1)O2,0.2522 | |
| OC1CNC2C1OC2=N,0.2578 | |
| CNC12C3OC1CC23O,0.2805 | |
| CC1CCC2CC2(C)C1,0.3314 | |
| COC1COCC(O)C1,0.3058 | |
| OCC12CCCC1O2,0.337 | |
| C(C1CC1)C1CCO1,0.33 | |
| CCCOC1CC1(C)C,0.3304 | |
| Cc1ccnc(c1F)C,0.225 | |
| CC(C)c1noc(=O)o1,0.2685 | |
| CC1([NH3+])C(O)C1C([O-])=O,0.1562 | |
| CC1OC2C1NC2=O,0.2494 | |
| C1CN=C2NC3C(O1)C23,0.2125 | |
| CC1OC1C1(CC1)C#N,0.2984 | |
| C1C2C3C4C2CCC1N34,0.3215 | |
| OC(C#N)C1(O)CC1O,0.2875 | |
| CC(C)C,0.401 | |
| CC#CC(N)C#N,0.2661 | |
| CCCC#CCOC=O,0.2675 | |
| COC1(C)C(O)C1O,0.2934 | |
| CC(CC(C)(C)C)C#C,0.3114 | |
| CC1C(CC1(C)C)C#C,0.3031 | |
| OC12CC1CC2C#C,0.2927 | |
| CC1CCC=CC2CC12,0.2509 | |
| OC1C2CC2OCC1=O,0.2133 | |
| CC12CC(=O)C1COC2,0.2143 | |
| CC1(C)NC(C#C)C1=O,0.2097 | |
| CCOC(C)(C#N)C#N,0.2772 | |
| CC1C2OC1C(C)=C2,0.2356 | |
| CCC12CC1C1CC21O,0.2766 | |
| CC1C=CC(O)CC1=O,0.2224 | |
| CC(C)(CC#C)C=O,0.2275 | |
| CN1N=NC(=N)OC1=O,0.1858 | |
| OC(CCOC=O)C#N,0.2848 | |
| C1C(=O)OC(=N1)CC=O,0.2271 | |
| C(=O)n1c(=O)oc(n1)N,0.2107 | |
| COCC(C)OC=NC,0.2721 | |
| COC(=O)C1(O)CC1C,0.2529 | |
| C#CC1CCC2OC12,0.3055 | |
| CC(CC=O)C1CC1O,0.2273 | |
| O1C2C=CC1C=CC=C2,0.1898 | |
| OC1C(=O)NC11COC1,0.2645 | |
| N#CC1CC2NC12,0.28 | |
| OC1C(CC1=O)C#C,0.2133 | |
| CC1CC1(C)OCC#C,0.2794 | |
| CC(C)C1CC1C,0.3498 | |
| C#CC1(CC1)C#CCO,0.2604 | |
| N=C1CNC(=O)C(=O)O1,0.203 | |
| C1CC11CCC2OC12,0.3486 | |
| CCC1OC=NCC1=O,0.203 | |
| CN1CC=CC(C1)C#N,0.2257 | |
| CC1(CCC#N)CC1O,0.3053 | |
| NC(CCN1CC1)C#N,0.2676 | |
| CC1C2COC1OCC2,0.3258 | |
| C1CC=C(C1)C#CC#N,0.1815 | |
| COC1C(C)C11CCO1,0.2782 | |
| C1C2OC(C12)C1CCO1,0.298 | |
| CC1(CO)CC(O1)C#N,0.2664 | |
| C#Cc1nc(on1)C#N,0.1971 | |
| c1c(onc1O)C(=N)N,0.2019 | |
| CC1C=CC2=C1C=CN2,0.1777 | |
| CCC(N)(C#N)C#CC,0.2707 | |
| CCC1CCOC1=NC,0.2707 | |
| C1CC1C1=CC2OC2C1,0.229 | |
| CC1=CC(=O)N(C1)C,0.2114 | |
| OC1C2CCC(O)CC12,0.3151 | |
| CCCNC(=NC)C=O,0.1608 | |
| CC1(CO1)C#CC#C,0.2181 | |
| c1cnn[nH]1,0.2618 | |
| COCC1COCCO1,0.3115 | |
| CCC1C2CCC1OC2,0.3103 | |
| O=C1CC2C3CC1CN23,0.2259 | |
| CN=C1OC(C=O)C1O,0.1931 | |
| CCC(C)(O)C1NC1C,0.3119 | |
| CC1C(C)C11CCO1,0.2912 | |
| CCC1(C=O)C2CC1C2,0.2171 | |
| OC1CC11C2CC1C2=O,0.2525 | |
| CCCC1C2CC(=O)N12,0.2341 | |
| C1CC1C(=O)C=O,0.1539 | |
| CCOC1C(C)C1(C)O,0.3105 | |
| CC1(O)CNC(=O)C=C1,0.2011 | |
| CC([NH3+])C(C)(C)C([O-])=O,0.2774 | |
| c1c(c(co1)N)CC#N,0.2173 | |
| CCN=c1[nH]nnn1C,0.195 | |
| C1OC2C1C21CN=CO1,0.2475 | |
| CC1(CC1)C2(CC2)O,0.3162 | |
| OC(CC1CCO1)C=O,0.2138 | |
| CC1N2CC3C1(O)C23C,0.2845 | |
| C1CC=CC=CC=CC1,0.1613 | |
| C1C2COC=NCC1O2,0.2257 | |
| OCCOC1C2COC12,0.3062 | |
| NCC1(CNC=N1)C#N,0.2349 | |
| O=C1COCC2CN2C1,0.2067 | |
| CC1CN1C1=CC=NN1,0.2394 | |
| CCC1(C)CCC1O,0.3296 | |
| CC1C2COCC1C2O,0.3187 | |
| CC1(C)C2C3CC2(O)C13,0.3295 | |
| C#Cc1c[nH]nc1O,0.2183 | |
| Cn1c(cc(=O)cn1)O,0.1884 | |
| c1c([nH]cn1)COC=O,0.2311 | |
| N=C1OCC1OCC#C,0.263 | |
| CCOC1CC11CCC1,0.3091 | |
| CC#CC1=CC2NC2C1,0.1971 | |
| CC1=Cc2c(cn[nH]2)C1,0.1881 | |
| C#CCn1cnc(n1)O,0.2446 | |
| C1CC(C1)C2OCCO2,0.3398 | |
| CN1CC1(CO)C1CO1,0.2922 | |
| OCC12NC1CC21CC1,0.2784 | |
| CC([NH3+])(CC#N)C([O-])=O,0.2686 | |
| C1CCCNC(=O)CC1,0.267 | |
| C1CC11COC2CCC12,0.3172 | |
| Cc1ccnn1C,0.2575 | |
| CC#CC(=O)C(C)C,0.2054 | |
| CC1C(O)C1(O)CC#C,0.2647 | |
| CC12C3CC1CC(O)C23,0.3224 | |
| CC1NC11CC2CC12O,0.2877 | |
| OCC1C2OCCOC12,0.2988 | |
| CC1NCC(=O)OC1=N,0.2351 | |
| COC1CC(=O)C1(C)C,0.2166 | |
| CC(O)C(=O)C(C)CO,0.2319 | |
| CC1C2N3CC2(CO)C13,0.286 | |
| CC1NC1CC(O)C#C,0.2923 | |
| CC1C=CC(=NO)C1=O,0.1722 | |
| COc1ncc2n1CC2,0.2512 | |
| CC12CC(O1)(C#N)C2=O,0.2385 | |
| O=C1NC2C3OC1C23,0.2341 | |
| CCC1C2C3OC2C13,0.305 | |
| CC(C)(CC=O)C=O,0.21 | |
| c1c(coc1N(=O)=O)N,0.1472 | |
| COC1C2C3NC3C12,0.2654 | |
| CC1C2(C)CC=CC12C,0.2437 | |
| CC1(C)CCC1C#C,0.2996 | |
| CC1(CCCO1)C,0.3168 | |
| N=C1NC(=O)CC11CC1,0.25 | |
| C1NC11C2C3CC1OC23,0.31 | |
| CC(=NO)C1NC1C=O,0.2266 | |
| CC(OC(C)C=O)C=O,0.2162 | |
| NC1=NC(=N)C=NC=N1,0.1637 | |
| C1CN1C1CCOC1,0.3203 | |
| CC12OCC3CC1C23C,0.3069 | |
| c1nc(c(c(n1)O)O)N,0.2144 | |
| CC1COCC2CN12,0.2961 | |
| CC(C#CC=O)C1CO1,0.2043 | |
| CCCC1CC(=O)C=C1,0.1916 | |
| C1CC1(CCCC=O)O,0.2279 | |
| CN1CC(O)C11CC1O,0.2674 | |
| N=C1NC=NC=N1,0.1774 | |
| CC1(COCC=C1)C,0.2663 | |
| Cc1c(c[nH]n1)C=O,0.2042 | |
| OC12CC3C1COC23,0.3023 | |
| OCCC(O)CCC#C,0.3135 | |
| CC(O)C12CCCC1N2,0.3095 | |
| N=COCCC=O,0.2267 | |
| c1[nH]c2c(n1)c(n[nH]2)N,0.2175 | |
| CC1(C)C2C(O)CC12O,0.3076 | |
| O=CC1C2C3C=CC1C23,0.2032 | |
| N=C1OCC11CC=CC1,0.2652 | |
| CC12COCC(O)C1O2,0.3102 | |
| CCN1CC(O)C1=NC,0.236 | |
| OC1(CCC11CC1)C=O,0.2252 | |
| COCC1COC1=NC,0.273 | |
| CCC(C)C1CC(=N)O1,0.2885 | |
| OC1CCC1=O,0.2226 | |
| C1CC12CC(=CN2)C=O,0.1743 | |
| C1OC2CC1C=C2,0.2466 | |
| CCOC(=O)C#CC,0.234 | |
| FC1=CNC(=N)N=C1,0.1464 | |
| COC(C#C)C(C)C#C,0.2884 | |
| NC1CCC1(N)C#N,0.2731 | |
| CC1=[NH+]C(CN1)C([O-])=O,0.1506 | |
| C1CN=C(OC1)NC=O,0.2355 | |
| N=C1NN=NC=C1C#C,0.1461 | |
| C#CCOc1cnoc1,0.2269 | |
| c1c2n(nc1O)CC=C2,0.1796 | |
| C1C2C3C4COC13C24,0.3191 | |
| CCCC#CC#C,0.2314 | |
| O=C1C2C3C(C#N)N2C13,0.2264 | |
| CC1(CC(=O)N1)C=O,0.217 | |
| CCc1cncnc1N,0.2157 | |
| CC1C2CC3=CCC1C23,0.216 | |
| COC=NC(C)C#CC,0.2663 | |
| CC1(C)CN2CC12,0.3104 | |
| C#CC1CC=C2CCC12,0.2442 | |
| COC1(CCC1)C#C,0.2888 | |
| CC1(N)C=CCOC1=O,0.2444 | |
| O=CCC1(CCO1)C=O,0.2045 | |
| N#CCN1C2C3CC1C23,0.2567 | |
| CC1C2C3N1C3(C)C2C,0.3187 | |
| OCC12NCC1(O)C2O,0.2645 | |
| CC1(C)C2(O)CC1(O)C2,0.3105 | |
| CC12CC3(C)C1COC23,0.322 | |
| CN=CNc1[nH]ncn1,0.2165 | |
| COC12CCC1C2(C)C,0.3104 | |
| CC1(O)C[NH2+]C1C([O-])=O,0.2626 | |
| COC1CC(=O)C=C1,0.1901 | |
| N#CC12CC3C1CC23,0.3191 | |
| OCC1CCOC1,0.3234 | |
| O=CC12C3CC1C=CC23,0.2091 | |
| CC1(C)OC1C1CCO1,0.3205 | |
| OC(CC#C)C#N,0.2835 | |
| OC1CC1OCCC#N,0.2696 | |
| C(=O)c1[nH]c(c(n1)N)N,0.1554 | |
| FC(F)(F)C1CN1,0.3538 | |
| [O-]C(=O)C1=CNC(=[NH2+])N1,0.1749 | |
| CC12CN1CCOC2,0.3068 | |
| OC1C(O)C1C#CC=O,0.1934 | |
| CC1CN1C1=NC=NO1,0.2364 | |
| CCn1cc(nc1O)O,0.2373 | |
| C1COC(=O)NC(=O)N1,0.2735 | |
| CC1N2CC2(C#C)C1=O,0.2129 | |
| CCC1C(C)C1C(C)O,0.3257 | |
| CCOC1CCCCO1,0.3373 | |
| CCC12OCC1C2C=O,0.213 | |
| Cc1cc(n[nH]1)NC,0.2217 | |
| OC(COC=O)CC#C,0.2848 | |
| OCC(=O)NCC1CO1,0.275 | |
| CC1(CCO)NC1C#N,0.2861 | |
| c1c2c([nH]n1)CCO2,0.2205 | |
| CC1C2OCC2C1(C)C,0.3142 | |
| C1CC23C1CC1C2CC31,0.3493 | |
| CCC#CC1CC2NC12,0.2801 | |
| O=CC1OC2CCC=C12,0.2089 | |
| CC1CC23CCCC12N3,0.305 | |
| CN1CC(C)(C#N)C1=O,0.2689 | |
| Cc1coc(nc1=O)C,0.2078 | |
| CC1=CCC(O)C(=O)C1,0.2128 | |
| CCC1CCC1C(C)C,0.356 | |
| CC(C#N)C(C)C1CC1,0.3231 | |
| C(=N)N(C=N)C(=O)C#N,0.2005 | |
| CCc1cc(oc1)CC,0.234 | |
| CC([NH3+])C1=COC([O-])=N1,0.236 | |
| CC1(O)CC=CC1O,0.2496 | |
| CN(C)C(=O)NCC#C,0.2706 | |
| CC1NC1(C)C(O)C#C,0.2615 | |
| CN(C)C1COC1C=O,0.196 | |
| CC(C)C(=O)C(=O)N,0.1759 | |
| CCC(C#N)C(F)(F)F,0.3524 | |
| N=C1NC=CN=C1C=O,0.1339 | |
| NC(C#N)C1=NON=C1,0.2212 | |
| CCN1CC1COC=O,0.2331 | |
| C1CN2C(=C1)CCC2=O,0.2182 | |
| C#CCC1OCCC=C1,0.261 | |
| OCC1(C=O)C2CN1C2,0.2118 | |
| CC(C=O)C12CCC1N2,0.223 | |
| Cc1cnc([nH]1)NC=O,0.193 | |
| C1C2CCN=C3OCC123,0.2632 | |
| C1C2OC2C2=NC=CN12,0.2308 | |
| OCCC1C2CC1C2,0.3433 | |
| C(=O)c1noc(=O)o1,0.1924 | |
| CN(C=O)C1C2COC12,0.2632 | |
| CC1C2COC2C11CN1,0.2978 | |
| C1OC2C3OC3CCC12,0.3111 | |
| CCCC1(O)CCC1=O,0.2177 | |
| O=C1C2NC3C2NC13,0.197 | |
| OCCCC12CC1OC2,0.3036 | |
| CC1CC2(CO2)C1=O,0.2034 | |
| O=CC1C2NC3C2OC13,0.2269 | |
| c1ncnc(n1)C#N,0.1995 | |
| OCCC(=O)C(O)CO,0.2243 | |
| CN1CC1CCCC#C,0.2785 | |
| C#CCCC(=O)CC#C,0.2288 | |
| CC1CCC2N=COC12,0.2702 | |
| O=C1OC2CCNC12,0.248 | |
| Cc1cnoc1NC,0.2179 | |
| c1c2n(c(n1)O)CCC2,0.2478 | |
| OCC1(CC(=O)O1)C=O,0.2147 | |
| N#CC12NCC1C1NC21,0.2388 | |
| CCC1CC(=O)N1C=N,0.2283 | |
| N=C1CN(C=O)C(=O)N1,0.2357 | |
| CC1CC2CC(CO1)O2,0.3203 | |
| C1C2N1CC1=C2NN=N1,0.2239 | |
| CC1OC(=O)C1(O)CO,0.2562 | |
| N=C1NC(=N)N=CC=N1,0.1376 | |
| CN1C=CC(C)(O)C1=O,0.1986 | |
| CCCC1CNC(=O)O1,0.314 | |
| CN=C1NCCC(=O)N1,0.2181 | |
| CC1(CN1CC#N)C=O,0.2206 | |
| OC12C(NC1=N)C2C#C,0.2427 | |
| CC12OC(CC1=O)C2O,0.2111 | |
| CC1C(OC1=N)C1CO1,0.2909 | |
| OC1CNC2(CC2)C1=O,0.2006 | |
| CC1CC1(O)C(N)=O,0.2677 | |
| CC1NC(=O)N2CCC12,0.2896 | |
| N#CC1NC2COC1C2,0.2825 | |
| c1cnc(=O)oc1,0.1844 | |
| CC1C2CCC1(O)C2O,0.3115 | |
| c1cnc(c(=O)nc1)O,0.1763 | |
| CC1C2N3CC2(O)C13C,0.3082 | |
| CC1C2CC(C#N)C12C,0.2958 | |
| C1C=C2C3C4C2C1N34,0.1621 | |
| C1C2C1N1CC3C1CN23,0.2746 | |
| OC1C2NC1C2C#N,0.2851 | |
| CC1C(C=O)C11CCC1,0.2235 | |
| CC(=O)C1OCCO1,0.2178 | |
| CC1C(C)C11OCC1C,0.2947 | |
| CC1(O)CC11CC(O)C1,0.3173 | |
| c1nc(c(o1)N)C(=O)N,0.2118 | |
| CC1C=C2CC3C1C23C,0.1779 | |
| C#CC#CC#CC#N,0.1661 | |
| c1c(=O)c(c[nH]c1N)N,0.1852 | |
| CC1=C(C(=O)N(C1)C)C,0.2173 | |
| CC(C)C1CCC11CO1,0.3296 | |
| OC1C2CC1(N2)C#C,0.265 | |
| CC1(C)C2CC(O)C12C,0.3146 | |
| CCC(=O)C(=N)NC,0.187 | |
| C#CC1(CC1)NCC#N,0.2566 | |
| CC1CC=C(CO)CO1,0.2621 | |
| CC12CC(=O)C3CC1C23,0.2238 | |
| N=C1NC(=O)OC=N1,0.2173 | |
| CCN(C)c1cc[nH]n1,0.2166 | |
| N=C1C=CC=NOC1=O,0.1756 | |
| CC(O)C(C)(O)CC=O,0.2204 | |
| O=C1C2CC2C2NC12,0.2031 | |
| CCNCc1ncco1,0.2316 | |
| OCC(=O)C1C2CC1O2,0.2074 | |
| CC1C2C(O)C2(O)C1C,0.3005 | |
| CC1=CC(OCC1)C#N,0.2594 | |
| CCOC1CC2CN2C1,0.3015 | |
| O=CC1C2CC(=O)C1O2,0.193 | |
| NCC1(CCCN1)C#N,0.276 | |
| CCC1(CO)CC1OC,0.299 | |
| OC1CC=CC2COC12,0.2537 | |
| OCC12CC3C=CC1C23,0.2343 | |
| CC1CC2(CC2)C2OC12,0.346 | |
| CC1OC(=O)C1(O)C#C,0.2441 | |
| CN(CC#N)CC(=O)N,0.2496 | |
| C#CC1=CC(=O)COC1,0.1605 | |
| CC(=O)N1CC2(C1)CC2,0.2667 | |
| [NH3+]CCC(C#C)C([O-])=O,0.2734 | |
| N=COCC1NC1C=O,0.2218 | |
| CC#CC(=O)C#CCO,0.1898 | |
| c1c(onc1O)CN,0.2441 | |
| OC1CCC(CC=O)C1,0.2277 | |
| CC1C(NC=O)C1C#C,0.2663 | |
| CC(C=O)(C=O)C#C,0.2075 | |
| c1cc(c(c(c1)O)N)N,0.2116 | |
| C1C2C1C1OC1C1OC21,0.3284 | |
| CC#CCC1CCC1O,0.3016 | |
| COC1CN(C1)CC#C,0.2599 | |
| C(=N)(C(=O)NC(=N)N)N,0.1801 | |
| c1coc2c1CC=CC2,0.2307 | |
| OC1CC11OCC1C=O,0.2062 | |
| CCC1CCC11CC1O,0.3256 | |
| CC12CC(C1)N(C2)C=O,0.2708 | |
| CC1=CCCC1,0.2608 | |
| C#CCOCCC#N,0.2891 | |
| CC1CC2(CO)CC12,0.322 | |
| O=CC1C2COC1C=C2,0.2157 | |
| CC1CNC1C(=O)C#N,0.1656 | |
| NC1=NCC2NC2C1=O,0.1759 | |
| CN=C1OCOC1CO,0.2732 | |
| c1c([nH]c(=O)c(n1)N)N,0.1598 | |
| CCN(C)c1[nH]ncn1,0.2415 | |
| CC1C(O)CN(C)C1=O,0.2719 | |
| CCC1CC(C)(O)C1O,0.3025 | |
| OC1C2CCC1N2C=O,0.2607 | |
| Cc1c(cn[nH]1)CC#N,0.2555 | |
| C(CC=O)CC(=O)CO,0.2213 | |
| c1c(nc(o1)CN)O,0.2204 | |
| COCCC(O)C#N,0.2749 | |
| CC12C=CCC1C2C=O,0.2111 | |
| OC1=NC(=N)N=NN1,0.1814 | |
| CC1OC1C1CC(C)C1,0.3372 | |
| O=C1C=CC2N3CC12C3,0.1549 | |
| C1CC12CN=C(C2=O)N,0.1865 | |
| CC#CC(C=O)C1CN1,0.2151 | |
| OC12CCC1(O)C1NC21,0.2916 | |
| CC1NC(C#C)C1=O,0.2118 | |
| CC1(CO1)C(=O)C=O,0.149 | |
| CC(CC=O)OC=O,0.2245 | |
| CCC12CC1CC(C)O2,0.3119 | |
| CN(C)C(=O)C#CC#C,0.192 | |
| c1c2c(noc2on1)N,0.2265 | |
| OC12CCC3CC1OC23,0.3274 | |
| CC1(O)C2CC=CC12C,0.2439 | |
| COC1CC2C(C)CC12,0.3201 | |
| CC1C2C3C4N2C1C34O,0.2854 | |
| NC(=O)C1OC1CC#N,0.2582 | |
| CC#CC1(O)CC1C,0.2686 | |
| CC(C)OC(=O)C(C)N,0.2501 | |
| c1cnn2c1C=CC2,0.1901 | |
| CC12OC(C1O)C2=NO,0.2504 | |
| C1CC11OCC11CCO1,0.2958 | |
| OC12CC1C1(CO1)C2,0.3287 | |
| CC(C)CN(C)C=O,0.2716 | |
| CCC(O)C#CCC#N,0.2855 | |
| CC12C3C4C1C2(O)CN34,0.2863 | |
| COC1OCCCC1=O,0.2128 | |
| CC1C2OC=NC12C=O,0.2168 | |
| CC#CCNC(=O)C=O,0.1728 | |
| NC1=CC(=O)NC1C#C,0.2202 | |
| CC1OC2CCC12C#C,0.2753 | |
| CC(CO)C(C)CO,0.3347 | |
| CC12C3CN1C3C21CO1,0.3089 | |
| CC1CNC1=O,0.2825 | |
| Cn1cc(nn1)C#N,0.242 | |
| CC1C2CC1(C)C(C)O2,0.3109 | |
| OC12CC1C1CN1C2,0.2917 | |
| CCC1CC(O)C1C=O,0.2227 | |
| N#CC12CCC1C1CN21,0.2563 | |
| CC1CC2CC2C1CO,0.3343 | |
| C1CC1C12NC1CC=C2,0.2379 | |
| CC1OC=NC1(C)C=O,0.2147 | |
| CCNC(=N)C(=O)C=O,0.1113 | |
| CC1OC2CC3(C)C2C13,0.3245 | |
| N=C1CCC(CC#C)O1,0.2824 | |
| CC1CCOC(=O)C1,0.2719 | |
| CC1=CCCCC1,0.2614 | |
| N=C1CN2CC2CO1,0.261 | |
| C1COCCOC=N1,0.2583 | |
| c1nc2c(o1)nno2,0.1919 | |
| CCOC1CC2NC12,0.3076 | |
| C#Cc1c(cn[nH]1)N,0.1877 | |
| Cc1c(c(n[nH]1)C)N,0.2328 | |
| CC12CC34C=CC(C13)C24,0.2202 | |
| CC#CC(=N)NC(=O)C,0.2164 | |
| CC1CC1C1COC1C,0.3233 | |
| CC(=O)C1CC2(CO2)C1,0.2316 | |
| CC1C2C1C1(C)COC21,0.3068 | |
| CN1C2CC1C2=NO,0.2517 | |
| CC1(COC1C=O)C=O,0.2082 | |
| OC1C2CC3C(C2)C13O,0.3005 | |
| C(C#CC(=O)N)O,0.2366 | |
| CCC1CCNC(=O)O1,0.3071 | |
| C#CC1(CC2CN12)C#C,0.2483 | |
| OCC1C2CC=CC1O2,0.2348 | |
| OC1CC2(O)CC12O,0.2938 | |
| CCC12CC3C(C1)C3C2,0.3415 | |
| CCCC(C)OC,0.3341 | |
| CC12C3CC(CC13)C2=O,0.2256 | |
| C1CC1C1COCC=C1,0.2645 | |
| CC1(C)CC1(O)C=O,0.2173 | |
| CC1CCOC1CC=O,0.2238 | |
| CC(=N)N(CCO)C=O,0.2209 | |
| OCC1CC2C3CC3C12,0.3085 | |
| C1CC23OC(C=C2)C3O1,0.2309 | |
| CCNC(COC)C#N,0.2671 | |
| COC1CC1([NH3+])C([O-])=O,0.2676 | |
| COC1CC2C(C)C12O,0.3284 | |
| CC(C)C(C)(CO)C#C,0.3114 | |
| CC1CC(C1C)C(N)=O,0.2709 | |
| C1CC23CC=CC2OC13,0.2468 | |
| O=C1C2NC=NC1C=C2,0.2013 | |
| c1c(c([nH]c1N)O)C#N,0.2098 | |
| Cc1c(cnc(n1)F)N,0.1855 | |
| CNC1C2NC2(C)C1=O,0.1992 | |
| CN(C)c1n[nH]nn1,0.198 | |
| CN1CCC1(C#N)C#N,0.2349 | |
| c1cn2c(c1C=O)CC2,0.1993 | |
| CC12CN1C(C2)C#N,0.2703 | |
| CC1=C(C)C2C3OC2C13,0.2216 | |
| COC1CC(C1)C#N,0.2949 | |
| CCC1(O)CCN2CC12,0.2915 | |
| CC1C2CC3(O)C2OC13,0.3024 | |
| COC12CN3C(C=C1)C23,0.224 | |
| OC1CC1C1OCC=C1,0.2524 | |
| C1CC(C1)(C=O)C2CC2,0.2251 | |
| N=C1NCCCC(=O)N1,0.2203 | |
| CN1C2C3C4C3C2(C)C14,0.3035 | |
| CNC(=O)N(C=N)C=O,0.2253 | |
| CC(CCO)C(C)(C)C,0.3355 | |
| CCC1CC2(C)C(C)C12,0.32 | |
| OC1C2CC1C(=C2)C#N,0.201 | |
| CC#CC(C#C)C1CO1,0.2831 | |
| OC12CC(C1)(C2)C#C,0.2961 | |
| CC(C)[NH2+]CC([O-])=O,0.2671 | |
| CN1CC1C1CCC1=O,0.2045 | |
| CCC12CC3C4C3C1C24,0.3045 | |
| OC1COC(OC1)C=O,0.2251 | |
| OC1C2CC1(O)C1OC21,0.3145 | |
| COc1c([nH]c(=O)o1)N,0.2388 | |
| CC#CC(=O)CC1CC1,0.2013 | |
| CCCC1(CC=O)CO1,0.2229 | |
| C(=O)C(C=O)(C=O)C=O,0.1946 | |
| CC(C)C1C2C3CC1C23,0.326 | |
| c1coc(c1C#N)CO,0.2161 | |
| CC1C2CC3CC3(O)C12,0.3226 | |
| O=CC12CCC1C1OC21,0.2172 | |
| OCC1C(O)CC11CN1,0.2919 | |
| CC1=CC2OC1C2C#C,0.2268 | |
| Cn1c(noc1=O)C=O,0.1682 | |
| Cc1[nH]c(=O)ccn1,0.1957 | |
| CCC1(C)CC(O1)C#N,0.2791 | |
| c1(c(nc([nH]1)O)N)N,0.2337 | |
| CC1C2CN2C11COC1,0.306 | |
| C#CC1COCCO1,0.2696 | |
| COC(C#C)C1NC1C,0.2781 | |
| CC1CC(C=O)C1C=O,0.2043 | |
| OCC1=CC(=N)OCC1,0.2139 | |
| NC1(CC2CN2C1)C#N,0.264 | |
| CCCC(=O)OC,0.2869 | |
| C1OC11CCCCOC1,0.3148 | |
| C#CCC1CC1N1CC1,0.2977 | |
| CN=c1cc[nH]nc1N,0.1709 | |
| N#CCCOCC1CN1,0.2859 | |
| CC1C2OC2CC1C=O,0.2246 | |
| CC12CC1C1(C)CC1C2,0.321 | |
| C(C1CN1)C1=CN=CO1,0.2422 | |
| O=C1C2OC3C2CCC13,0.2086 | |
| CC12CCC(C1)CC=C2,0.2615 | |
| Cc1c(nccn1)N,0.1894 | |
| CCC1CC2(CC2)C=C1,0.2448 | |
| C1CC=CCC(=NO)C1,0.2432 | |
| CC1CC11CC2NC12,0.306 | |
| CCC#CCCC(=O)N,0.2682 | |
| OCC(CC1CO1)C#N,0.3055 | |
| N#CC12CC1N1CC21,0.2515 | |
| C1CCC(C1)CCCO,0.342 | |
| COc1cc(ncn1)N,0.2231 | |
| COC(CO)CC#N,0.3048 | |
| CC1=C(F)N=NNC1=N,0.1627 | |
| CC1OC11CNC(=O)C1,0.2747 | |
| CC1(O)C(O)C1C1CC1,0.297 | |
| C1OC23CC(C4NC24)C13,0.2863 | |
| CC1(C)OCCC1C#C,0.2918 | |
| CCCc1c(c[nH]n1)N,0.2262 | |
| CC12OC1C=CC2O,0.2379 | |
| CCN1CC1C#CCO,0.2482 | |
| C#CC1C2CC1C1OC21,0.2971 | |
| OC12CC(C1)N=COC2,0.2686 | |
| ON=C1CN=CN2CC12,0.2288 | |
| CC1(CC(C1)N2CC2)C,0.3107 | |
| CC1OCOCC11CO1,0.3293 | |
| CC12CN1CC1NC21,0.2922 | |
| CC1(C=O)C2OC1C=C2,0.2153 | |
| CC1C(=O)CC11CN1C,0.2097 | |
| CN(C=N)c1ccon1,0.2062 | |
| CCC12NC3C1NC23,0.2873 | |
| O=C1CC2CCC1C2,0.2228 | |
| c1cnoc1OCCO,0.2378 | |
| COC12CC1N1CC21C,0.2856 | |
| OC1(COC=N)COC1,0.2627 | |
| CCC1CC1(CC)C=O,0.2261 | |
| CCC1(C)CCC1=O,0.2163 | |
| CC(O)C#CCCC#C,0.2859 | |
| N=C1ON=C(O1)C1CC1,0.2356 | |
| OCC1(O)CC11CCC1,0.2969 | |
| COC1CCC=C1C,0.2597 | |
| CC12NC1C(O)CC2=O,0.2186 | |
| NC1=NNC=C(O)C1=N,0.1628 | |
| CCC1(C)OCOC1C,0.3236 | |
| c1nc(on1)CCCO,0.2536 | |
| C#Cc1ncno1,0.2143 | |
| CC1C=CC2OC(=O)C12,0.2575 | |
| CC12CC1C=CC2O,0.2394 | |
| COC(=O)NC(C)C#N,0.2952 | |
| CN1C2CCCC2C1=O,0.2757 | |
| CCC1CC(C)(O)C1C,0.3202 | |
| CC12OC(=N)C1(C)C2O,0.2674 | |
| CC1C2CC1C2(C)C=O,0.2227 | |
| NC1=[NH+]CC(N1)C([O-])=O,0.2534 | |
| CC(C)CNC(=N)C=O,0.1662 | |
| CC(=N)OCC1COC1,0.2753 | |
| OC1CCC1OC=N,0.2708 | |
| COC1C2COC(=N)C12,0.2696 | |
| CC12NC1C=C1COC21,0.2269 | |
| OCCC1(CCO1)C#N,0.2775 | |
| CCCC1C2C3CC1N23,0.3123 | |
| CC1(C)CC(O)C(O)C1,0.2957 | |
| Cc1ccc(c(n1)O)F,0.206 | |
| OC12CCC3CC1C23O,0.282 | |
| OCC1(CC1O)C#N,0.2735 | |
| CC12CC(O1)C(=O)CC2,0.2097 | |
| CCC(C)OC(=O)CO,0.2746 | |
| CNC(=O)NC(=N)C#C,0.1993 | |
| CCC1=CC(=O)OC1,0.226 | |
| NC1=NOC(=N)N=C1,0.1473 | |
| CC(C)(C)n1cncn1,0.2725 | |
| Cc1c(c(c[nH]1)N)C#N,0.197 | |
| C1CC11C=C2CN3C2C13,0.1656 | |
| [NH3+]CC1=N[N-]N=CC1=O,0.1978 | |
| N=COC(=O)CC=O,0.224 | |
| OC1C2CC3OC1C23O,0.2996 | |
| NC(=O)C#CC(O)C#N,0.2298 | |
| CC12CN=CN1C2CO,0.2368 | |
| C1CCC(CC1)CCO,0.3406 | |
| CC1N=C(N)OC1C#N,0.2468 | |
| CC(CC#C)OC1CC1,0.302 | |
| C1C2CC3CC2C1O3,0.3241 | |
| CN=COC(C)C#N,0.2686 | |
| OC12CCC3C1OC23,0.3073 | |
| CC1CC=CCC(C)O1,0.2523 | |
| C1CC23CC(OC=N2)C13,0.2399 | |
| CC1CCC(=O)C2CC12,0.2257 | |
| C1CC=C(C(=O)C1)C#N,0.182 | |
| CC12COC(CCC1)O2,0.3263 | |
| OC1CC1C1=NON=N1,0.1853 | |
| CC12CC3(CC1C23)C=O,0.2191 | |
| CNC1(CC1C#C)C#N,0.2401 | |
| CC1CCC2C(O)C12O,0.3081 | |
| C#Cc1cc(=O)cc[nH]1,0.1729 | |
| CC12CN1C1C2NC1=O,0.2507 | |
| CC(=O)COCC#N,0.2352 | |
| CCCC#CCCO,0.3003 | |
| CC1C2C(C#N)C2C1C,0.3112 | |
| CC(C=O)C1=NC=CN1,0.1958 | |
| OCC12C3CC1C(=O)N23,0.2511 | |
| CC12OCC1(N)C2C#N,0.2658 | |
| O=C1NC2CC3C2N13,0.2667 | |
| CCC#CC(CC)OC,0.2939 | |
| Cc1cncn1CC#N,0.2286 | |
| c1c(c(c(o1)N)CO)N,0.2116 | |
| CN=C(c1cnco1)N,0.203 | |
| C1C2OCC3N=COC123,0.2527 | |
| O=CNCC#CC1CO1,0.2603 | |
| c1c(=O)nnoc(=O)n1,0.1587 | |
| CC#CCC1C2CC1O2,0.2907 | |
| CN=CN(C)C(=N)OC,0.2322 | |
| OCC1OC(=N)N2CC12,0.2844 | |
| C1C2CN3N=CN=C3N12,0.2515 | |
| C1C2OC3C4COC12C34,0.3056 | |
| CCCC1OC=NC1C,0.2692 | |
| CC1(CC#N)NCC1=O,0.2113 | |
| C#Cc1c[nH]c(n1)C=O,0.171 | |
| OC1C2NC=NC12C#N,0.2399 | |
| OC1C=CC2C3CN3C12,0.2295 | |
| COC1(COC1)C(=O)N,0.2586 | |
| CCOC(=O)CC1CO1,0.2828 | |
| N=C1OC=NC(=N)C=N1,0.1862 | |
| O=C1CC2CCC(C2)O1,0.2716 | |
| CC12OC1CNCC2=O,0.1942 | |
| c1ccc(c(c1)CO)F,0.2336 | |
| CC1=NC(N)=CC(=N)O1,0.1729 | |
| [NH3+]CC1=COC([O-])=C1,0.2285 | |
| OC12CCC3C4C1N4C23,0.3017 | |
| C1CC(=O)C(=C1N)C=O,0.1761 | |
| OC1C2C3CC2C13,0.323 | |
| CC1C2C(O)C3(CC3)N12,0.294 | |
| CC12CN3C1C1OC1C23,0.293 | |
| OC(C#C)C(C=O)C#N,0.2203 | |
| OC1CC2CC1CC2=O,0.2234 | |
| OCC1C=CC(=O)C1=O,0.1397 | |
| C1C2CC1C1=CN=CN21,0.2447 | |
| CC1(N)C2COC12C#N,0.2489 | |
| OC1CCC2(O)CC2C1,0.3219 | |
| CC#CC(C)C1COC1,0.2976 | |
| CN=C1C(=O)C=CN1C,0.142 | |
| Cc1c([nH]c(n1)C#C)O,0.1881 | |
| CCCC1OC1CC#C,0.31 | |
| c1c(ocn1)OC(=O)N,0.2445 | |
| CCC1(O)C2COCC12,0.3131 | |
| OCC1CC=CCO1,0.2676 | |
| CC1=C2NC3C2C3C1=O,0.149 | |
| Cc1c(nn[nH]1)C,0.2436 | |
| CCC1(C)CC=CC1O,0.2602 | |
| CCCCc1cnco1,0.2419 | |
| CC1OC2(C)CC=CC12,0.2582 | |
| CN1C(=N)OC=C1CO,0.2174 | |
| OC1C2CC3CC2C1O3,0.3158 | |
| OC1CC2OC3C2CC13,0.3124 | |
| CC#CC(O)C(C)CO,0.2873 | |
| CCC(C)COCC#N,0.2923 | |
| NC(=O)C1OCC1C=O,0.1891 | |
| CC(CO)C(=O)C1CO1,0.2193 | |
| CC12C3OC1CCC23O,0.2836 | |
| c1cc2ncccn2c1,0.1569 | |
| CC12CC3(C)CCN1C23,0.3159 | |
| O=C1CC=CC2CCC12,0.2163 | |
| CCN1CCC1=O,0.2791 | |
| CC1COCCC2OC12,0.3302 | |
| CC1(CN1)C1=NCCO1,0.2625 | |
| C(C#CCO)O,0.2807 | |
| CC1C(O)C(O)C1C#C,0.2824 | |
| C1C2N=C3OCC=C3C12,0.2 | |
| C1C2OC3CCCC12O3,0.3183 | |
| C1CC(=O)C=C1CC=O,0.1788 | |
| NC12CC1OC2=N,0.2629 | |
| CC1CC(C1)=NO,0.2496 | |
| N=C1NCC2=C1ON=C2,0.1976 | |
| C#CCCC1CC1C#C,0.2898 | |
| NC1=CN=C(N1)OC=N,0.2097 | |
| O=C1C2C3CC1OCC23,0.2113 | |
| C1C2NC3C1OC23,0.3034 | |
| NC1C2CNC12C#N,0.2328 | |
| OCC(O)C(O)C#C,0.2895 | |
| CC(=O)C#CCO,0.2092 | |
| c1c(nc(n1C=O)N)N,0.1589 | |
| c1c(c(nc(=O)o1)F)F,0.1855 | |
| NC(=O)C(C=O)C1CN1,0.1996 | |
| c1(nc(=O)[nH]nn1)N,0.173 | |
| CC1CCC1C(C)=NO,0.2524 | |
| CC1C2C3C4C(CN14)N23,0.2712 | |
| CC(C)C(C)(C)C1CC1,0.3471 | |
| OC12C=CC3C(C=C1)C23,0.2373 | |
| CN(C)CC1(CC1)C#N,0.2608 | |
| Cc1c(ocnc1=O)N,0.1979 | |
| COC(=O)C(=O)CCO,0.1823 | |
| OC1C2CC1N2CC#C,0.2684 | |
| O=C1CC2C3CC2C3C1,0.2203 | |
| N#CC12CC1OCOC2,0.2953 | |
| CC(C=O)C1(CO1)C=O,0.2186 | |
| Cc1cc([nH]c1C#N)C,0.2032 | |
| CC1(C)OCOC1=N,0.2895 | |
| CCn1c(c(cn1)O)O,0.239 | |
| CC(OC=N)C=O,0.2245 | |
| C#CC1CC1C#N,0.2756 | |
| COC1C(C)COC1=O,0.2491 | |
| CCC[NH+](C)CC([O-])=O,0.2639 | |
| CNc1c[nH]cnc1=O,0.1839 | |
| CC12CC1CCNC2=O,0.2611 | |
| CC1C2C3CC3(C)CN12,0.3027 | |
| CC1(C=C(CO1)C=O)C,0.1826 | |
| C(C(=O)CO)C(=O)N,0.2167 | |
| CC12OC1C(CO)C2=O,0.2112 | |
| CCCCCCN1CC1,0.3185 | |
| CNC1(C#C)C2CC1O2,0.2681 | |
| CN1C2CC1C(=O)C2=O,0.144 | |
| CC1CC11CCCCO1,0.324 | |
| C1CC12COCOC=N2,0.2561 | |
| COC(CO)CC#C,0.2963 | |
| OC12CC3C(C13)C21CN1,0.2871 | |
| COC1C2C(C)CC12C,0.3165 | |
| c1cc(=O)[nH]ccc1=O,0.1675 | |
| CC(C)C#CCC1CO1,0.2968 | |
| O=C1C2C3C4NC1C4N23,0.2046 | |
| CN(C=O)c1ncon1,0.224 | |
| OC12C3C=CN(C13)C2=N,0.2112 | |
| c1cocc(c1=O)F,0.2017 | |
| COCC1OC2CC2O1,0.3188 | |
| c1nnn(n1)CC#N,0.2596 | |
| CC1C2C3N2C(=O)C13C,0.2482 | |
| O=CC1OCC=C1C#N,0.1844 | |
| OC1CC(O)C1NC=O,0.2723 | |
| Cc1c2c(n[nH]1)CCO2,0.2199 | |
| c1noc(=O)n1C(=N)N,0.2356 | |
| O=C1NCCC(O1)C#C,0.2743 | |
| c1[nH]nc(n1)OCCO,0.249 | |
| C#CC1NC1(C#C)C#N,0.2434 | |
| CC1CC(CC(N)=O)C1,0.2778 | |
| CC1=CCC(CO)OC1,0.2621 | |
| CCC1(CN=CO1)C#C,0.2702 | |
| CC(C)N=C1COCO1,0.275 | |
| COC(CC1CO1)C=O,0.2129 | |
| CC12C3CC1C(=O)NC23,0.2577 | |
| Cc1cnc(nn1)OC,0.1665 | |
| COC1CNC1(C)C#N,0.2678 | |
| C1C23COC12CCOC3,0.2966 | |
| CC1OC2CC1C21CO1,0.3142 | |
| CC(C)(C)COC1CC1,0.3229 | |
| CC1(C)CN2CC1(O)C2,0.2853 | |
| CCC1C=CCOC1=O,0.2594 | |
| CNc1ccoc(=O)c1,0.1862 | |
| CCCc1nnon1,0.2456 | |
| Cc1c(ncc(n1)N)N,0.1638 | |
| NC1=CC(=N)N=C(F)N1,0.2072 | |
| CC1[NH2+]C(C1C)C([O-])=O,0.2646 | |
| CC1OCOCC(C)=C1,0.2551 | |
| O=C1OC2CC1C2C#N,0.2621 | |
| CC1CC(C)C1CC#C,0.3129 | |
| CC12NC1C1CCC21C,0.2964 | |
| O=C1CNC2CN(C2)C1,0.19 | |
| OC1CC2CN=COC12,0.2734 | |
| CC12C=CCC3OC1C23,0.2365 | |
| C1C2C3C4CC2C1C34,0.3559 | |
| OCCC12CC(C1)CO2,0.3185 | |
| O=CN1CC2CC1C=C2,0.2323 | |
| CCCC1C2CC1(C)O2,0.3125 | |
| C(CC(=O)N)C#N,0.2794 | |
| CC1CC(=O)C(C)C1O,0.2223 | |
| OCC1C2C(CN12)C#N,0.2764 | |
| COC1C2CC1(O)C2O,0.3165 | |
| CCCC(C)NC(N)=O,0.3003 | |
| CCCC1CC2CC1O2,0.3329 | |
| CC(=O)c1ccccn1,0.1803 | |
| CC([NH3+])C1=NOC([O-])=N1,0.1869 | |
| O=COC1CCC1C#C,0.2695 | |
| c1c(nc(o1)C(=O)N)N,0.176 | |
| C#CC1OC2COCC12,0.2672 | |
| CNC(C)=[NH+]CC([O-])=O,0.2505 | |
| NC(=NCC1CN1)C#N,0.2205 | |
| CCNC1=CC(=O)NC1,0.2157 | |
| CCOCC12CCC1N2,0.3361 | |
| CC1=NC(CO)C(=N)N1,0.2271 | |
| CC1=C(CCCN1)C=O,0.1838 | |
| CC1CCC(C1)C(C)=O,0.2335 | |
| OC1CC11CC2CC12,0.3043 | |
| CC#CC12CC1(C)CO2,0.2403 | |
| CCC1C(=O)CC11CN1,0.2134 | |
| OC(CC#CC=O)C#N,0.2037 | |
| CCC1OCC2OCC12,0.3244 | |
| C1C2CC3CC(C3)C12,0.3368 | |
| OCC1CC2OC12C#C,0.2627 | |
| O=COC(C=O)C#C,0.2191 | |
| CN1N=CN=C(O)C1=N,0.1623 | |
| CC1CC(=O)C11CC1O,0.2167 | |
| COC12CN=C3NC1C23,0.1778 | |
| CC1N2C=NCC2C1=O,0.2035 | |
| CCC1C(O)C1(O)C#C,0.2512 | |
| C#CC1(CC=CC1)C#C,0.2641 | |
| CC12CC(C1)OC(=N)O2,0.2936 | |
| NC(C#N)C1=CC=NO1,0.2325 | |
| CCN1C=NCC1=O,0.2286 | |
| CC1CN1CC1(C)CO1,0.3106 | |
| c1cncc(c1O)C#N,0.2116 | |
| C#CC1CCC=CC=C1,0.1921 | |
| OC1CN2CC2C(=O)C1,0.2143 | |
| C#CCOC1C2CC1O2,0.2675 | |
| CC12OC(=O)C3CC1C23,0.2695 | |
| Cc1cnoc1C2CC2,0.2266 | |
| CN1CC11C2CC1OC2,0.3077 | |
| C#Cc1c(cno1)N,0.1786 | |
| C1CC2C3OC(C1)C23,0.3084 | |
| c1coc2c1c(no2)N,0.2311 | |
| CN=C(CO)N(C)C=O,0.2256 | |
| CC1(CCNC=O)CO1,0.2806 | |
| N=C1CCC(CO1)C#N,0.2762 | |
| CC(C)CN=CNC=O,0.2323 | |
| CC1C2CC(C#N)C12,0.3052 | |
| CCCC1(CO)CCO1,0.3249 | |
| CC12OC1CCC2O,0.3299 | |
| CC1(O)C(NC1=O)C=O,0.22 | |
| CC(=O)CC(O)C1CN1,0.2057 | |
| CC1C2NC2(C)C1(C)O,0.2962 | |
| CC12CN(CC1)C2C=O,0.2006 | |
| CC1C(N1C=O)C(C)=O,0.2107 | |
| NC1C(O)C1C#N,0.2619 | |
| C1COC(=O)NCC1=O,0.2119 | |
| O=C1C2CCC=CC1N2,0.2108 | |
| CC1C2CC1([NH2+]2)C([O-])=O,0.2182 | |
| CCC(=O)C1OCC1O,0.2173 | |
| CC(CO)C1CN2CC12,0.3031 | |
| CCC(C(C)O)C(C)O,0.3189 | |
| OCC1CC2CC1CO2,0.3121 | |
| CC1CN1CCC1CC1,0.3116 | |
| CC1(OCOC1=N)C#N,0.2761 | |
| CC(=NO)C(=O)N(C)C,0.2115 | |
| CC(C#N)C(O)CC#N,0.3084 | |
| O=C1CC2C3C4C3N2C14,0.2092 | |
| Cc1cc(ncc1F)C,0.2196 | |
| OCC1(CO1)C1CO1,0.3354 | |
| c1cc(cc(c1)F)C#N,0.2083 | |
| CC(=O)C12NC1C1OC21,0.2014 | |
| N1C=NC23C1C1C2OC31,0.2364 | |
| COC1C2CC2(C)C1O,0.3154 | |
| CCN(C)C(C#N)C#N,0.2348 | |
| OC1CC11C2NC2C1=O,0.2165 | |
| N=C1COCC(O1)C#N,0.2694 | |
| C1C=CC2CC=CCC12,0.2596 | |
| CC(C=O)N1CCC1,0.2039 | |
| CC1(C)C2CC=CC12O,0.238 | |
| CC(O)C1(CO1)C=O,0.2176 | |
| OCC(COC=N)C#C,0.2643 | |
| c1c(cncc1F)N,0.1992 | |
| CC1OCC1CC1CC1,0.325 | |
| CCCN1CC1C#CC,0.2611 | |
| CC12CC3C4C1C4C23C,0.3173 | |
| O=C1C=CCC2COC12,0.1741 | |
| CCC(=O)C#C,0.2087 | |
| c1cc(oc1)CNC=O,0.2333 | |
| O=C1CN2C3C4OC13C24,0.1972 | |
| NC1=NOC(F)=CC1=N,0.189 | |
| CCC12CC(N1)C2=O,0.2468 | |
| O=C1OC2CC1C1CC21,0.2698 | |
| CC(O)(CO)CC1CO1,0.315 | |
| O=C1CCC1C#CC#C,0.2009 | |
| Cn1cnc(n1)CC#N,0.2669 | |
| CC(O)C1CN(C)C1=O,0.2747 | |
| CC1(C)CCCC1C=O,0.2245 | |
| OC12C3OC1C3NC2=O,0.238 | |
| N#CC1CC=CC11CC1,0.2482 | |
| CN=C(C1CC1)NC=O,0.2221 | |
| c1nc2c(o1)C(=O)NC2,0.2191 | |
| O=C1NCCC2CC1C2,0.2568 | |
| C(C#CC1CC1)C1CN1,0.2792 | |
| CC1CC2(CCO2)C1=O,0.196 | |
| O=CN1CC1C(=O)C=O,0.1429 | |
| CCN1CC2OCC12C,0.2765 | |
| CC1(CO)CC1(N)C#N,0.2756 | |
| COC12CC=C3CC1C23,0.1826 | |
| C1OC1C1CC2OC2C1,0.3468 | |
| CC1CCC(C#C)C1=O,0.2149 | |
| c1c(c(c[nH]1)N)N,0.2348 | |
| C1C2C3CC4OC(C23)C14,0.3159 | |
| Cc1cccc(=O)nc1,0.1712 | |
| O=CC12CC(C1)(N2)C#C,0.2125 | |
| CC1C(O)C2CC12CO,0.3125 | |
| CCC1(C)CC1(O)C=O,0.2171 | |
| CC1=CC2OC1C2C#N,0.2261 | |
| CC12CC1C(=O)C2C#N,0.23 | |
| CC1C(=O)NC=C1C,0.2098 | |
| CC1(C)NC1(C)C=O,0.2138 | |
| C#CCC12CC1CCC2,0.3105 | |
| CC#CC12CC(C)C1N2,0.2692 | |
| OCC12CC(=O)CC1N2,0.2223 | |
| CC1NC1C1=NC=CN1,0.2417 | |
| CNC1C(CO)OC1=N,0.2517 | |
| c1c[nH]c(=O)ncc1=O,0.1616 | |
| C1C(=O)C(N1)(C#N)C#N,0.2168 | |
| CC1=C(C(=O)NC1)C=O,0.1701 | |
| CN1C2C=CC1C21CN1,0.2197 | |
| CCC12CC1C(C)OC2,0.3344 | |
| CC(=O)C(C)(C)C#C,0.2283 | |
| ON=C1CC(O)(C1)C#N,0.2433 | |
| CC1(C=CCOC1=O)C,0.2648 | |
| CC#CCC#CCC#N,0.2721 | |
| COC=NCCOC=N,0.2587 | |
| CC1CCC(=C1)C#N,0.2196 | |
| CN(C1CCC1)C(=O)N,0.2876 | |
| CCC1=CCOC12CC2,0.2257 | |
| CC(CCOC=O)C#C,0.2765 | |
| CCC(=O)OCC#N,0.2866 | |
| CC1OCC=C(C)C1C,0.2615 | |
| C1C2(CN1CC=O)CO2,0.2043 | |
| N=C1CNC2CC2CO1,0.26 | |
| CC1COC(CC=O)O1,0.2291 | |
| CC12NC1COC21CC1,0.2924 | |
| CNc1cccnc1,0.1912 | |
| CC1=NC2CC2(C)CO1,0.2489 | |
| CC(C)(C)CCC#C,0.3144 | |
| CN1CC2(C)CN2C1=O,0.2767 | |
| OCC#CC1CCC1O,0.2725 | |
| OCC(C1CN1)C1CO1,0.3058 | |
| C1CC1CN=CNC=O,0.2319 | |
| CCN1CC1C(=O)CO,0.2027 | |
| CC#CC1NC11COC1,0.2695 | |
| NCC1(CO1)C#N,0.2636 | |
| CC(O)C1CC1NC=O,0.2762 | |
| CCC(C)CC(C)=NO,0.2549 | |
| CCc1cnc(cn1)C,0.1953 | |
| OC1C2OC3COC1C23,0.3019 | |
| O=C1CCCOC1C#N,0.2073 | |
| OCC12OC1CC2C#C,0.2938 | |
| Cc1ccc([nH]1)CCO,0.2342 | |
| C#CC1(CC1)C2CCC2,0.2932 | |
| c1c([nH]cn1)C2COC2,0.2455 | |
| CCC(CC)NCC#N,0.2653 | |
| CC12COC1C2C#C,0.2781 | |
| CCCC1CC(C)C=C1,0.2612 | |
| CC(O)C1CC1OC=N,0.2809 | |
| N=C1OC(=O)NC2CC12,0.259 | |
| CNC(=[NH2+])C#CC([O-])=O,0.1249 | |
| CCn1cc(c(c1)N)N,0.2259 | |
| CC1=CC2CC(O)C1O2,0.2517 | |
| CC1C2CC3OC1CC23,0.3213 | |
| CCC(=O)C(=O)C(C)C,0.1555 | |
| CC1C=C2C3C4C3C2C14,0.1626 | |
| CC12COC(O1)C=C2,0.2457 | |
| CCOC(=N)C1(C)CO1,0.2726 | |
| Cc1c2c([nH]n1)nno2,0.1948 | |
| c1cc(nc(c1N)N)O,0.1842 | |
| CCCC1C2OC1C2=O,0.2458 | |
| CCC#CC12CN1CC2,0.2502 | |
| CC1=CCC(C1)NC=O,0.2608 | |
| COC(C)COC(C)=N,0.2864 | |
| N#CC1CC(O1)C1CN1,0.2496 | |
| N=C1CC2OCC2CO1,0.2767 | |
| C1OC2C3C4C2C1N34,0.3154 | |
| CCc1cncc(n1)C,0.1954 | |
| OC1C2NC1C2CC#N,0.2939 | |
| CCC(C)(CC)C(=O)C,0.2275 | |
| C#CC12CC(C1)CC2,0.3011 | |
| CC12COC11CC2CC1,0.293 | |
| CC1OCC(=O)OC1C,0.2631 | |
| c1c2c([nH]cn2)ncn1,0.2045 | |
| CC1(CC1)C(C)(C)O,0.3251 | |
| CCNc1cnoc1C,0.201 | |
| CC12OC3CC1C23CO,0.2801 | |
| CC(C)C1(C)CC1(C)O,0.3153 | |
| OC12CC1NC2C=O,0.2006 | |
| OC12CC3C1C1CN3C21,0.2866 | |
| CCC1CCCC1C=O,0.2258 | |
| CC12CC3C4CC4C1N23,0.2988 | |
| CC(=O)OC(CO)C#N,0.2783 | |
| C1CCN(C=CC1)C=O,0.2177 | |
| CC1CN(C1C)C(N)=O,0.289 | |
| CC1(O)C2COC(=O)C12,0.2685 | |
| CC12OC3C1C=CC23C,0.2239 | |
| CCOC(C#N)C#N,0.2766 | |
| C#Cc1ncon1,0.2249 | |
| Cc1ccc[nH]1,0.243 | |
| CC(C)CC(C)C(C)C,0.372 | |
| Cc1c(c(oc1C)C)C,0.2273 | |
| OC1CC2(CN2)C2OC12,0.3059 | |
| C#CCc1c[nH]cn1,0.2533 | |
| O=C1CC2OCOCC12,0.2225 | |
| C#Cc1cccc(c1)F,0.2007 | |
| O=CNC1=NCC2NC12,0.2194 | |
| CC12C3CC3N1CC2O,0.2742 | |
| O=C1OCC11OC1C#C,0.2497 | |
| OC12C3C1C1OCC3C21,0.3027 | |
| OC1C2NC2C=CC1=O,0.1871 | |
| CC1=NCC(=N)N1,0.2301 | |
| CC1C2OC3CC3C12C,0.3182 | |
| CC1C=CC2C1OC2=O,0.2466 | |
| CC1CN1C1CCC1C,0.2989 | |
| C1CC1C(=O)NC=O,0.2192 | |
| CC(C)C(=O)NC1CC1,0.2703 | |
| OC12CCC1=CCC2=O,0.2107 | |
| C1CCC2(C1)CO2,0.3329 | |
| CC12CC3CC(C1)C23O,0.3034 | |
| CCOC(=O)CC(=O)C,0.2275 | |
| CC#CC(C)COC=O,0.2645 | |
| CN1C2C3CN=C1C23O,0.1594 | |
| CC(C)(C)C(=O)CO,0.2295 | |
| C1C(=CC(=O)CN1)CO,0.1673 | |
| CC1(CNC(=O)C1)C=O,0.2113 | |
| OC1C2C1C1(CN21)C=O,0.1933 | |
| CC1CC(CO1)C=O,0.2235 | |
| OC1C2OCC3CC2C13,0.3169 | |
| CCC1C2CC3C2OC13,0.313 | |
| CC12COCC1(C)O2,0.3298 | |
| OC1CC2(CCC12)C#C,0.285 | |
| CC1COC1C1CN1,0.314 | |
| C1CN1CCC(=O)C=O,0.1443 | |
| CC12OC1CNC2C#N,0.2713 | |
| CC1CC=CC=CCO1,0.2028 | |
| CC1C2CN3CC2(O)C13,0.2909 | |
| CCC1C2C1C(O)C2O,0.3046 | |
| Cc1cc(c(=O)[nH]c1)C,0.1764 | |
| CC1(C)OC(C=C1)C#C,0.2533 | |
| CC1COC(C=O)=N1,0.1865 | |
| CC1OC1C1OC1C#N,0.2732 | |
| CCC12CC=CC1CO2,0.2603 | |
| OCC1CC2(CC2)C1O,0.3038 | |
| COC1COC1(C)C#N,0.283 | |
| CCC(O)C1OC1C,0.3246 | |
| Cn1c(noc1=O)N,0.2576 | |
| N#CC1CCCCOC1,0.3011 | |
| CC1C(O)C11COC1=N,0.2799 | |
| CC12CC(C1)C(=C2)C#N,0.1992 | |
| [NH3+]C(CC([O-])=O)C#C,0.2642 | |
| CCCCN=C(C=O)N,0.1829 | |
| C1NC1C1=CN=CN=N1,0.1662 | |
| CCc1c[nH]nc1O,0.2456 | |
| c1cnc(nc1C=O)O,0.1737 | |
| C(=Nc1c(n[nH]n1)O)N,0.1845 | |
| O=COC1CCCC=C1,0.2595 | |
| C#CCC12C3CC1OC23,0.281 | |
| COCC(C)(O)CC=O,0.2255 | |
| CC1(C)OC=NC1CO,0.2628 | |
| CC12CCCC1CCO2,0.3215 | |
| COCCC1CC(C)O1,0.3337 | |
| N#CC12CC3CC3C1O2,0.2839 | |
| C(CO)N=C(C(=O)N)N,0.2161 | |
| CC(=O)C12NC1CC=C2,0.2192 | |
| CC#CC1(CN1)C(C)C,0.2707 | |
| COCC1(C)OC1C,0.337 | |
| OCC1C2C3C2C1C3O,0.3155 | |
| CCN1CC=CC(=O)C1,0.1715 | |
| C1C2C3COC3CN12,0.3044 | |
| OCC1C2OCC(=O)C12,0.2205 | |
| N=COC1C2C3CN2C13,0.2638 | |
| C1CC23CCC2C=CC13,0.2532 | |
| CC12C(O)CC1OC2=O,0.2679 | |
| C1CNC(=O)C1=O,0.1725 | |
| CC1C2CC(O)C1CO2,0.3129 | |
| [NH3+]CC1=NC(=O)C=N[N-]1,0.183 | |
| CC[NH2+]C(C)CC([O-])=O,0.2774 | |
| O=CC12OC3CC1C23,0.2107 | |
| CC#CCOC(=O)C,0.2708 | |
| COC1(CC1)C(C)O,0.3125 | |
| CC1(CC(=O)CCO1)C,0.2243 | |
| c1[nH]nc(n1)NC=N,0.2244 | |
| CC1=CC(=O)OC1=NC,0.1913 | |
| COCC(O)CC(N)=O,0.2768 | |
| OC1CCC(=O)COC1,0.2161 | |
| CC1CC2C1CNC2=O,0.2686 | |
| c1[nH]c(c(n1)O)CCO,0.2241 | |
| CC1(COC1)C(C)(C)O,0.292 | |
| O=C(C#C)C1CNC1=O,0.1939 | |
| OC1CC=C2C=CCC12,0.1943 | |
| OC1CC2(O)CC(=O)C12,0.218 | |
| CC(=O)C1(C)CC1C#C,0.2247 | |
| C1C2C3OC4CC3C2C14,0.3232 | |
| CC1(CC1C#N)C1CO1,0.3066 | |
| CC(C)(C#CC=O)C#N,0.2036 | |
| NC(=[NH2+])C1=CC(=O)[CH-]N1,0.083 | |
| C1C2OC3CCOC3C12,0.3217 | |
| CC1CN1C(=N)NC=O,0.2271 | |
| CC1OC2C3CC1C23C,0.3122 | |
| COC(C)=NC(C)C#N,0.2738 | |
| CCC12CC1(O)CC2=O,0.2278 | |
| c1c([nH]c(n1)O)C=O,0.1815 | |
| C#Cc1cnoc1,0.2179 | |
| CC1C2OCC(=N)OC12,0.2673 | |
| COCC12OC3C1NC23,0.2967 | |
| CC#Cc1cnccn1,0.1869 | |
| CC(=O)C1(O)COC1=N,0.2157 | |
| O=CC1CN1CC#N,0.2135 | |
| [NH3+]C1CC(=O)[N-]C1C#N,0.199 | |
| CC12CCC3OC1(C)C23,0.3049 | |
| CC(CC#N)NCC=O,0.2165 | |
| CC#CC1(C)CC=CC1,0.2658 | |
| CC1C2(O)C3CN3C12C,0.2833 | |
| CC1CN(C)CC(=O)O1,0.2468 | |
| CC1(OC11COC1)C#N,0.2645 | |
| CC1C=CC2(OC12)C#N,0.2378 | |
| CC1C2NC3C2OC13C,0.3 | |
| CC1CC(C)C(O1)C=O,0.2193 | |
| Cn1cc(cc1N)CO,0.2317 | |
| COCC1OCC1=O,0.2254 | |
| N=C1OCC2=C1N=CO2,0.2234 | |
| ON=C1CC2COC1C2,0.2465 | |
| CC1=CCC(=O)CC=C1,0.2055 | |
| c1c(cn[nH]1)C#CC#N,0.1961 | |
| C1CC(=O)CC(=O)C=C1,0.179 | |
| CCCC1(CN1C)C=O,0.215 | |
| CC1(CC(=O)CO1)C#N,0.2205 | |
| ON=C1C(O)C2CC12O,0.2385 | |
| COC1CCCC1=O,0.2003 | |
| C#CC1=CCCCC1,0.2127 | |
| OCCCC12CCC1N2,0.3273 | |
| CCC1=CCC2NC12,0.2464 | |
| CCC#CC1(CC1)O,0.2715 | |
| CN1CC11CC2CC1O2,0.3128 | |
| C1CC1CC2(CC2)C=O,0.2266 | |
| OC1C2CC1C(O)C=C2,0.2439 | |
| OC1C2COC2C11CC1,0.3014 | |
| O=CC1C2C1C1CC2O1,0.2266 | |
| OCC1C2CNC(=O)N12,0.277 | |
| CC#CC1(C)CCC1=O,0.2057 | |
| CC(C)N=C1C=CCO1,0.2065 | |
| CC1=C2COC2CC1,0.2387 | |
| OC(C#C)C(=N)N1CC1,0.2561 | |
| C1CC2OCCC3C1C23,0.31 | |
| CC1C=CCCC(C)=C1,0.2505 | |
| CN1CC11CC2OC12C,0.3161 | |
| CCc1c(ocn1)C=O,0.1937 | |
| CCOC1COC1C,0.3219 | |
| OC12C3COC1C(=O)C23,0.2151 | |
| OC1C2CC11CCC1O2,0.2927 | |
| CC1(CO1)C1=NCCO1,0.2545 | |
| CC(C)C(O)C1(C)CN1,0.288 | |
| CN=C1CC2OCC2O1,0.2731 | |
| C1C(=NO)C2(N1)COC2,0.2285 | |
| CCOCC1CN1C,0.3053 | |
| O=C1NC2CC1C2,0.2598 | |
| CCC(CC)C1(CC1)O,0.2997 | |
| COCCC(O)C(N)=O,0.2699 | |
| CC1C(O)C(C)C11CN1,0.2971 | |
| CC12C3C1C1CC3C2O1,0.34 | |
| COC=NC1CC=CC1,0.256 | |
| CCCC#CC(O)CC,0.286 | |
| OCC1CCC(=O)CO1,0.2126 | |
| CNC1=NC=CC(=N)O1,0.1811 | |
| CC12CN(CC1)C2C#N,0.2547 | |
| c1nc(on1)NC2CC2,0.241 | |
| OCCC1(CCN1)C#N,0.2621 | |
| C#CC1COCC=CC1,0.2531 | |
| CCC(COC)C=O,0.2281 | |
| NC1(CO)CC1(O)C#N,0.2707 | |
| OC12CN3C(C13)C2=O,0.228 | |
| CCC1(CN1)C#CC,0.2821 | |
| C#CCC1(CC1)NC=O,0.2726 | |
| C#CC1C2NC2C2NC12,0.2826 | |
| CC1CC1(C)CC#C,0.3101 | |
| CC1C2OC1C1C(O)C21,0.3065 | |
| Cc1c(=O)[nH]cc(n1)N,0.1439 | |
| Cc1c(nc(cn1)O)O,0.189 | |
| NC(=O)C1C2NC1C2=O,0.2338 | |
| C(=O)c1c(oc(=O)[nH]1)N,0.1678 | |
| COC1CC=CC1C#N,0.2649 | |
| CC12CC3CC1COC23,0.3177 | |
| CC1OC(C)C1C#C,0.2891 | |
| CC1CN2CC(=NO)C12,0.219 | |
| CC(=O)OC1CC2NC12,0.2542 | |
| c1cnc(cc1F)C#N,0.2175 | |
| CC12NC1(C#C)C1OC21,0.2738 | |
| CC1CC2C(O1)C2C#C,0.2707 | |
| CCC(CC=O)OC=N,0.2223 | |
| OCCOC1COC1=N,0.2717 | |
| N#CCC1NCC2OC12,0.2722 | |
| COCC12CC1(O)CC2,0.2865 | |
| CC(N=CNC=O)C#C,0.2328 | |
| CCC1(CO)CNC1=O,0.2783 | |
| CC(=O)C1NC11COC1,0.2214 | |
| CNC1(CC1C#N)C#C,0.235 | |
| COC1OCCN=C1N,0.2476 | |
| CC([NH3+])(C1CC1)C([O-])=O,0.2704 | |
| COC12CC1CC(=O)C2,0.2222 | |
| CN1C2C1C1(C)CCC21,0.2964 | |
| O=CC12COC1C1OC21,0.2172 | |
| CC(=O)C1=CC2CN2C1,0.1737 | |
| c1c(n[nH]c1N(=O)=O)N,0.1399 | |
| CC1C(C)C1CC(N)=O,0.2728 | |
| CC(C)C12OC1C1NC21,0.2779 | |
| C(CC#CCCO)CO,0.3024 | |
| CC1N2CCC12C=O,0.2095 | |
| CC12CC3C(C1)C23,0.3349 | |
| Cc1ccoc1C(=O)C,0.1896 | |
| CC1CCC1CC#C,0.3145 | |
| CCC12C3C4C3C1(O)C24,0.2885 | |
| C1CC(C1)(CCO)O,0.3221 | |
| CC12CC3C4C1C4(O)C23,0.3056 | |
| CC12C3C1C1(O)C3C21C,0.2789 | |
| CCCC1OC(=O)C1C,0.2812 | |
| CC1C[NH+](CC([O-])=O)C1,0.264 | |
| CC(=O)Nc1c[nH]cn1,0.2199 | |
| OC1CN(CC=O)C1=N,0.1963 | |
| CC1(C)OCC2CC1C2,0.3205 | |
| CC1NC(=O)C(=O)C1C,0.1714 | |
| C1C=CC2CC1CC=C2,0.2379 | |
| CC1C2CN3C2C1C3=O,0.2251 | |
| CC1(C#N)C2COCC12,0.3006 | |
| CCC(C)OC(=N)OC,0.314 | |
| OCCOC1CCOC1,0.3221 | |
| C#CCNc1ccon1,0.2275 | |
| CN=C1OC(C)=CN=C1,0.1511 | |
| CC(=O)C1NC1C#N,0.2198 | |
| NC1=CN=C2C(O)CN12,0.2237 | |
| [O-]C(=O)C1C[NH2+]CC=C1,0.1587 | |
| CCC(C)C(=O)C=O,0.1541 | |
| O=CC1=C2CN3C(C1)C23,0.1436 | |
| CC12C=CC3C(C=C1)C23,0.233 | |
| OC1CC1(C#C)C1CO1,0.2848 | |
| CC12C3NC3C3C1CN23,0.2977 | |
| O=CC1CCC(=C1)C#C,0.1948 | |
| CC(C)(C=O)C1CC1O,0.2245 | |
| CC1=C2CC3C(C1)C23O,0.1694 | |
| CC1C2C3C=CC2C13,0.226 | |
| CCC(C)(C)C1CO1,0.3388 | |
| CC1C(C)(N)C1(O)C#N,0.271 | |
| c1c2n(cn1)CC=C2,0.182 | |
| CC12C3C4OC1C4N23,0.3035 | |
| OC12CC3CC1(C#C)C23,0.2642 | |
| CC#CCNC=O,0.2722 | |
| C1c2c(nn[nH]2)NC1=O,0.2056 | |
| CCNCc1ncon1,0.2031 | |
| COC1CC2C3CC3C12,0.3044 | |
| CC1OCC2CC1O2,0.3208 | |
| CCC(C)CO,0.3408 | |
| OC12C3OC1C3C21NC1,0.3041 | |
| CC1CC2C3CC2C1C3,0.3652 | |
| OC1COCC2CC12,0.3107 | |
| CCc1ccc([nH]1)CC,0.2323 | |
| COC1CCCC1C=O,0.2256 | |
| OC12CC3CC1C2O3,0.2942 | |
| NC1=NC2C(O)C2CO1,0.2646 | |
| CC1C(N1C)C(C)(C)O,0.3129 | |
| CC#CCOC(=N)C#N,0.2103 | |
| Cc1c([nH]cnc1=O)N,0.203 | |
| OCC1CNC(=O)C1,0.275 | |
| C#CC12CCC1CC2,0.2843 | |
| CCC1(CN1C=O)CC,0.2546 | |
| CN1CC2CC2NC1=O,0.2867 | |
| OCC1=CNCC1=NO,0.1777 | |
| CC1C2(O)CC1(C2)C#C,0.2945 | |
| CC(CO)CCC#C,0.3157 | |
| CC12CC1(CC#N)OC2,0.2722 | |
| CCN=C(C#C)NC=O,0.1965 | |
| CCC(CC#C)N1CC1,0.2844 | |
| CCCn1ccc(c1)O,0.2306 | |
| C1C2C3CC1OCOC23,0.3195 | |
| C1CN1C1CC=CC1,0.2606 | |
| CC1CC1NC(=O)CO,0.2695 | |
| CC1C2CC1(C2)N1CC1,0.3167 | |
| CC12OCC1CC2O,0.3074 | |
| COCC(CCO)C=O,0.2282 | |
| CC1(O)C2CC1C2CO,0.3216 | |
| CCC#CCC(=O)N,0.2682 | |
| CCC1C(CC#N)N1C,0.2634 | |
| CC1CC2CC1(N2)C#N,0.2645 | |
| OC(C=O)C1OCC=C1,0.2046 | |
| COC1C2CC1C1OC21,0.3316 | |
| CCCC12CC1CCC2,0.3379 | |
| Cc1cn[nH]c1C(=O)C,0.1955 | |
| CC1COC(C)OC1,0.338 | |
| CC1OC(=O)C1(C)C,0.2803 | |
| C1C=C2CN=CN2C1=O,0.1929 | |
| CC1CC=C2C=CCC12,0.193 | |
| CC1=CC(C#N)C(O)C1,0.2597 | |
| COC1CC2CC(C1)O2,0.3169 | |
| C#CC12CC3C(O1)C23,0.2524 | |
| NC(=O)C12COC1C2O,0.2571 | |
| OC1CN2CC3C2C13O,0.2813 | |
| N#CC1OCC11CCO1,0.2637 | |
| CC12CC1C(C)(C)OC2,0.3281 | |
| C#CC1COCC11CC1,0.2942 | |
| OC(C#C)C(C#C)C#N,0.2811 | |
| OCC(CC#C)C1CC1,0.2923 | |
| CC1C2C(CC12C)C#N,0.2988 | |
| NC(N)=[NH+]CCC([O-])=O,0.2577 | |
| O=C1CCN2CCN=C12,0.1624 | |
| OCC12OCC1C2O,0.2929 | |
| COCCC1CC1(C)O,0.3242 | |
| C#CC1OCCN2CC12,0.2528 | |
| c1[nH]c2c(n1)OC(=O)C2,0.2069 | |
| Cc1c(oc(n1)NC)C,0.2273 | |
| OC(C#N)C1=COC=C1,0.237 | |
| C1C2C3OC2C13,0.3099 | |
| CC(C#CC#C)C1CO1,0.2295 | |
| CC(CO)CC1CCO1,0.3198 | |
| OC12C3C4C5C3C1C5C24,0.2913 | |
| N=C1N=CN=CN1C=O,0.1645 | |
| c1c(oc(=O)nc1O)N,0.2034 | |
| COC12CC3OC1C23O,0.2791 | |
| CCC1=C(C)CC2OC12,0.2368 | |
| CC#CC(=NO)C(C)O,0.2019 | |
| CC(=O)CC(CO)C#N,0.2362 | |
| CC1CCOC1CCO,0.3203 | |
| Cc1cc([nH]c1C)N,0.229 | |
| CN1C2C(O)C1C2C#N,0.2585 | |
| c1c(coc(=O)n1)F,0.1705 | |
| CCC12CC(C1)CO2,0.3202 | |
| C1C2C1C1COC3C2C13,0.2994 | |
| C1OC2C1C1COC2C1,0.3131 | |
| OC1C2CC1(O)C(=O)O2,0.2691 | |
| O=CCCC(=O)C1CN1,0.221 | |
| C#Cc1c(nc([nH]1)N)O,0.1918 | |
| C1CC=C(C1)CC=O,0.2078 | |
| O=CNC1C=CNC1=O,0.2095 | |
| C#Cc1nc(on1)CO,0.2222 | |
| CCC1=C(CNC1=O)C,0.223 | |
| O=C1CCC1CCC#C,0.2194 | |
| CCC1NCC1=NO,0.2333 | |
| CC1COCC(CO)O1,0.3213 | |
| CC(O)C(CO)NC=O,0.276 | |
| CCC(CNC=O)C#N,0.2784 | |
| C1CC11C2CC1CCC2,0.3463 | |
| CC(C)C1CCC1O,0.3261 | |
| CC1(CO)CCC11CO1,0.3242 | |
| CC(C)CC#CCCO,0.3015 | |
| CC12CN3C1C2C3=O,0.2436 | |
| N#CC12OC1C1CCC21,0.2683 | |
| Cc1c(nc([nH]1)O)N,0.2275 | |
| OCC1CC(C=O)C=C1,0.2162 | |
| CC1(C)CC(O)C11CN1,0.3021 | |
| NCC1(C#N)C(O)C1O,0.259 | |
| OCC1(C#C)C2CC1C2,0.2949 | |
| CC12OC(=O)C1(O)C2O,0.2539 | |
| CC1C2OCC(C)C12O,0.2886 | |
| N=C1NCC11COCO1,0.2616 | |
| OC1(C=CNC1=N)C#C,0.2021 | |
| OCC1=C2CCC2CC1,0.2412 | |
| CC1C2CC(O)C12,0.3214 | |
| CCC1OC1CC1CC1,0.3501 | |
| O=CC1CCCN1C=O,0.2027 | |
| OCC12CC3C1C3(O)C2,0.3067 | |
| OCCC1CC1(O)C=O,0.2211 | |
| CC1N2CCCC12C=O,0.2122 | |
| CC12C3C4C3C(=O)C1C24,0.208 | |
| CC12COCC1(O2)C#N,0.2724 | |
| O1C=C2C=CN=C2C=N1,0.1599 | |
| CC1C=CC2(C)CC1C2,0.2524 | |
| CC1C2COCC12C#N,0.2935 | |
| CC1(C)CC1OCC#N,0.276 | |
| CC(O)C1OCCC1=O,0.2115 | |
| OC1(C#C)C2C3C1CN23,0.2641 | |
| O=C1OCC2CCC1O2,0.2555 | |
| N=C1OC2C3CC1OC23,0.259 | |
| CNc1c(=O)occn1,0.1629 | |
| CN1CC1CC(N)C#N,0.256 | |
| CC1C(C#C)C(O)C1=O,0.2082 | |
| OC1CC2C(CC=O)C12,0.2248 | |
| O=CC1CC2CCC1O2,0.2238 | |
| CC(CC1CO1)C#N,0.3174 | |
| Cc1c(non1)N=CN,0.2016 | |
| OC1COC2=NOC=C12,0.2375 | |
| CC1OC1C(C)(C)C#N,0.308 | |
| OC1CN(C=O)C=C1,0.2106 | |
| CC1C2C(O)C2NC1=O,0.2645 | |
| CC1N2CC2(C)C11CN1,0.3025 | |
| Cc1c[nH]c(c1O)OC,0.2318 | |
| OCC12CCC1OC2,0.2976 | |
| CC1N2CC(C)C12C#C,0.2448 | |
| N#CC12CC1CC2,0.2885 | |
| OC1C2CC1C1CCC21,0.3169 | |
| C1NC11CC2C3CC1N23,0.3061 | |
| CC(C)(CNC=O)OC,0.2831 | |
| COC1(CCC1)CC#N,0.2943 | |
| CC1(O)C2CC2C11CN1,0.3003 | |
| CCN1CC1(C=O)C#C,0.1961 | |
| O=CNC1C=CCC1=O,0.2156 | |
| CC#CCCOC,0.305 | |
| CC12CC3C1C(C2)C3=O,0.2201 | |
| CC1CCN(C=O)C=C1,0.2127 | |
| OC12CC1C1(CO1)CC2,0.3287 | |
| OCC1=CC2(CN2)CC1,0.2358 | |
| c1nc(c2n1CC2)C#N,0.2309 | |
| c1(c(non1)N(=O)=O)N,0.1566 | |
| c1(nc(=O)onn1)N,0.1688 | |
| Cc1c[nH]c(c1C)NC,0.238 | |
| OC1C2OC1C2CC=O,0.2255 | |
| OC1=NC=NC(=N)C=C1,0.1697 | |
| N#CC1OC=NC2CC12,0.2528 | |
| NC1=C(F)C(=N)N=CN1,0.1874 | |
| N=COCC1(CC1)C#N,0.2796 | |
| OC12CC1CC2NC=O,0.2528 | |
| O=CC1C2CCC1CC2,0.2263 | |
| CC(COC1CC1)C#N,0.2987 | |
| COC1(CO)C(O)C1O,0.2737 | |
| C1CC1C12OC3C1CC23,0.3084 | |
| OC1=COC(=N1)C1CO1,0.2064 | |
| CN1CC(C(N)=O)C1=O,0.259 | |
| CCOCC1CCC=C1,0.264 | |
| COc1cc([nH]c1O)O,0.2297 | |
| COCCC1C2CCC12,0.3356 | |
| CC1C2CC2OC1(C)C,0.3013 | |
| O=CCC1=CC2OC2C1,0.2066 | |
| CCC(C)CCCCO,0.3422 | |
| c1c(cc(cc1O)O)N,0.2259 | |
| COC1C2C1C(C)C2C,0.3231 | |
| N=CN1CCNC1=O,0.2432 | |
| NC(=[NH2+])C1=COC=C1[O-],0.1827 | |
| CC12CC(O1)C2CC#N,0.2896 | |
| CN=COC1CCC=C1,0.2466 | |
| NC1(COC1=N)C#N,0.2567 | |
| C1OC23CC(C=C2)C13,0.2324 | |
| CCC12OC1C=CC2O,0.2368 | |
| Cc1cc(oc1)NC=N,0.1973 | |
| CC1(CCC=O)CCO1,0.229 | |
| CC1(O)C(O)C1CC#C,0.2911 | |
| CCC1(C)CC(C1)C=O,0.224 | |
| O=C1CNC2CCC2N1,0.259 | |
| CCC1C2OC1C21CO1,0.3181 | |
| C#CC1(COC1=O)C#C,0.2566 | |
| OC1C2CN(C=O)C12,0.2556 | |
| O=CC1C=CC2OC12,0.21 | |
| CCC12OCC1CC2C,0.3053 | |
| COC(C)C(O)C(C)=O,0.2372 | |
| C1C2C3CC4(CO4)C3N12,0.2793 | |
| Cn1cc(cc1CO)N,0.2163 | |
| OC1(C#C)C2CCOC12,0.2631 | |
| CCC1OCC(C)C1O,0.3032 | |
| C1OC11COCC2CC12,0.3169 | |
| CC1=CC2CC1(CO)O2,0.2356 | |
| Cc1c2c(c[nH]1)COC2,0.2344 | |
| C#CCCC1CCOC1,0.2954 | |
| OC(C=O)C1(CO1)C#N,0.2296 | |
| CCC1NC1C1CCO1,0.3105 | |
| C#CCOC1CC2CC12,0.2841 | |
| O=C1C2CC1OC(=O)N2,0.1952 | |
| CC1=C(OC=N)ON=N1,0.2033 | |
| CN=C1OC2C=CCC12,0.2417 | |
| CC1CN2CCC12C#N,0.24 | |
| C#CC(=O)c1ccoc1,0.1803 | |
| c1c([nH]nn1)CCO,0.2531 | |
| CC1=C(C)C=CC(=N)O1,0.1643 | |
| C[NH2+]CC(=O)C([O-])=O,0.1768 | |
| O=COC1C2CN2C1=O,0.2275 | |
| Cc1cn(cnc1=O)C,0.2077 | |
| O=CNCC1COC=N1,0.257 | |
| c1c2c([nH]c1O)nno2,0.1849 | |
| NC1(CC#N)C(O)C1O,0.2737 | |
| CCC(C)C1CC(=O)N1,0.2818 | |
| CCN1CCC1(C)C#N,0.2605 | |
| C1C2OCC3(CCC3)C12,0.3122 | |
| C1COC(=O)N1,0.3152 | |
| CCNc1nc(on1)C,0.2221 | |
| CCN1CC1C(N)C#N,0.2533 | |
| C1CC23OC4CC12CC34,0.2993 | |
| OC(C#N)(C#N)C1CN1,0.2339 | |
| CCCCC1(CC1)C=O,0.2329 | |
| COC1C(C)OC1C#C,0.272 | |
| CC12CN3C1CC(O)C23,0.2911 | |
| NC(=O)C1(CC#C)CN1,0.2638 | |
| NC1C2N=CNC=NC12,0.2007 | |
| CC12OC1C(C=O)C=C2,0.2093 | |
| c1c2c(ncn1)NCC2,0.203 | |
| CC12CC(N1)C(=C2)C#N,0.1951 | |
| CC(C)OCC1(CC1)O,0.3168 | |
| OCC1C2C3CN3C12,0.2842 | |
| OC12CC3C1OCC23O,0.2933 | |
| OC1C2OC2CC1C#C,0.2901 | |
| N=C1OCC11CC1,0.2819 | |
| COc1c(n[nH]c1O)N,0.2525 | |
| CC1N(C)C1(C)CC#N,0.2666 | |
| O=CC1NC2=NCCC12,0.1898 | |
| CC1OC(=N)NC1C=O,0.1909 | |
| CC1CN2N=C(O)N=C12,0.2427 | |
| C1CC2C3OC3C2O1,0.3084 | |
| O=C1C2C=CC3C2N13,0.2094 | |
| CC(C)C1COC(C)C1,0.3181 | |
| Cc1cnc(o1)C(C)C,0.2367 | |
| CC1C(=O)CCC=C1C,0.2239 | |
| CC1CC(=O)C1(C)C=O,0.1967 | |
| OC1C(=O)COC1=O,0.2122 | |
| Cc1cnc(c(=O)[nH]1)C,0.1715 | |
| N=C(C#N)N1C2CCC12,0.2026 | |
| c1c(noc1C=O)C=O,0.1764 | |
| CCC1CC(N1)C#N,0.2653 | |
| OC12CC3C4C1CC2N34,0.2918 | |
| CC1(O)C=CC(O)C1=O,0.207 | |
| CC1(CCC1)C(=O)CO,0.2355 | |
| CCCn1cncc1C,0.2454 | |
| CC(O)(CO)CC#N,0.3076 | |
| CCn1c(ncn1)CO,0.2556 | |
| N=C1OC2CC2C1C#N,0.2716 | |
| CNC1(C#N)C(N)C1N,0.2482 | |
| CCNc1ccn(c1)C,0.2167 | |
| C#CC1OCCC1C#N,0.2972 | |
| CC#CC1C2NC2C1=O,0.2037 | |
| Cc1nc(nc(n1)O)N,0.2319 | |
| COCC(O)C(C)(C)C,0.3226 | |
| N#CC1CC2(CO2)C1,0.3058 | |
| CC(C#CCO)C1CC1,0.2826 | |
| CC1CCOC1(C)CO,0.3179 | |
| CCC(O)C1NC1C#C,0.277 | |
| CCC1N(C)C1(C)C=O,0.2101 | |
| CN=C1OC=CC(N)=N1,0.1734 | |
| CC1C2C(O)C1C2C#N,0.2983 | |
| CC12CN3C4C(C14)C23,0.2948 | |
| c1c(n[nH]c(=O)n1)N,0.1475 | |
| CC1C2COC(O2)C1=O,0.211 | |
| CCC12COC1C=CC2,0.2516 | |
| CCC1CC(O)C1C#C,0.2919 | |
| COCC#CCOC=N,0.2744 | |
| C1CC2COCC(C2)O1,0.2999 | |
| CC(=O)N(CCO)C=O,0.2342 | |
| CC(=O)C(CCO)C#N,0.2304 | |
| CC1=CC(O)=NC(=N)O1,0.1809 | |
| O=CCCC12CC(C1)O2,0.2213 | |
| CN=C1OCC11CO1,0.2612 | |
| CCC1COC(C1)C#N,0.297 | |
| CC(C)OC1CNC1=O,0.257 | |
| CC1CC=CC=C(C)C1,0.1895 | |
| Cc1cccc(=O)cc1,0.1562 | |
| c1c2c(c([nH]1)O)[nH]cn2,0.1914 | |
| Cc1c([nH]c(n1)NC)O,0.2243 | |
| CCC(CC)(CO)C=O,0.2225 | |
| CCC1(CC1O)C1CC1,0.3275 | |
| N=C1NC(CC#N)=CO1,0.2096 | |
| N#CC1C2CCC3C2N13,0.2569 | |
| N=C1C=NNN=CC1=N,0.1681 | |
| CCn1c(ncc1O)C,0.2372 | |
| CC1(C=CC(=NC)O1)C,0.2012 | |
| CCC12CC(O)(C1)C2=O,0.2453 | |
| O=C1CC2CC3C(N1)C23,0.2655 | |
| NC(=O)C1C2CC1C2,0.2653 | |
| COC1(C)CNC(=O)C1,0.2754 | |
| CCc1nc(c(o1)C)C,0.2325 | |
| CC12C=CC3CC1C23,0.2373 | |
| CCC1OC1CCC#N,0.3113 | |
| OC1CC2CCC(C2)C1,0.3286 | |
| CC1(CO)CC1(O)C#N,0.2913 | |
| NC1(C#C)C2OC=NC12,0.2421 | |
| CC(C)C(C)C(=O)C=O,0.1535 | |
| COCC1C2CC(=O)N12,0.2354 | |
| CN(C=O)C(=N)CC#N,0.2318 | |
| N#CC1CC2CC(C2)O1,0.2883 | |
| CCCC1CC(N1)C#N,0.2653 | |
| OCC12CN3C(CC1)C23,0.2878 | |
| O=CC1(NC1C#N)C#C,0.2172 | |
| C#Cc1c(c([nH]n1)O)N,0.2143 | |
| CCC12CC1C(C)C2C,0.3199 | |
| CCOCC1(C)CC1O,0.2963 | |
| COC1COC2CC2C1,0.3023 | |
| CC12COC(C1)CC=C2,0.2566 | |
| C#CC1OC1(C#C)C#N,0.2408 | |
| CC(=O)COC(=N)C#C,0.2191 | |
| CC1C2(C)CC2C11CO1,0.3245 | |
| OC1COC(=NC1)C#N,0.2279 | |
| CC1CC23OCC2OC13,0.2818 | |
| CC1(C#C)C2OC(=N)C12,0.2481 | |
| OC1(CCC2CC12)C=O,0.2249 | |
| O=CCC12NC1C1NC21,0.1805 | |
| OC1C2OC(C#N)C12,0.2461 | |
| CC1COC(=O)C(=N)N1,0.196 | |
| c1c(cncn1)CC#N,0.2079 | |
| CC(C#N)C1=CCCC1,0.2527 | |
| CCC(NC=O)C(C)=O,0.222 | |
| CN=C1NN=CC(O)=C1,0.154 | |
| OCC[NH2+]CC([O-])=O,0.269 | |
| C#CC(=N)NC(=O)CO,0.2029 | |
| CC12OCOC1(C)C2O,0.2955 | |
| CC1CC(=O)C(=O)C1O,0.1439 | |
| COC1OC=NC1C#C,0.2703 | |
| OC1C2CC1(O)C21CO1,0.3135 | |
| CC1(C)C2CC(O)CN12,0.2819 | |
| CC(=O)C#CCC1CO1,0.2078 | |
| CC(=O)N1CC1C1CN1,0.2513 | |
| COC1CC1(CO)C#C,0.2759 | |
| OC1CC1C1=COC=C1,0.2357 | |
| OCC1OC1C(O)C#C,0.2822 | |
| NC(=O)OC12CC1CC2,0.3074 | |
| CC(C#C)C1CC1,0.3126 | |
| OC1CC2CC12C1CO1,0.3187 | |
| C#CC#CC1CCCO1,0.225 | |
| CC1CC(=N)OC1C#N,0.2823 | |
| CC(OC1CC1)C(N)=O,0.2657 | |
| O=CC12CC(COC1)N2,0.2017 | |
| C1CC1(CO)NCC#N,0.274 | |
| CC(=O)OC=NCCO,0.2297 | |
| O=C1NC2CC3COC123,0.251 | |
| CC1(CC#N)CC2OC12,0.2971 | |
| CC1CC(CO)CC1=O,0.2221 | |
| OC1C2CC2CNC1=O,0.2486 | |
| Cc1cnc(cn1)NC,0.1741 | |
| NC(=O)C(C=O)C1CO1,0.2096 | |
| CN1C=NC(=N)C(F)=C1,0.1901 | |
| CC#CC1C2CC1C2=O,0.2452 | |
| COC12CC1(C)C(O)C2,0.321 | |
| O=C1CCCCC2CC12,0.2255 | |
| NC(=O)CC1NCC1=O,0.2008 | |
| c1c(c(=O)c(co1)O)O,0.1843 | |
| CC(C=O)(C#N)C1CC1,0.2225 | |
| OC12C3CC1C=CC2O3,0.2348 | |
| NC1=COC2=C1N=NO2,0.1251 | |
| CC(O)C1CCOC1C,0.3034 | |
| CCC1=CCC(O)C1=O,0.1944 | |
| OCC12CC1C1(O)CC21,0.2761 | |
| CC1CC=CC11CO1,0.2509 | |
| CC1CC2=CC=C(C)N12,0.2388 | |
| COc1c(cn[nH]1)C#N,0.2384 | |
| O=CNC1CC2OC2C1,0.2828 | |
| NC(=O)C1=CC2CC2C1,0.2094 | |
| O=C1NCC1CC1CC1,0.2809 | |
| CCC1C2C3CC2N13,0.3142 | |
| CCC(C)C#CCC#C,0.2886 | |
| CC(C=O)(C=O)N1CC1,0.1806 | |
| CCCOC(=O)C(=O)N,0.206 | |
| CC12CN(C1)C1CC1O2,0.2934 | |
| CCC(O)CN1CC1C,0.3018 | |
| C#Cc1ncnc(n1)F,0.2056 | |
| CC#CC(CC#C)C#N,0.2798 | |
| N#CCC12CC1CC2,0.3021 | |
| OC1C2C=C3COC3C12,0.2196 | |
| CC1(C)CC1(O)C#N,0.2921 | |
| CCCC(=O)C1(C)CN1,0.2304 | |
| OC1CC(O)C(C1)C#N,0.3058 | |
| O=CC1CC2CC(C2)C1,0.2278 | |
| Cn1c(cnn1)CO,0.2512 | |
| C1COCCC(=C1)CO,0.2498 | |
| CNC(=O)COC=O,0.2641 | |
| N=COC1C2NC2C1=O,0.2018 | |
| CC1OC11C2CC2C1O,0.3034 | |
| OC1CC=CCC2OC12,0.2663 | |
| OC(C#C)C1=NON=C1,0.2375 | |
| CCN=c1ccnc[nH]1,0.174 | |
| N=C1OC2CC2C11CO1,0.2534 | |
| CC1C2C3C2N1C3C#N,0.2711 | |
| OCC1NC=NC1C#C,0.248 | |
| CNC1C(N)C1(C)C#N,0.2721 | |
| OC1CC1CC#CC#C,0.2305 | |
| CC12CC(=NO)C1CO2,0.2424 | |
| Cc1c(cc([nH]1)N)OC,0.219 | |
| CC1(COCCO)CN1,0.317 | |
| CC1C(CO)C1(C)C#N,0.3068 | |
| CC(C)C1C2COCC12,0.3216 | |
| CC1NC11C2C3OC2C13,0.3051 | |
| OC1C2C=CCCC12O,0.2405 | |
| C(#N)C(C#N)N,0.2758 | |
| CN(C=O)C(=O)C1CN1,0.2249 | |
| CCC1(C)OC(C)C1=O,0.2186 | |
| CCC1C(C)OC1=N,0.2888 | |
| CC1=CC2CC1OCC2,0.2496 | |
| Cc1cnccn1,0.1969 | |
| CCN1CC1C(=O)C#C,0.168 | |
| OCCN=C1NCC1O,0.2517 | |
| c1c2n(c(=O)o1)CC=C2,0.1698 | |
| CCOCC1OC1C,0.3391 | |
| N#CC1OCC=C1,0.2543 | |
| CCC1C2C(O)C1C2O,0.3171 | |
| CC12C=CC3(C)CC1N23,0.2181 | |
| CN1C2CC3C2C13C=O,0.1948 | |
| CCC(CC)(CC)C#N,0.35 | |
| C1CC1NC(C#N)C#N,0.2397 | |
| N=COCCOCC=O,0.2265 | |
| C#CC1OC1C1CCO1,0.269 | |
| c1cc2n(c1)CCC2=O,0.1917 | |
| CC1N2CC1(C2)C#C,0.2752 | |
| CC#CC(C)(C)C(C)C,0.3061 | |
| CC1C2C3CC3(C)N12,0.3102 | |
| CCc1ncc(=O)[nH]n1,0.1668 | |
| CC1OCCC1C#N,0.2956 | |
| CC1C(OC=O)C1(C)O,0.2595 | |
| CC(C1CC1)C(N)=O,0.2751 | |
| Cc1cn(c(c1N)O)C,0.2348 | |
| CCc1cc(cnc1)O,0.2094 | |
| CC1C(C)C2(O)CC12O,0.2927 | |
| C(CO)N(C=O)C(=N)N,0.2367 | |
| CC#Cc1noc(=O)o1,0.2101 | |
| C1CC2OCCOCC12,0.3172 | |
| O=CC#CC1NCC1=O,0.1957 | |
| C(C#CC#CC#N)C#N,0.1937 | |
| COC12C3CC1(O)CC23,0.2941 | |
| NC(C#N)C12CC1CC2,0.2739 | |
| N#CCC#CC1CCO1,0.2636 | |
| Cn1cc(nc1O)O,0.2372 | |
| C1CC2(C1=O)COC2,0.2095 | |
| OC12C3C4C3C1C24,0.2916 | |
| Cn1c(c(nn1)O)OC,0.2169 | |
| CC1CC=CCC1O,0.2666 | |
| C1CC12CC(C2)(C#N)O,0.2949 | |
| C1C(CO1)(CO)C=O,0.2154 | |
| c1c(nnn1C(=O)N)O,0.1973 | |
| CC1=NOC(=N)C(O)=C1,0.1773 | |
| Cc1nnc2n1nn[nH]2,0.1937 | |
| OCCC12CN1CCC2,0.3059 | |
| C1CC2CN3C1C3CO2,0.2833 | |
| CC(CC#C)N(C)C=O,0.2728 | |
| C1N2CCC12C1CCO1,0.3128 | |
| CC12C3C4C=C1CC2N34,0.1768 | |
| CC1C(C)C1(C)NC=O,0.2729 | |
| c1c(oc(n1)O)N2CC2,0.2343 | |
| COCC1=CC2CC2C1,0.2443 | |
| OC(C#N)C1COC1=N,0.2797 | |
| CC1C2OC2(C=O)C1O,0.2132 | |
| CC12CCC1C1CC21,0.3197 | |
| N#CC12CC3NC1C3O2,0.2504 | |
| CCC12CC(=O)N1C2C,0.2344 | |
| O=C1CC2C(C3CC3)C12,0.2296 | |
| CC1CCC(OC=O)O1,0.2779 | |
| c1c(c(c[nH]1)C#N)C#N,0.2235 | |
| CC1(COC1)C2CC2,0.3232 | |
| C1CC1COC(=O)C#N,0.2395 | |
| CCOC(CC)C(C)=O,0.2185 | |
| CC1(CCC1)CC=O,0.2245 | |
| OC12CN3C1CC23C=O,0.2088 | |
| NC(=O)C12C3C4C3N1C24,0.2335 | |
| Cc1cc(ncc1N)F,0.1915 | |
| CC1C2C(C1C)N2C=O,0.2439 | |
| NC1(CC2(O)CC12)C#N,0.295 | |
| C1C2C3C1C21OCOC31,0.318 | |
| OCC12CCC(N1)C2=O,0.2283 | |
| COC1C(=O)CC1(C)O,0.1998 | |
| N#CC1C2CN1CCO2,0.2513 | |
| CCc1c(cno1)N,0.2084 | |
| CC1(C)C=CCC1C=O,0.2189 | |
| c1c(c[nH]c1CC#N)O,0.2203 | |
| CN1C2CC(O)C12C,0.2941 | |
| CC#CC#CCC(=O)C,0.212 | |
| Cc1nnc2n1cno2,0.2077 | |
| c1c(c(coc1=O)F)F,0.1785 | |
| CN1C2C3C(C=O)C2C13,0.199 | |
| COCC(=N)OCC=O,0.2211 | |
| C1OC11CCOCC=C1,0.2487 | |
| Cc1c([nH]c(n1)O)OC,0.2478 | |
| CC(O)C(NC=O)C=O,0.2168 | |
| OCC1(CC1)C(O)C#C,0.2998 | |
| CC(C)(C(=O)NC=O)N,0.2115 | |
| CC1C(=NO)C2NC12C,0.2358 | |
| C1CC1CCO,0.3424 | |
| CCOC1(CC1O)C=O,0.2181 | |
| CC12CC1(O)C(=O)OC2,0.2591 | |
| CC12CCC1C2NC=O,0.2686 | |
| CCC1OCC1O,0.306 | |
| C(c1c(nc(o1)N)O)O,0.2198 | |
| O=C1C=CC2(CN2)C1=O,0.1373 | |
| Cc1c(cc[nH]1)OC=O,0.2178 | |
| OC1CCN2C3CC1C23,0.3088 | |
| CCOC(=N)CC(C)O,0.2871 | |
| CC(C)C1OCC=C1C,0.2487 | |
| C1C2CC3CC12CCO3,0.3159 | |
| C1CC1N=COCCO,0.2516 | |
| N#CCN1C2C3CC2C13,0.2639 | |
| C[NH2+]C(CO)C([O-])=O,0.2613 | |
| CC12CCN1C(=O)CC2,0.2561 | |
| c1c2c(n[nH]1)CCC=C2,0.2029 | |
| Cc1c(ocn1)CC#N,0.2393 | |
| CN1C2CC(C2)C1C#N,0.2582 | |
| CC1C=CC=C(C)C=C1,0.1784 | |
| CC1C2OC1C2OC=N,0.2699 | |
| CC1=CCc2n1cnc2,0.2052 | |
| COC12CC1C(O)C=C2,0.238 | |
| Cn1cc2c(n1)onn2,0.1946 | |
| COC(C)CC1CC1,0.3347 | |
| COC(C)CCC#CC,0.302 | |
| C1OC2CC3NC3C12,0.3016 | |
| N#CC1CCCN2CC12,0.2686 | |
| CC1N2CC(C)C12CO,0.304 | |
| CC1OCOC11COC1,0.3201 | |
| CC(C)C12CC(=O)C1O2,0.2165 | |
| C1C2OC2C2=C1NN=C2,0.2455 | |
| CC1(C)CC1C(O)C=O,0.2245 | |
| CCC12C3CN(C13)C2C,0.3006 | |
| CC1CC(CO1)C1CC1,0.3299 | |
| CC1CC(C)CC(C)C1,0.3698 | |
| OC1=C(O)C(=N)OC=N1,0.1623 | |
| CC1C(CC=O)C1(C)O,0.2251 | |
| CC(CC#N)C1COC1,0.2852 | |
| CCCC1(C)CC(=O)N1,0.2831 | |
| C#CCN1CC2OCC12,0.2591 | |
| C1CC2=NCC(=O)N2C1,0.2294 | |
| O=C1NC2C(C3CC3)C12,0.2496 | |
| OCC(O)C1(CN1)C#C,0.2818 | |
| C1C(CO1)(CCO)C#N,0.2867 | |
| CC1=CC(=O)C(C)(O)C1,0.1888 | |
| CC1(CC1)C(C)(C)C=O,0.2245 | |
| CC(C)C(C)C1COC1,0.3108 | |
| CC(O)C12C3C4C3N1C24,0.2801 | |
| CC#CC1(COC1)CO,0.2866 | |
| OCC#CC1CCO1,0.2681 | |
| OC1CNC(=O)C(O)C1,0.2627 | |
| C1CN(C=CC1=O)C=O,0.1842 | |
| CCC12CC(CO)(C1)O2,0.3183 | |
| NC(=O)C1COC1=N,0.2602 | |
| C1C2CCC11OCCC21,0.3198 | |
| OC(C#C)C1=NOC=N1,0.2446 | |
| CN1C(=N)OC=C1C,0.2204 | |
| C(#N)c1c(c(n[nH]1)O)N,0.1803 | |
| CC(O)C#C,0.3001 | |
| C1CC1COC(=O)C=O,0.1809 | |
| CCC1(C)C2CN2C1=O,0.2299 | |
| C#CC#Cc1[nH]ccn1,0.1718 | |
| CCc1c([nH]cn1)C=O,0.1902 | |
| Cn1c(ccn1)C2CC2,0.2502 | |
| CNC(=O)CC1CN1,0.2746 | |
| C1C(CN1C=O)O,0.2654 | |
| C1CN1C1CCC=CC1,0.262 | |
| COCC(=O)NCC=O,0.2183 | |
| CC(C)n1cc(nc1)O,0.228 | |
| c1cocc1C#N,0.224 | |
| N#CC12CC3C(C=C1)N23,0.2168 | |
| c1nnc2n1nc([nH]2)O,0.2498 | |
| OCC(=O)C1COCO1,0.2275 | |
| C#CC1CN2CC2CO1,0.2525 | |
| OCC1CC(=O)C1C#C,0.2155 | |
| CC(CCO)C(O)C#C,0.2938 | |
| NC(=O)CC12CC1CC2,0.2695 | |
| NC1=C(O)C(=N)OC=N1,0.1588 | |
| COC1OC(=O)C=C1,0.2194 | |
| CN1C2C1C1(O)COC21,0.2778 | |
| CC(=O)CC1(CO1)C=O,0.2232 | |
| OC1CC(OC1=N)C#C,0.2827 | |
| OC1COC2C3CC12N3,0.2995 | |
| CCC12C3C4C1C2(C)N34,0.2783 | |
| [NH3+]CC1=N[N-]C=NC1=O,0.1795 | |
| CC1CC1C1=CNC=C1,0.2476 | |
| CC1C(CC#C)C1(C)O,0.298 | |
| CC1=CCOC(=NC1)C,0.2313 | |
| OCC12OCC1C1OC21,0.2929 | |
| COCC1OCC(C)O1,0.3298 | |
| CC12CC1OC2(C)C=O,0.2059 | |
| C1CN2C3COCC23C1,0.3056 | |
| C#CC(CC#N)C1CN1,0.2688 | |
| CC1=CCCCC1(C)O,0.2582 | |
| CCC(C)(CC#C)C#C,0.2947 | |
| CCC1(O)C2C3CC2C13,0.3218 | |
| CCn1cc(nc1)C,0.2486 | |
| CC1(C)C2N=COC12C,0.2506 | |
| CCCN1N=COC1=N,0.2153 | |
| CCC12CC3C=CC1N23,0.2135 | |
| OC1CCN2N=CC=C12,0.2553 | |
| CC1CC(C)C1C(C)=O,0.2216 | |
| c1(=O)c(noc(n1)N)F,0.1986 | |
| C1CC23OC4C2OC34C1,0.2826 | |
| COCC1CC1(C)C#N,0.3007 | |
| C1CN1CCOC=O,0.269 | |
| NC1=NNN=C(N)C1=N,0.1515 | |
| C[NH2+]CC1=C([O-])OC=N1,0.1552 | |
| OC(C#N)C1=CN=CN1,0.2309 | |
| c1coc2n1ncn2,0.2374 | |
| Cc1nc(c(=O)[nH]n1)F,0.1791 | |
| O=CCN1C2CC1C2=O,0.2258 | |
| CC1C2CC(C2)C11CC1,0.3488 | |
| CCCOC(CN)C#N,0.2698 | |
| [NH3+]CCC1=C([O-])ON=C1,0.2316 | |
| O=COCC(C=O)C#C,0.2208 | |
| Cc1c(cno1)N(C)C,0.2208 | |
| O=CC1CC2C1CC2=O,0.2077 | |
| CCc1nc(cn1C)C,0.2403 | |
| CC1C2CCC12OC=O,0.2671 | |
| N#CC12CCC=C1CN2,0.2335 | |
| CCC12CC(O1)C2C#N,0.2777 | |
| CC1(C)C2CCC12C#C,0.2651 | |
| CC(O)(CCO)C1CN1,0.2799 | |
| OC1CCCCCC1O,0.311 | |
| O=CC1C2CN1CC2=O,0.1868 | |
| OC1CN(CC2CN2)C1,0.3011 | |
| CC1OC(C)(C)C11CN1,0.3095 | |
| Cc1c(nn(c1C)C)C,0.2512 | |
| C1C2N=C3OC4C2C1C34,0.1556 | |
| O=C1COC2CC2C=C1,0.1786 | |
| COC1CCNCC1=O,0.2044 | |
| CC#Cc1c(nco1)N,0.1803 | |
| CC1OC2(C)CC12CO,0.2991 | |
| NC1(C#N)C2C3CC3C12,0.2492 | |
| CC(CCC#N)C(C)=O,0.2306 | |
| OC(C#N)C1=CC=CN1,0.2191 | |
| ON=C1CC2(NC12)C#N,0.23 | |
| NC(C(O)C#N)C1CO1,0.2741 | |
| CC1[NH2+]C2C1C2C([O-])=O,0.2648 | |
| C1CC1(CCC=O)O,0.2282 | |
| CC(C)Oc1cn[nH]n1,0.2311 | |
| OC1CNC1CC#N,0.2842 | |
| c1coc(=O)cc1N,0.1849 | |
| CC1C(C#C)C(=O)N1C,0.2692 | |
| O=CCCC#CC1CO1,0.22 | |
| C1C2CCC=CCC1O2,0.2314 | |
| COC1CCC(C1)C#C,0.3098 | |
| OCCC(CC#N)C#C,0.2996 | |
| N=C1CNC(=O)CCO1,0.254 | |
| OC1C2C3C2C2C3C12O,0.2865 | |
| c1cc(ncc1N)N,0.1739 | |
| [O-]C(=O)C1[NH2+]C2CC12,0.2645 | |
| c1nnc2n1nc(o2)N,0.2478 | |
| c1c(ncn1C2CC2)N,0.2162 | |
| CC1(CCO1)C#CC#N,0.2237 | |
| C1C2OC3C=CC2OC13,0.2285 | |
| c1c([nH]nc1C=O)CO,0.2003 | |
| CC1CC1C(N)C#N,0.2919 | |
| C#CCCc1ncon1,0.2382 | |
| CC1CC2=CCCC12,0.2462 | |
| CC1C2CC3(CO3)CN12,0.2942 | |
| CC1(OC1C=O)C1CC1,0.215 | |
| OC1=NNC=C1OC=N,0.2359 | |
| NC1=C(O)NC=NC1=N,0.1882 | |
| Cc1c[nH]c(c1O)C,0.2296 | |
| COCC#CC#CCO,0.2204 | |
| OC1C2CC=CN2C1=O,0.2125 | |
| CC1(CO1)C1COC=N1,0.2699 | |
| CCC1[NH2+]C1CC([O-])=O,0.2761 | |
| C1COCC=C1C=O,0.1962 | |
| NC1C2NC2COC1=N,0.2714 | |
| C1C=C(C(=O)O1)CC#N,0.2305 | |
| CNC(C#N)C(=O)CO,0.2202 | |
| CC(C)(C#C)OCC#N,0.2785 | |
| C1C2OC3CC4C(C12)C34,0.2969 | |
| O=CN1C=CC2CC1C2,0.2051 | |
| CC(C#C)C(=O)C#C,0.1949 | |
| CCCCC(C)CC,0.3799 | |
| C1OC1C1CC2CC1C2,0.3498 | |
| CN(C)C(C=O)C(N)=O,0.1685 | |
| CC12CC(C=C1)C(=O)C2,0.2051 | |
| COC12C3CC1C(=O)C23,0.2404 | |
| CC12CC1C(=O)CC2,0.2261 | |
| CC12C3CC1C(O)C2O3,0.2971 | |
| OC1C2OCC1(O)C2=O,0.1881 | |
| CC1CC2CCC1C2C,0.3554 | |
| C1C2CN=C3NC=NC123,0.2087 | |
| CCCCCC#CC=O,0.2054 | |
| CCC(C)(C=O)C(C)C,0.2225 | |
| CNC1=CC=COC1=N,0.1546 | |
| c1c(=O)nc(oc1F)F,0.2231 | |
| C1CC=CCC2(C1)CC2,0.2577 | |
| Cc1n[nH]c(=O)n1C,0.2394 | |
| CC1NC2(CC12)C#N,0.2443 | |
| OCCC12NC3C1OC23,0.2907 | |
| NC1=C(O)OC(=N)C=N1,0.1274 | |
| CC1CC2CC(C)(C2)C1,0.3489 | |
| CNC(C)(CC#N)C=O,0.2099 | |
| O=C1NCC1OC1CC1,0.2576 | |
| N#CC12OC1C1CC21,0.2451 | |
| CC12CC3NC3C1CO2,0.3028 | |
| CC(C)(C#N)OCC#N,0.291 | |
| CCC12NC1C1OCC21,0.2873 | |
| NC(=O)CC1CC2OC12,0.2789 | |
| Cn1cccc1C#C,0.1994 | |
| OCC1OC2CCC1C2,0.3195 | |
| CNC(=O)OC1CC1,0.3124 | |
| C#CC12NC1C1OCC21,0.2433 | |
| CC1CC=C2CCC2O1,0.2495 | |
| CC(C)N1N=NNC1=N,0.1994 | |
| CC12OC3C4NC4C1C23,0.2796 | |
| CC1=C(C(=O)OCC1)C,0.2208 | |
| N=C1NCC2NC2C1=O,0.1847 | |
| CCOc1conc1N,0.2299 | |
| c1cnn2c1CC=CC2,0.2414 | |
| CC12C3C4N1C2C34C#C,0.2357 | |
| CCNC(=O)NC1CC1,0.2984 | |
| OCC12NC1C(O)C2=O,0.2016 | |
| Cc1cn(cc1NC)C,0.2239 | |
| OC(C1CC1)C(=O)C#C,0.1962 | |
| CC(C)c1cnn(n1)C,0.2488 | |
| C1C=CC2(C1=O)COC2,0.2163 | |
| CC12OC1COC21CC1,0.3151 | |
| OC1CC2COCC=C12,0.2511 | |
| C1C2CCC3CC2C13,0.3473 | |
| OC1COC2(CC2)C1=O,0.2127 | |
| c1coc2c1C(=O)OC2,0.2248 | |
| Cc1c(con1)NC,0.2126 | |
| C1OCC23OC2CC=C13,0.2419 | |
| CC(=O)C1CCOC1,0.2312 | |
| C#CC1CC2(C1)CC2,0.3035 | |
| CCC1=C(CCC1=O)N,0.2045 | |
| CCC(C=O)C(=O)C#C,0.1786 | |
| CC1(CC1)C12CC1CC2,0.325 | |
| CC(C)c1cn(cn1)C,0.2489 | |
| c1c(nc(nn1)F)N,0.1846 | |
| c1c(c(=O)c(no1)F)N,0.1595 | |
| CC(=O)C(C)(C)OC=N,0.2298 | |
| CC1C=CC2CC1(O)C2,0.2526 | |
| N=C1OCC(C=O)=C1,0.1693 | |
| COCc1c(c[nH]n1)N,0.2201 | |
| O=CCC12CC1C(=O)N2,0.2187 | |
| CC12CC1C1OC(=O)C21,0.2583 | |
| CC1(C=O)C2C3CC2C13,0.2193 | |
| CN1C2CC2(C)OC1=O,0.2913 | |
| CC1C2CC1(CO2)C#N,0.2771 | |
| CC12C3C1C1=CC2CC31,0.1919 | |
| CC12CC3C4C(C14)C23,0.3289 | |
| c1c(c([nH]c1O)N)C=O,0.1692 | |
| CC1(CC1C(N)=O)C=O,0.2252 | |
| NC1COCC=C1C#N,0.208 | |
| COc1cc(n[nH]1)O,0.2552 | |
| CC1CC(CO)(O1)C=O,0.2103 | |
| C1C=Cc2c(nno2)N1,0.1439 | |
| C(=N)NC(=O)C(=N)N,0.2073 | |
| CC1OCC=CC1C#N,0.2591 | |
| CC12C3CN1C2(C)C3=O,0.2277 | |
| CC(C)C1N2CC2C1=O,0.2181 | |
| O=CNC1CC(=O)C=C1,0.1882 | |
| CC(C)C1(CCCC1)O,0.3142 | |
| COC1C(NC1=O)C#C,0.2537 | |
| C1CC12COCCO2,0.3268 | |
| CC1(CN1C=O)C1CO1,0.2511 | |
| c1c2c(n[nH]1)C=CCC2,0.2028 | |
| CCOCc1cnoc1,0.2459 | |
| OC1CC2CCCC12,0.3126 | |
| CC#CCCC(C)O,0.3023 | |
| OCC12CC3OC3C1O2,0.3109 | |
| CC1CC2(NCC12)C#N,0.2546 | |
| OC1C2CN(CC=O)C12,0.2006 | |
| CC12COC(=N)C1C2O,0.2666 | |
| C1COC(O1)CCO,0.3336 | |
| CC(O)(CC#C)C1CO1,0.3045 | |
| CC1C(NC1=O)C1CN1,0.2678 | |
| C1C2C3C1C21N=COC31,0.2498 | |
| OCC1CC(C#C)C1=O,0.2112 | |
| OCCCC(O)CCO,0.328 | |
| CC(O)C1C2CC2C1O,0.3008 | |
| c1c(coc1N)NC=N,0.1997 | |
| CC1(CO)OC2COC12,0.3032 | |
| OC1CC2OC1OC2=O,0.2652 | |
| CCC(C)C1=CN=CO1,0.2427 | |
| CC(=NO)CNC(=O)N,0.2509 | |
| O=CCC1C2CCOC12,0.2271 | |
| CCC1CC2(O)C(O)C12,0.3011 | |
| CCN1CC(=O)C(=O)C1,0.1412 | |
| CC1CC(CO)CC=C1,0.2646 | |
| COC1(CC1)C1CC1O,0.2906 | |
| CC1C(C)(C)CC1(C)O,0.3208 | |
| COC(C)C12CC(C1)C2,0.333 | |
| c1(nc([nH]n1)N)C(=N)N,0.2106 | |
| CC(C1OC1C)N1CC1,0.3088 | |
| NC1=C(O)C(=N)OC=C1,0.161 | |
| CCC(O)C1COC1,0.3066 | |
| c1c(c(=O)c(c[nH]1)O)N,0.1713 | |
| CC12CC3C(O)C1(C)N23,0.3051 | |
| CC1(C)CC2C=CCC12,0.259 | |
| C1CN1CCNC(=O)N,0.2858 | |
| CCN=C1OC2CC1C2,0.2758 | |
| CCC1CC(O)(CC)C1,0.3197 | |
| CC1OC1C1C(O)C1O,0.2787 | |
| OC12C3CCN(C13)C2=N,0.2535 | |
| CC(O)C1C(C)C1O,0.3075 | |
| CC1=C2C3CC3N2N=N1,0.2281 | |
| CCC12C3C1C1C3CC21,0.3217 | |
| C1OC2C1N=C1OCC21,0.2605 | |
| N=C1OC(=O)C(=O)C=C1,0.1521 | |
| COCC1N2CCC12C,0.303 | |
| CC12C(CC1=O)C2C=O,0.2143 | |
| CN=COC1CC1C=O,0.2225 | |
| c1c2c(n[nH]1)OCCN2,0.227 | |
| CC1=CCCC2OCC12,0.2562 | |
| CC12CC3OC3CC1O2,0.3302 | |
| OC1C=CC2OC3C2C13,0.226 | |
| c1c2n(nn1)CCC2=O,0.2017 | |
| CC12CC1CC2(O)C=O,0.2224 | |
| CCC1=CC(=O)N(C1)C,0.211 | |
| CC1OC2C3CN3C12C,0.284 | |
| CC(O)C1=C(N)ON=C1,0.2275 | |
| CCC12CNC(=O)C1N2,0.2575 | |
| O=C1COC11C2CC1C2,0.2163 | |
| NC1C(CO)OC1=N,0.2641 | |
| C1CC=C(C1)CC2CC2,0.2578 | |
| C#CC12CC(C1)C=CC2,0.2503 | |
| CCC1CC(C)CCO1,0.331 | |
| C#CCc1ccon1,0.2532 | |
| OC1=NOC(=N)C(=N)N1,0.1944 | |
| Cc1ccnn1C(=O)N,0.2289 | |
| CC12CC1(NCC2)C#N,0.2548 | |
| CC(O)C1CCOC1=O,0.2749 | |
| c1cc(nc(c1O)F)O,0.1917 | |
| COc1c(cccn1)F,0.2093 | |
| C1C2C=C3COCC3N12,0.2255 | |
| COC1COC1=O,0.252 | |
| CC12CC1C1(C)CCC21,0.315 | |
| C1C2CC11OCCC21,0.3284 | |
| Cc1c(cc(cn1)F)O,0.2092 | |
| OC1C2C3CC3(C#C)C12,0.2722 | |
| CC1C2OC2C1CCO,0.3261 | |
| c1cc(=O)nc(nc1)O,0.1606 | |
| CC1OC2(CC12O)C#N,0.2437 | |
| Cc1nc(c(n1C)N)O,0.2232 | |
| N#CC1(CN1)C1CO1,0.2798 | |
| CC12CC3C1C1CN1C23,0.3156 | |
| CCC(C)C1C2COC12,0.3092 | |
| CNc1c(nc(o1)O)N,0.2247 | |
| C1CC1OCCC(=O)N,0.2744 | |
| N#CC12CC3C(CN13)C2,0.2628 | |
| OC12CC34CCC(C13)C24,0.3306 | |
| CCC1(C)OCC1C#N,0.2816 | |
| CCC1(CC1)COCC,0.3296 | |
| OC1C2CN2C=CC1=O,0.1903 | |
| CCC(C)C(NC)C#N,0.2733 | |
| CC1(CC1)C2(CC2)C,0.3265 | |
| CC1CC2CC1C2=NO,0.2617 | |
| CC1=CC(OCC1)C=O,0.209 | |
| Cn1cc(nn1)OC,0.2218 | |
| CC1CC(=O)C(C)(C)O1,0.2186 | |
| O=C1CC2COC12C#N,0.199 | |
| CC12CN1C(=O)C2(C)O,0.2228 | |
| CC1CC11C2CC2C1=O,0.228 | |
| ON=C1C(O)CC11CN1,0.2202 | |
| OC1C=CC2C(C#C)C12,0.2332 | |
| CN=CN(C=NC)C=O,0.2204 | |
| O=C1CC2OC2CCN1,0.2649 | |
| CC1(CC=O)CC2OC12,0.2262 | |
| CCCC1CCC1=NO,0.2493 | |
| CC1(C)C(C#N)N1C=O,0.2527 | |
| CN1CC2C(C#N)C12,0.2479 | |
| CC1COC2(C)CC12,0.3114 | |
| c1c2c([nH]c1N)OCC2,0.2255 | |
| OC1C(O)C11CC(=O)O1,0.26 | |
| CN(C)C(=O)OC(C)=N,0.2571 | |
| C(C#N)NCC(=O)N,0.2595 | |
| CN=c1nnn(nn1)C,0.1578 | |
| CC12OC(C#C)C1C2O,0.245 | |
| CC12CC3C(O1)C23O,0.291 | |
| OCC1CC11COCO1,0.3156 | |
| FC1=CN=CC(=N)O1,0.1647 | |
| COC1CC2C(C)N2C1,0.2904 | |
| CC12C(C#C)N1CC2=O,0.2147 | |
| CCNc1ccoc1N,0.2098 | |
| O=C1CC=CCC2CN12,0.2264 | |
| NC12C3N=C4NC1C4C23,0.1615 | |
| COCCc1cnoc1,0.2459 | |
| CC(O)C1CN1CCO,0.2988 | |
| CC12CC1N1N=CC=C21,0.2344 | |
| C#CCCc1cc[nH]c1,0.2495 | |
| CN=C1NN=NC(=N)N1,0.1706 | |
| NC1(CCCC=C1)C#N,0.2462 | |
| CC(O)C1OC(=O)C1O,0.2614 | |
| COC1(CO)CCC1C,0.3034 | |
| O=CC12OC3C1COC23,0.2111 | |
| CC1OCC=CC=C1,0.1901 | |
| CC1OC2(CC2)C1C#N,0.2629 | |
| OCC1OCC2(CC2)O1,0.3236 | |
| O=C1C2N3CC1C23C#C,0.2238 | |
| c1[nH]c(=O)n(n1)C(=O)N,0.2283 | |
| CNC1=NNN=CC1=N,0.1625 | |
| CC(C#N)C1C(C)C1O,0.3061 | |
| CC1CC(CO1)=NO,0.2501 | |
| CC1=COC(=N)N=C1C,0.168 | |
| c1c2c(c([nH]1)O)[nH]nn2,0.1734 | |
| CCC1NC11CC2OC12,0.3156 | |
| OC1CC2C1OC2=O,0.2808 | |
| C1CC1Nc2nnon2,0.1921 | |
| C1CC11OC2C3OC2C13,0.305 | |
| N=C1OCC1(C#N)C#N,0.2801 | |
| CCCOC(C)C1CC1,0.334 | |
| Cn1c(=O)cc(cn1)N,0.1801 | |
| CC1NC11COC1,0.3031 | |
| CC(C#N)C1CCCC1,0.3477 | |
| CC1C2CC2(O)C1CO,0.3026 | |
| CC1(CC#C)C2CC1O2,0.2931 | |
| CCC(=O)C(C)(O)C#N,0.2159 | |
| CC1OCCCCC1=O,0.2142 | |
| O=CCC1CC1C1CC1,0.2231 | |
| CC1(CC11CCO1)C#C,0.2753 | |
| CC#CC(=O)CC#C,0.2063 | |
| CC1OC2C3CC2(C3)O1,0.3269 | |
| N=C(OC=O)C1CO1,0.2439 | |
| CC1(CC=CC12CC2)C,0.2478 | |
| CC1=CCCCCC1O,0.2504 | |
| CC(=O)CC1(CC1)C,0.2252 | |
| N=C1NC2=C(NN=C2)O1,0.2162 | |
| C1OC11CC2CC2C=C1,0.2386 | |
| O=C1NC=CC1C1CO1,0.2129 | |
| O=C1COCC1C#N,0.2125 | |
| CC1C(=O)NC1(C)C#C,0.2696 | |
| CC1(CC1)c2ccon2,0.2413 | |
| CNc1c(cco1)C#N,0.2043 | |
| CCC(O)(C#N)C(N)=O,0.258 | |
| CC(C)C1CCC1(C)C,0.3495 | |
| CC(O)(C#N)C1(O)CC1,0.2926 | |
| C1CC12CCN2C(=O)N,0.2723 | |
| CC(C)C(O)CC=O,0.2315 | |
| CC1(COCC12CC2)C,0.3189 | |
| OC12COC1C=CCC2,0.2481 | |
| C1C2(COC2)OC(=O)N1,0.3098 | |
| OCC1=CC2CC1O2,0.2338 | |
| O=C1CC2CC2(O1)C#C,0.2593 | |
| CC1C2NC1C2(N)C#N,0.272 | |
| CC12C3C1C1=CCC2C31,0.1607 | |
| COC1=C(C)OC(=N)N1,0.2291 | |
| CC(=O)C12OC1C1NC21,0.1999 | |
| C1C2CCCC12,0.3524 | |
| O=C1CC2NC3CNC123,0.1864 | |
| CC(O)C1(O)CC(=O)C1,0.2203 | |
| CC1CC1(C)C1(O)CC1,0.3167 | |
| OCCC1OCC1C#C,0.2863 | |
| c1c(nncn1)C(=N)N,0.1675 | |
| [O-]C(=O)C12CC1C[NH2+]2,0.257 | |
| NC(=O)C1C2C3CN2C13,0.2503 | |
| COC(C)C(=O)C1CN1,0.2276 | |
| C1C2CC3CC1N23,0.2946 | |
| CC1(O)C2CN2C1=O,0.2216 | |
| CC1(C)C(C#N)C1C#N,0.2942 | |
| C1C2CCC3=CCCC123,0.242 | |
| CC1C2CN2C1=O,0.2338 | |
| C(c1nc(on1)C#N)O,0.206 | |
| C(=O)C(C=O)(C=O)C#N,0.2143 | |
| CN1C2C3(C)CC2(C)C13,0.2978 | |
| CNc1cnc(o1)O,0.2417 | |
| OC1(COCC1=O)C=O,0.1834 | |
| CC1CCN2C(C#C)C12,0.2567 | |
| CCC1(CC1)C1OC1,0.3453 | |
| OCC1=CCC2COC12,0.2555 | |
| OC1C2C3OC1C=CC23,0.2305 | |
| OC1COC(OC1)C#C,0.2917 | |
| CCCC#CCOCC,0.2844 | |
| N#CCC12COC1CN2,0.2601 | |
| O=C1CC2(CC2)C2NC12,0.2128 | |
| CC(C)C1C(C#N)N1C,0.26 | |
| OC1CC1C1C2CC1C2,0.3029 | |
| CCC1COCC11CC1,0.3253 | |
| CCC1NC1C(=O)CO,0.2272 | |
| c1c(c(c(nn1)N)O)O,0.2061 | |
| CNC(=O)NCCC#N,0.2933 | |
| OC12CC1(C#C)C1OC21,0.2612 | |
| CC12OC1CC=C2C=O,0.1876 | |
| OC1CC1(CC#N)C=O,0.226 | |
| CC1C2OC(=O)C12N,0.2459 | |
| C(C#N)C(CO)(CO)O,0.3103 | |
| CCn1c(=O)oc(n1)C,0.2389 | |
| OC1COC1C#CC#N,0.2245 | |
| N#CC1=NCC2CC2O1,0.2258 | |
| CC1OCC(=C1)C#C,0.2051 | |
| C1C(OC=N1)(C=O)C=O,0.1941 | |
| CC1OC(C)(C)C1C=O,0.2181 | |
| CC(C)CC#CC(=O)N,0.2341 | |
| OC1C(O)C2C3CC3C12,0.2961 | |
| CC12CCN=C1NC=N2,0.2281 | |
| CC1C(C)C1CC1CO1,0.3417 | |
| CCC1=CC(=O)CC1,0.1938 | |
| CN1C2C3C4OC2C1C34,0.3127 | |
| CNC(CO)(C#C)C#N,0.2663 | |
| NC12CCC1(C#N)C2O,0.2638 | |
| CC(CO)CC(C)C#N,0.3133 | |
| CCC1(C)C2C3OC1C23,0.3023 | |
| CC(=O)NC1CC1O,0.2692 | |
| CCC(=N)NC(=O)CO,0.2369 | |
| CNc1ccoc1C#C,0.1773 | |
| OC1COCCCC1=O,0.2174 | |
| CC1OCC2C1C2(C)O,0.3177 | |
| CC1[NH2+]C2(CC12)C([O-])=O,0.2577 | |
| N=C1OC23COC2CC13,0.2744 | |
| CC1OC(CO)C11CC1,0.309 | |
| CC1=CON=CC1=N,0.1819 | |
| O=CNC1COCC1=O,0.1966 | |
| C(C=O)Oc1n[nH]nn1,0.2271 | |
| C1C2NC3=NOC=C3C12,0.222 | |
| c1c[nH]c2c1C(=O)OC2,0.2254 | |
| CC#CC1(COC1)C#C,0.2768 | |
| CC12OC3C4CC1N4C23,0.2675 | |
| CCC1N2CC1(O)C2C,0.3098 | |
| CC(C)(C)C(C)(C)C=O,0.2234 | |
| O=CC12CN1CC2C#N,0.2153 | |
| CCNc1cc(on1)C,0.2223 | |
| CN=c1c(cnc[nH]1)O,0.1762 | |
| CC1CC(C=O)=CC1O,0.189 | |
| C1OC11CCC=CC1,0.2685 | |
| O=CC1CCC(=O)OC1,0.223 | |
| C1CN2C3C4C(C23)N14,0.2721 | |
| C1CC1C1C2CC1OC2,0.3171 | |
| CC1(CN1)C(=N)OC=O,0.2479 | |
| OC1CC2C3NC2C13O,0.2827 | |
| CC1C2C=CC(C#N)N12,0.2252 | |
| CC(=O)C(O)C1CC1O,0.2313 | |
| N=C1OC2C3OCC1C23,0.2586 | |
| c1c(c([nH]n1)N)N(=O)=O,0.1728 | |
| N=C1OCC2CC1C=C2,0.2443 | |
| C1CC1C12CC3C(C1)N23,0.3169 | |
| CC12OCC3(O)CC1C23,0.2938 | |
| CC1C=CCNC1=O,0.2521 | |
| CC1C2CC1C=CC=C2,0.1779 | |
| C#CCOC1=NCCC1,0.2792 | |
| OC1=NC=CC(=N)C=N1,0.1524 | |
| CC12CC=CC1C1CC21,0.2635 | |
| O=C1OC2(CC2)C2CC12,0.2639 | |
| C#CC(=O)CCN1CC1,0.1799 | |
| CCCC(C)(C)CC#C,0.31 | |
| N#CC1CN2CC2CN1,0.2499 | |
| O=C1CCCC2NC2C1,0.2243 | |
| NC1=NC(=[NH2+])[N-]C(F)=C1,0.2222 | |
| CCC(=O)CC1(C)CO1,0.228 | |
| CC1CC2CC2(O)C1O,0.3056 | |
| Cc1ccoc1CCO,0.2345 | |
| C#Cc1c(ocn1)CO,0.2138 | |
| C1CC23NC2CCOC13,0.3197 | |
| COC1(C)C2CC2C1O,0.3146 | |
| C1OC2COCC1O2,0.3291 | |
| CN(C)C(=O)C(O)C=O,0.2119 | |
| CC1COCOC1C,0.3388 | |
| CC(C)C1CC=CCO1,0.2671 | |
| COC(C)C(F)(F)F,0.352 | |
| c1c(c(cnn1)O)O,0.2031 | |
| CCCC(C#C)C(C)O,0.3021 | |
| CC1CC23CCC12CC3,0.2918 | |
| OC1C[NH2+]CC1C([O-])=O,0.2736 | |
| CC1C(=O)C=CC11CN1,0.1904 | |
| NC(=O)N1C=COC1=N,0.2228 | |
| CC([NH3+])CC#CC([O-])=O,0.2251 | |
| OCC1OC2C(O)C2O1,0.3002 | |
| Cc1c(c(oc1N)N)O,0.2138 | |
| CC(C=O)C(C)C1CC1,0.2279 | |
| OC1CC2CC1C21CO1,0.3305 | |
| CC1OC(=N)C2(C)CC12,0.2807 | |
| O=C1CCC2(CN2)C=C1,0.1867 | |
| O=C1C2COCC1C=C2,0.2309 | |
| CNC(=N)C1(CO1)C#N,0.2222 | |
| Cc1c(c(ncn1)F)O,0.2154 | |
| CC1CN1C1=NON=C1,0.21 | |
| N#CCNC1C2COC12,0.2554 | |
| COC1(CC1)C(O)C=O,0.2161 | |
| O=C1NC2C(N1)C2C#C,0.2637 | |
| CCC1CC(C)C(C)O1,0.3181 | |
| O=C1CCOCC11CO1,0.217 | |
| CC1(C)C2CC3C2N13,0.3239 | |
| CN1CC(O)CC1C=O,0.1876 | |
| CC(CO)OCC#C,0.2848 | |
| CC(C#C)C(CO)C#C,0.2951 | |
| O=CC1C2CCC1C2=O,0.2007 | |
| CC(C)COCCO,0.3351 | |
| CC#CCn1cnnn1,0.265 | |
| CC1CCN1C(=O)C=O,0.1725 | |
| CC1(CNC(N)=O)CO1,0.3033 | |
| N#CC1CC2=CCCC12,0.2457 | |
| CC1C2CC=CC1CO2,0.2558 | |
| CNC(=O)N1CC1C#N,0.2724 | |
| OC1(COC1=O)C1CC1,0.2585 | |
| CC12OCC1(O)C2O,0.2653 | |
| CC1(C)C(C#C)C1C#N,0.271 | |
| CC12CC3(C)CC1C23O,0.2952 | |
| COC1C2OC2C1(C)C,0.3178 | |
| CC1CC(=O)NCC=C1,0.2461 | |
| OC1CN(C=O)C(=O)C1,0.2162 | |
| CC1(CO)C=CC2OC12,0.2466 | |
| CCC1OCCN2CC12,0.3061 | |
| C#CCOc1c[nH]cn1,0.2278 | |
| CC(O)C1OCCC1O,0.3057 | |
| c1nc(nnn1)OC=O,0.1658 | |
| CC1C(OC1(C)C)(C)C,0.3081 | |
| CC1C2C3C4N3C2C14C,0.3036 | |
| CCC1C(O)C2CC12C,0.303 | |
| O=CC12CCC1C2C#C,0.2137 | |
| [O-]C(=O)C1C2CC[NH2+]C12,0.2657 | |
| C1CC(C1)OC(=O)C#N,0.2452 | |
| CC1CC2OC(C1)C=C2,0.2473 | |
| CC1C2(O)CCC12C#C,0.2524 | |
| CCCCCC(O)C#C,0.2974 | |
| C(C=O)OC(=N)NC=O,0.2092 | |
| O=C1CC=CC1N1CC1,0.2103 | |
| C(=O)NC(=O)N,0.242 | |
| COC1C2OC2C1C#C,0.2789 | |
| CCC1(O)CC=CC1,0.2681 | |
| CC1CC2CC(C1)O2,0.3144 | |
| CCC1=CC(C)CC1O,0.2574 | |
| CC1COC1(C#N)C#N,0.2611 | |
| COC1OCC(CO)=C1,0.2616 | |
| CCC#CC1OC1CC,0.2738 | |
| C1OC23C1CC1C2OC31,0.2862 | |
| CC(=NO)CCO,0.2523 | |
| OC1C2CC3(CCC13)C2,0.3327 | |
| CC(O)CC(C)(C)O,0.3167 | |
| CC(=O)CN1C2CCC12,0.2273 | |
| COC1OCCC2NC12,0.3106 | |
| CC12C3COC1C(O)C23,0.304 | |
| CC1CCC=CCC1O,0.253 | |
| O=C1COC2C(C#N)C12,0.2153 | |
| CC1(CN1)C(=O)OC=N,0.2324 | |
| CCC#Cc1nc[nH]n1,0.2229 | |
| CC1(CN2CCC12)C#N,0.2587 | |
| CC(O)C1(CO1)C1CN1,0.3184 | |
| O=CC1OCC(=O)O1,0.2157 | |
| COC1C(C)OC1C#N,0.2746 | |
| CN1C2C3C1C2C3(C)O,0.2809 | |
| FC1=NC(=N)N=C(F)O1,0.2361 | |
| O=C1CC2CN2C1C#N,0.2026 | |
| COC1C2NC1C(C)=C2,0.222 | |
| CCN=C(C=O)N1CC1,0.163 | |
| CCCc1cnc(o1)C,0.2363 | |
| CC#CC1OC2COC12,0.26 | |
| CCC1(C)C2OC1C2O,0.301 | |
| OC1C2CCOC2C1=O,0.1943 | |
| CC12C3C1C1CC3C21O,0.2955 | |
| CC12OCC(C=C1)C2O,0.2302 | |
| CC(=O)C1CC(O)C1,0.2165 | |
| CC12CC1C=CC21CO1,0.2385 | |
| CC#CCn1ccnn1,0.2572 | |
| CC(O)(C#N)C#CC#C,0.222 | |
| NC1=NC2C3CC2(C3)O1,0.2743 | |
| OCC1OCOCC=C1,0.2586 | |
| C1C(=O)NCC12COC2,0.2711 | |
| CC1(CC#N)OC1CO,0.2998 | |
| CCC(C#C)C(O)CO,0.2984 | |
| Cc1c(c[nH]n1)OC=O,0.2455 | |
| CC(C)(CO)C#CC#N,0.245 | |
| CC1=CC2(CO2)CCC1,0.2464 | |
| CC(NCC#N)C(N)=O,0.2541 | |
| Cn1ccnc1OC,0.2454 | |
| Cc1ccc(c(c1)O)N,0.1987 | |
| Cn1cc(cc1OC)N,0.2269 | |
| CC1(C(=NO)CO1)C,0.2469 | |
| CC1COC(C)C1(C)O,0.3127 | |
| COCC(=O)C(O)C#C,0.2245 | |
| CC12CC(CO1)OC2=N,0.273 | |
| CCC1(COC1=N)NC,0.2548 | |
| CCCNc1cc[nH]n1,0.2245 | |
| c1c(cncc1F)C#N,0.2054 | |
| CN1C2C3C2N2CC1C32,0.257 | |
| c1c(n[nH]n1)N=CN,0.2017 | |
| CCC1COC1,0.3194 | |
| OCC1OCCN=CO1,0.2598 | |
| CC1(NC1C1CN1)C#C,0.2666 | |
| CC(C1CCC1)C(C)=O,0.229 | |
| CN1C2CC1C(=O)OC2,0.2375 | |
| C#CC1=CCOCOC1,0.2088 | |
| CC1C(OC1=N)C#N,0.2763 | |
| CC(CC=O)(C=O)C#N,0.205 | |
| COC1CNC1=O,0.2566 | |
| CC(C#C)C1(CN1)C#C,0.274 | |
| CC1(C#C)C2CCC1O2,0.3042 | |
| CNC(=O)COCC=O,0.2092 | |
| COC(=O)CC(O)CO,0.2722 | |
| CCC1C2CCC2C1=O,0.2138 | |
| CCCC(CC)C(N)=O,0.2737 | |
| C1OC2C3OC22C1NC32,0.2077 | |
| COCC1(COC1)C=O,0.2211 | |
| O=CN1C2CC=CCC12,0.2554 | |
| c1cc(oc(=O)c1)C=O,0.1541 | |
| CC1=C(C)N=CC(=N)O1,0.1546 | |
| c1c(n[nH]n1)C(=O)CO,0.2031 | |
| O=CC1C2CC3C(C2)N13,0.2247 | |
| ON=C1CCC1(O)C=O,0.209 | |
| O=CC1CC2OC2CO1,0.2263 | |
| C1NC11CC2CC3C1N23,0.3016 | |
| CC#CCOC1CC1C,0.2812 | |
| CC1NC(=O)COC1=O,0.2554 | |
| N=C(C=O)N1C2CC1C2,0.1746 | |
| CC1CC(C)C1C,0.3575 | |
| CC1=CC2CN2C1C=O,0.1907 | |
| CC1C2CCC1(C)OC2,0.3091 | |
| C(C=O)n1nc(nn1)N,0.1943 | |
| COC1(CC2CC12)C#C,0.2858 | |
| [NH3+]C1(CC1)C([O-])=O,0.2701 | |
| CC(=O)NC(=N)C=O,0.1894 | |
| OC1C2C3C1C(=O)C23O,0.236 | |
| OCC12OCC1CC=C2,0.2561 | |
| FC1=NC(=N)ON=N1,0.1649 | |
| C1C2NC3=C(C=NN3)C12,0.228 | |
| c1c(c[nH]c1N)N,0.225 | |
| CCC1(CO)CC2OC12,0.307 | |
| O=CC#CC1=NCCN1,0.1484 | |
| CN1C(=O)CC12CC2,0.2671 | |
| OCC#CCCOC=N,0.2743 | |
| O=C1C2CCC1C21CC1,0.2285 | |
| OCC1C2CC1(N2)C=O,0.1911 | |
| CC1NCC2=C1N=CO2,0.2213 | |
| O=COCC12CC1CO2,0.2621 | |
| OC1COCCNC1=O,0.2526 | |
| CC1C2N(C)C1C2=O,0.2483 | |
| CC12CN1C(=O)N1CC21,0.2387 | |
| OC1C2CC3C(O)C2C13,0.315 | |
| Cc1c(cnc(=O)[nH]1)O,0.1552 | |
| C1CC=C(C1)NC=O,0.2118 | |
| Cc1c(c(=O)ocn1)N,0.167 | |
| c1c(nn(n1)C=O)O,0.1996 | |
| C1COC(O1)CCCO,0.335 | |
| CC(O)C1CC1OC=O,0.2799 | |
| c1c(ncoc1=O)C=O,0.1667 | |
| CC1OC1(C)C(C)(C)C,0.3317 | |
| CC1(C#N)C2C3CN3C12,0.2571 | |
| NC(=O)C1C2CC1C2O,0.2645 | |
| CC1=C(CC2(C1)CC2)C,0.2545 | |
| CC12CC1NC(C2)C#N,0.253 | |
| CC1OC=NC11CCC1,0.2658 | |
| CC12C3CN1C(=O)C2O3,0.2084 | |
| CCCc1c[nH]nc1,0.2583 | |
| C1COC(O1)C#CCO,0.2733 | |
| c1c2c(c[nH]1)C=CCC2,0.1998 | |
| OC1C2C3CC1C=CC23,0.2417 | |
| NC(=O)C1(N)COC1=O,0.2333 | |
| CC(C)OC=O,0.2863 | |
| CC1CC2(CO)OC12C,0.323 | |
| OCCCC1NC1C=O,0.2218 | |
| C1OC1C1C2C3CC1N23,0.3195 | |
| CN=C1OCC2(C)NC12,0.2566 | |
| CNC1=CC(=O)CNC1,0.1941 | |
| CC1C=CC2(O)CCC12,0.2585 | |
| C1CC12CC(=O)N2,0.2768 | |
| O=C1NCC2C(C#N)C12,0.2583 | |
| N#CC1(C#N)C2CNC12,0.2465 | |
| NC(=O)C1CCN1C=O,0.2464 | |
| C#CC12CC3OC1C3N2,0.2637 | |
| CC1N2C3C4CCC13C24,0.3053 | |
| N#CC12CCC1=CCC2,0.245 | |
| CC12CC1N1CC1C2,0.3096 | |
| CCc1n[nH]c(=O)o1,0.2473 | |
| CN1CC1C(=O)C1CN1,0.1949 | |
| OC1CC=CC2CN2C1,0.2282 | |
| N#CC1=CC2CCC1N2,0.1969 | |
| OC12CC1OCCOC2,0.3155 | |
| N#CC12C3CC1CC2C3,0.2973 | |
| COCC1C2OC(C)C12,0.3211 | |
| CC12C3CC1C1CC3C21,0.326 | |
| CCn1cc(c(n1)N)C,0.23 | |
| ON=C1CC2(CC2)C1O,0.2443 | |
| C#Cc1[nH]cc(n1)CO,0.1997 | |
| C(=O)c1[nH]c(=O)[nH]n1,0.1637 | |
| CC(O)C(C)C1CC1C,0.3267 | |
| CCC1CC1C1(O)CC1,0.3162 | |
| CC1(C)OC=NC2CC12,0.253 | |
| CC#CCC(O)C1CO1,0.2987 | |
| OC1C2C3CN2C13C=O,0.2037 | |
| N#CCC1C=CC2CC12,0.2463 | |
| CCCOCCCC=O,0.2301 | |
| CC(C)c1c(c[nH]n1)O,0.233 | |
| OC1C2CN3CC=C1C23,0.1958 | |
| OC1C2C3NC2C13C#N,0.2633 | |
| O=CC1C2CC2OC1=O,0.2253 | |
| CC1=C(N)C=NOC1=N,0.1578 | |
| OCCOC1CCCO1,0.3416 | |
| CC1(COC1)NCC#N,0.2687 | |
| OCC1(CN2CC2)CN1,0.3009 | |
| CC1C(C)N1C(=N)C#N,0.2021 | |
| Cc1cn(cn1)CC#C,0.2377 | |
| N#CC1CC2C3CC2C13,0.3425 | |
| CC1C2NC1(C#C)C2=O,0.2388 | |
| C1C2C3OC3CCCN12,0.302 | |
| CC12COC(C=O)C1N2,0.2205 | |
| O=C1CCN1CC1CO1,0.2776 | |
| N=COC1COCC1=O,0.1993 | |
| CC1(O)CC2C1OC2=O,0.2777 | |
| Cn1cnc2c1con2,0.196 | |
| OC(C=O)C1=COC=N1,0.206 | |
| CC1C2C=C(CO)CN12,0.2264 | |
| CC1OC1(C)C1CC1,0.3506 | |
| [NH3+]CC1=C([O-])OC(O)=C1,0.1555 | |
| CCOC(CO)C1CC1,0.3175 | |
| CC1(NC1CC=O)C=O,0.2022 | |
| CC1OCC2C3OC1C23,0.3059 | |
| OCC1CNC(CO)=N1,0.2465 | |
| CC(=O)NC(=O)CC=O,0.2086 | |
| N#CC1C2CN1CC=C2,0.2261 | |
| O=CC12COCC1CO2,0.2062 | |
| CN=c1occ(o1)C=O,0.1643 | |
| CN=C1NN=CC(F)=N1,0.1486 | |
| CCC(CO)CCO,0.3361 | |
| CC12OCCC1N1CC21,0.2991 | |
| CC1=CCC2(CC2)OC1,0.2634 | |
| CC#CC#CCN1CC1,0.2207 | |
| CC1=C(F)C(=O)N=NO1,0.1666 | |
| CCC1CC1C#CC,0.2823 | |
| OCC12CC1CC(=N)O2,0.2742 | |
| O=C1C=C2NC3CN1C23,0.1703 | |
| CNC(=O)C1NCC1=O,0.1962 | |
| CCN1CC(C1)(C=O)O,0.1777 | |
| COC1=NOC(=N)N=C1,0.1549 | |
| CC1=NC(=CO1)C1CO1,0.2354 | |
| C1C=CC(=O)CC1=NO,0.1828 | |
| C#CCC12C3C4C(C13)N24,0.2598 | |
| N#CC1C2C3CCC1C23,0.3027 | |
| CC(C#CC#N)C1CC1,0.2444 | |
| CN1CC(N)(C#C)C1=O,0.2408 | |
| NC1C2CC(N2)C1C#N,0.2701 | |
| COC1OCC2(C)CC12,0.3473 | |
| C#CC1C2C3C=CC2C13,0.2246 | |
| CC12OC3C4C3C1C24,0.3172 | |
| CCC(=O)C1CC1(C)C,0.2301 | |
| OC1CC2(O)CC1(O)C2,0.3068 | |
| COC(C)C1CC2OC12,0.3272 | |
| C1CC2(CC3CCC23)O1,0.3037 | |
| CC(C#C)N(C)CC=O,0.1986 | |
| CC1OCC2N3CC12C3,0.2899 | |
| O=CC1CC2COC1C2,0.2208 | |
| CC(C#N)C(O)C#N,0.3082 | |
| C1CC2NC2CO1,0.3125 | |
| C1C=CC2C3C4C3C2C14,0.2547 | |
| C(C#N)C(=O)C#N,0.2126 | |
| CC12OC3C(C13)C2CO,0.2934 | |
| CC(C=O)C#CC(N)=O,0.2122 | |
| Cc1c(cnn1C)N,0.2274 | |
| COC1C2CC2CC1=O,0.1999 | |
| ON=C1CCC2C(O)C12,0.2393 | |
| O=C1CNC23CC12NC3,0.189 | |
| C1CC#CC=CCOC1,0.1983 | |
| CC1CCOCC(O)C1,0.3149 | |
| OC1C(=O)C2CCC12O,0.2114 | |
| CC(O)CC(O)C(C)C,0.3073 | |
| C1CC12CC(C2)(CO)O,0.3201 | |
| OCC1CC2(OC12)C#N,0.2742 | |
| NC1=C(N)OC(=N)O1,0.2395 | |
| CC12CC(CO)=CC1N2,0.2309 | |
| CCC(=O)C(=N)N,0.1974 | |
| CCOC1COC(=N)O1,0.3107 | |
| [NH3+]C[C-]1OC(=O)C=C1,0.1739 | |
| C1C2CC11COCCC21,0.3379 | |
| COCC1OC1CC#C,0.3054 | |
| C1OC23COC2COC13,0.3152 | |
| Cc1c[nH]c(n1)C=O,0.1815 | |
| COC1(C)CCC1C=O,0.2262 | |
| Cc1cc(c([nH]1)C)O,0.2208 | |
| C[NH2+]C1CC1C([O-])=O,0.2729 | |
| CC1(COCOC1)C#N,0.3145 | |
| C1CC(O1)C1=CCCC1,0.247 | |
| CC12OC1C1(O)CC2C1,0.3195 | |
| CCC12CC(CC1)C2C,0.3584 | |
| c1cc(oc1)NC(=O)N,0.2322 | |
| Cc1c(c(n[nH]1)O)C#N,0.2285 | |
| N=COC1=CC=CO1,0.2226 | |
| CC1C2C3C1N2CC3=O,0.2057 | |
| CC1C2CC2(CO)C1O,0.3159 | |
| CCOC1(C)CC1(C)O,0.3157 | |
| CC1CC11C2OC1C2C,0.3115 | |
| COCC1COC1C=O,0.2107 | |
| O=CC1(CC2OC12)C#C,0.2165 | |
| CC(O)C1=NOC=C1,0.248 | |
| CC12CC3(CN3)C1N2,0.313 | |
| CC(O)CC1(C)CC1,0.3253 | |
| CC12COC1(C)C(=O)O2,0.2497 | |
| OC1CC11CCCC1,0.3314 | |
| CCC(C#N)C#CC=O,0.2032 | |
| N=C1NC=COC1=N,0.175 | |
| CC1CC1(O)CC#N,0.2968 | |
| c1c(onc1N)C=O,0.1706 | |
| OCC1=CC(O)CC1,0.2577 | |
| CC1(C#N)C2OC2C1O,0.294 | |
| O=C1CCC2CC12,0.2264 | |
| Cc1ccnn(c1=O)C,0.1765 | |
| CCC(O)C(O)CO,0.3207 | |
| CN(C(=O)C#C)C(=O)N,0.2138 | |
| C#CCC1OC1C#N,0.2672 | |
| COC1C2CN2C1=O,0.2164 | |
| O=C1CC2(N1)C1CC2C1,0.284 | |
| CCCC(=NO)COC,0.2584 | |
| COC1OC2CC1C=C2,0.251 | |
| C#CC1=NCC(N1)C#N,0.2073 | |
| CC1C2C3C(CN2C)N13,0.2769 | |
| N=C1OC2(CNC12)C#C,0.245 | |
| CC12CC=C(C=O)C1O2,0.1887 | |
| CC12C3C1C1(C)C2CN31,0.2952 | |
| OC(C=O)C1OCC1O,0.2125 | |
| CC#CC1(C)CC2OC12,0.2874 | |
| COC1(C)CC1C(C)=O,0.2311 | |
| C1CCCOC=NCC1,0.2576 | |
| CCOC1C=CCC1O,0.2633 | |
| N=C1CC2=C(N1)N=NO2,0.1759 | |
| CC(=O)OC1CC2CC12,0.2796 | |
| C#CC12CC1CCOC2,0.2883 | |
| O=COC1CNC(=O)C1,0.2522 | |
| CC1OC2(CC2)C1=O,0.2174 | |
| COCC1COC(=O)C1,0.2779 | |
| CCOC=NCC#C,0.2716 | |
| CC1(OCOC1=N)C=O,0.2223 | |
| O=CCC#CCC1CO1,0.2207 | |
| CCC1CC1(OC)C#N,0.291 | |
| COC1CC(C)C1C#C,0.2888 | |
| CC1C2CC2C=C1CO,0.2436 | |
| C1OC2C1C1CCCC21,0.31 | |
| CC12NC1(CO)CC=C2,0.2346 | |
| CC(C)C1C(O)C1O,0.2798 | |
| CC12OC1CC21COC1,0.3176 | |
| N=C1OC(=O)NN=C1,0.1941 | |
| NC(=O)N1C2CCC12,0.2674 | |
| Cc1cc(n(c1)C)C,0.2409 | |
| CCc1coc(n1)NC,0.2337 | |
| CCC1CC(=O)C(C)O1,0.2192 | |
| OC1C2C3C1=CCC23O,0.1839 | |
| O=C1CC2C(C12)N1CC1,0.2301 | |
| O=C1COC11CC2OC12,0.2124 | |
| CCC#CC1(C)CN1C,0.2606 | |
| OC1C2NC2C2CC12O,0.2974 | |
| CNC(C#N)C(O)C#N,0.2709 | |
| CC12CC1C(=O)COC2,0.2127 | |
| CCC(C)C(O)COC,0.3254 | |
| C1C(CO1)(CNC=O)O,0.2476 | |
| OCC12CC1CC(O)C2,0.3244 | |
| C1C2N1CC21CC1,0.3055 | |
| CCc1[nH]cc(n1)OC,0.224 | |
| c1c(c([nH]n1)N)N2CC2,0.2335 | |
| CCCC1C=CCC1C,0.261 | |
| NC(=O)N1C=NNC1=N,0.2152 | |
| CC(C)C12OC3C1CC23,0.302 | |
| CC1NC(C#N)C2NC12,0.2674 | |
| CC1(CCC#N)CN1,0.2961 | |
| c1cn[nH]c1C#CCO,0.2061 | |
| COCC1=CCOC1C,0.2504 | |
| CCC(=O)COC=NC,0.2212 | |
| Cc1c(ocn1)N,0.2398 | |
| CCC1(CC1)C(F)(F)F,0.3821 | |
| C1C2CC3OC1C23,0.3127 | |
| NC12CCC1OC2=O,0.2497 | |
| CC(CC#C)C(C)(C)C,0.3124 | |
| CC12C3OC1C3CC2O,0.2973 | |
| c1c(c(c(cn1)N)F)N,0.2045 | |
| C1CC23OCCC2OC13,0.3014 | |
| CCC1CC1OC(C)=O,0.2793 | |
| CC12CC3C(C1)C(=O)C23,0.2283 | |
| CC1COCC1CCO,0.3162 | |
| N#CC12C3CC4C1N4C23,0.2579 | |
| CC1(CN1C=O)C,0.2533 | |
| CCC1(C)C(C#C)N1C,0.2555 | |
| O=C1CC23CCC2C1O3,0.2154 | |
| Cc1coc2c1occ2,0.2011 | |
| Cc1cnc(cc1F)N,0.2049 | |
| OC1CC2CCC(C1)O2,0.3038 | |
| CN=C1C(=CC(=O)N1)N,0.1726 | |
| OCC12CCOC1C2O,0.3148 | |
| CC12CCC1(O)C1OC21,0.318 | |
| O=CC1CN=C(N1)C#N,0.2012 | |
| OC12CCC3C1C2C3=O,0.234 | |
| CC1OC11CC2(C)NC12,0.2996 | |
| CC1CC(O)CCC=C1,0.2583 | |
| N=C1NC2CC2N1C=O,0.2293 | |
| C#CC1CCOCOC1,0.3063 | |
| O=C(C#N)C1OCC=C1,0.1707 | |
| Cc1cc(c([nH]1)C#N)O,0.1987 | |
| CC12CN1C(C#N)C2O,0.2595 | |
| O=C1C2CC1CC=CC2,0.2186 | |
| O=C1C2CN2C11CCC1,0.2175 | |
| NC(C#N)C12CC(C1)C2,0.2812 | |
| CC12OC1COC2C#C,0.2865 | |
| C1CC12C=CC=CCO2,0.1817 | |
| c1cnc(nc1)N(=O)=O,0.1898 | |
| C1CC2(C1)C(=O)OCO2,0.2697 | |
| Cc1c(nc([nH]1)C#C)C,0.1941 | |
| CCOCC(F)(F)F,0.3485 | |
| CC1CCC11OC1CO,0.3226 | |
| CC12CC3CC(C=C1)C23,0.2494 | |
| CC1(C)CCOC1C#C,0.2922 | |
| COC(C#N)C1CC1,0.303 | |
| NC1=C(C=NO1)C1CO1,0.2235 | |
| CCC12OC(C1O)C2=O,0.2257 | |
| c1coc(c1C#N)N,0.2094 | |
| C1CC2CC(CC=C2)O1,0.2563 | |
| CCC1(C)OC1(C)C,0.3342 | |
| CCOC(C)(C)C#C,0.2973 | |
| CC1=NC(C)(CO1)C#C,0.2691 | |
| O=CC12CN3C(CO1)C23,0.201 | |
| CN(C)CC(=N)NC=O,0.2207 | |
| OC1COC(=N)C2CC12,0.2706 | |
| CC12CCC1C1NC21,0.3014 | |
| CC1CC(=O)OC1=N,0.2626 | |
| CC(=O)CC#CC1CO1,0.2272 | |
| COC12CC3C1C2C3O,0.3187 | |
| O=C1COCC2(CO2)C1,0.218 | |
| CCC1CCCCO1,0.331 | |
| C1C2C1C1C2CC11CO1,0.3035 | |
| CCC(C)CC1CCC1,0.3599 | |
| CCOCC(C)(O)C=O,0.2236 | |
| CC1=CC2NC2(C)CC1,0.2364 | |
| NC(=O)CC12CC1CO2,0.2718 | |
| C1CC1C1OCC=C1,0.2517 | |
| CC(C)(CCO)OC=O,0.2742 | |
| C#CC1(CC1)C(=O)CO,0.2319 | |
| CC12OC1C=CC2=O,0.1716 | |
| CC(C)(C)c1ccno1,0.2455 | |
| Cc1c(c[nH]c1C=O)N,0.1588 | |
| C#CCC#CCC(=O)N,0.2704 | |
| COCC(C)(C)OC=N,0.2846 | |
| c1c2c([nH]c1N)nn[nH]2,0.1951 | |
| COC=NC1CC(=O)C1,0.2203 | |
| NC1=CNC=C1OC=N,0.214 | |
| CC1CN2C3C2C(=O)C13,0.2181 | |
| COc1ncc(cn1)F,0.1967 | |
| CC(=O)NC1CC1CO,0.2692 | |
| Cn1c(c([nH]c1=O)N)O,0.2311 | |
| CC#CC1C2CC1N2C,0.2641 | |
| Cc1cc2c([nH]1)OCC2,0.2243 | |
| Cc1cc(cnc1F)O,0.1999 | |
| CC(O)C12CC1(O)CC2,0.3154 | |
| OC1C2C(CC12O)C=O,0.2237 | |
| C#CCC1(CC1)CC#C,0.3078 | |
| CC1(C(=CCO1)C#C)C,0.2044 | |
| C(C#N)OC(CO)CO,0.2775 | |
| COC(=O)CCNC=O,0.2681 | |
| N=C1OCCCCO1,0.2943 | |
| C1CC(=O)C(=O)CNC1,0.1679 | |
| CC1C2CC(=O)CC1O2,0.223 | |
| Cc1c(nc[nH]1)N2CC2,0.2377 | |
| CCC(=O)c1c[nH]cn1,0.2078 | |
| CCOCC(C)C#C,0.3131 | |
| OCC1CN1CC#N,0.2765 | |
| COC(=O)C1CCN1C,0.2301 | |
| CCCN1CC(C1)C#N,0.258 | |
| OC1CCC2OCC12O,0.3068 | |
| O=C1CN2CC(=O)CC12,0.1946 | |
| OC1C2C3CC(=O)C1C23,0.2222 | |
| CCC12NC1C1CC21C,0.2738 | |
| OC1CC2(CN2)C2NC12,0.3104 | |
| CC12CC1C(=O)NC2=O,0.2303 | |
| CC1OC1C1OCC=C1,0.2487 | |
| CN1C=CC(=N1)C1CO1,0.2472 | |
| C1C(=O)CN1C(=O)CO,0.2113 | |
| CC12C3COC1(C)CN23,0.3097 | |
| OCC1(OCC1=O)C#N,0.2146 | |
| CCCC(O)C(=O)C#C,0.1985 | |
| N#CC1N=C2CC3C1N23,0.1941 | |
| N=C1OC=C2CC=CN12,0.1801 | |
| C1C2OC3CN1C2C=C3,0.2082 | |
| OCC1OC(=N)C2CC12,0.2749 | |
| OC1CC2NC(=O)NC12,0.2803 | |
| COC12CC3C1C3(C)C2,0.3183 | |
| CCC#CC(=O)C1CN1,0.1984 | |
| C#CCCCNC(=O)N,0.2964 | |
| CCN1CC1C#CC,0.2614 | |
| CC1(O)C2NC1C2C#N,0.2826 | |
| CC(=O)C1(O)CC1C#C,0.2165 | |
| c1c2c(on1)C(=NC2)N,0.1965 | |
| COC1C2CN2C1=NC,0.2433 | |
| N=C1C=NC=CN=C1,0.166 | |
| Cc1cc(n[nH]1)CC#C,0.2559 | |
| CN=c1cnocc1N,0.152 | |
| C(#CC#N)C#CC#N,0.1744 | |
| COC1C2OC1C(C)=C2,0.2378 | |
| NC(=O)C1CC1CC=O,0.2262 | |
| CCC1OC1CCO,0.3378 | |
| c1nc(nc(n1)F)C#N,0.2059 | |
| CC(C)(CC(=O)C=O)O,0.1533 | |
| CC1(NC(=O)C=C1)C#C,0.2132 | |
| CNCc1nnn(n1)C,0.2029 | |
| CC(OCC1CN1)C#N,0.2709 | |
| C1CN(C1)C(=O)N,0.2894 | |
| c1c2c(on1)CCN2,0.1964 | |
| OCC1C2CC(=NO)C12,0.2429 | |
| CC1=CC2(C)CC1(C)C2,0.2355 | |
| c1cnc(c(c1N)N)O,0.2074 | |
| C1C=Cc2c(non2)N1,0.175 | |
| CC1(O)C2CN2C1(C)C,0.2948 | |
| NC1=CC(=O)CC1CO,0.2079 | |
| CC1(COC1)C2CCC2,0.3156 | |
| CC1CCOCC11CN1,0.3082 | |
| O=CC#CC#CC1CO1,0.175 | |
| COC12CCC3CC1C23,0.329 | |
| CC1C2CC1(O)C(=O)N2,0.2652 | |
| NC(C#N)C12CC1CN2,0.2585 | |
| OC1CCOC2CC12,0.3145 | |
| COC1CCC2CC1C2,0.3263 | |
| CC#CC(=O)C(=O)C#N,0.1531 | |
| COC1CC2CN2C1=O,0.2149 | |
| CC1CC2OC1C1NC21,0.3096 | |
| C1OC23CC=CC2NC13,0.2295 | |
| CC(C=O)N=CNC=O,0.2125 | |
| COC1CC=CC(C)O1,0.2653 | |
| CC12NC3C1C2OC3=O,0.2374 | |
| Cc1c(oc(n1)C)CO,0.2295 | |
| COCc1ccn[nH]1,0.2583 | |
| OC12COCC1N1CC21,0.3005 | |
| C(CO)N=COC=O,0.2383 | |
| COC(=O)CCOC=O,0.2806 | |
| CC12CC3(C)C4C1N4C23,0.3006 | |
| CCC1CN1CCOC,0.3119 | |
| c1cocc1NCC=O,0.1745 | |
| COC1CC(=O)C1C,0.2211 | |
| COC12CC1C=CC2C,0.245 | |
| CC12CC(C1)OC=N2,0.2656 | |
| OCC(CC#N)C1CO1,0.3066 | |
| CCC1OCC11COC1,0.3079 | |
| CC1(O)C2C3C4C3C1C24,0.308 | |
| CCN=C1OC(C)C1O,0.2723 | |
| OC1COC1C1CC1,0.3065 | |
| Cc1cc(on1)C(C)C,0.2482 | |
| CC(=N)Nc1cnoc1,0.2116 | |
| CN(C)c1ccno1,0.2182 | |
| CC12C3COC1C(=N)N23,0.2406 | |
| CC(N)(C[NH3+])C([O-])=O,0.2677 | |
| c1coc2c1CCC2=O,0.1945 | |
| COC1C=CCC1O,0.2631 | |
| CC#CC1CC1OC=O,0.2478 | |
| CC1CC(C=O)C2CN12,0.2109 | |
| OCCC1=CC(=N)OC1,0.2143 | |
| Cn1c(c(c(n1)O)N)N,0.2435 | |
| CC1C(C)N2CC(=O)C12,0.1974 | |
| CC1OC1C1=CCCC1,0.2408 | |
| N#CC1CCC=C1C#N,0.2224 | |
| CC1C2OC(N)=NC12,0.269 | |
| CC1COC(=O)C(C)N1,0.2356 | |
| CCC1(CC)CC2NC12,0.3048 | |
| CC12CC1OCCCO2,0.3178 | |
| COc1c(c[nH]c1N)N,0.2243 | |
| CC1CC2C1OC2=O,0.2799 | |
| N=C1OCC2OCOC12,0.2657 | |
| CC1CC2C1C2(C)C#N,0.3127 | |
| OCC1(CO)OC1C=O,0.2153 | |
| OC1CC2CC1C2C#C,0.3028 | |
| CCN=C1OCC1CC,0.2769 | |
| C1C2C1C13NC21CC=C3,0.1952 | |
| C1OC2C1C21CCCO1,0.2873 | |
| CC1C(=O)C2OC12C#C,0.2059 | |
| CC(=O)n1ccnc1,0.1976 | |
| CC1CC2(CO2)C1(C)O,0.3177 | |
| OCC12CC3(CC3)C1O2,0.3236 | |
| C1C=Cc2c1[nH]c(=O)o2,0.1709 | |
| O=CC1NC1CN1CC1,0.2125 | |
| CC1CCC=CC1C#C,0.2622 | |
| CC(O)C12CC3C1N3C2,0.2952 | |
| CC12CC(C3CC13)C2=O,0.2345 | |
| CNc1coc(=O)[nH]1,0.2372 | |
| CC1=CC(=O)CN(C1)C,0.1751 | |
| OC1CCC1(C=O)C#N,0.2115 | |
| CN1C=CC=CNC1=O,0.1706 | |
| CC1N2CC2CCC1=O,0.1987 | |
| CCNC1CC1(O)C#N,0.239 | |
| CCC(=O)N1C2CCC12,0.2451 | |
| O=C(C#C)C12CC(C1)N2,0.1823 | |
| OC1COC(C1)OC=O,0.2775 | |
| C1CC2COCC3C1N23,0.302 | |
| CC(C)c1[nH]ccn1,0.2515 | |
| COC1(C)CCOC1C,0.3204 | |
| C#Cc1[nH]c(cn1)C#N,0.1869 | |
| CC1OC(=N)CC=C1C,0.2569 | |
| Cc1cnc(n1C=O)O,0.1661 | |
| CCOC(CC)CC#N,0.2915 | |
| CC(C)(C#C)OC,0.2972 | |
| c1c2c([nH]cn2)[nH]n1,0.2287 | |
| N#CC1NCC2NC12,0.268 | |
| CC1CC2CC=CCC12,0.2614 | |
| CC(CC1CO1)N1CC1,0.3095 | |
| COC1(C#N)C(N)C1N,0.2373 | |
| c1c(ocnc1=O)C#N,0.1786 | |
| ON=C1C2CC2C2OC12,0.2299 | |
| OC1C2CN3CC3C12,0.2789 | |
| CC(C)N1CC1(C)CO,0.297 | |
| CC1CN2N=CN=C2C1,0.2668 | |
| c1cc(c(=O)cnc1)N,0.1437 | |
| N=C1NC23CC(C2)OC13,0.2594 | |
| CC1(CC#N)CC=CC1,0.2647 | |
| O=C1CC=C2CCC2C1,0.2231 | |
| CC1C2NC2(C)C2CN12,0.3199 | |
| CCNc1c(nc[nH]1)O,0.225 | |
| c1c(nnn1CC#N)O,0.2199 | |
| CC1(CNCC1=O)C#N,0.1941 | |
| O=CC(=O)C1NC1C#C,0.1605 | |
| CC1CN2CC2CC1=O,0.2125 | |
| CC1NC(=O)CC1C#C,0.2695 | |
| N=C(C#N)N1CC(=O)C1,0.2019 | |
| COC1C2C3CC3(O)C12,0.3192 | |
| CC12OCC1C(O)C2=O,0.1928 | |
| CN1C2C3NC3C2C1=O,0.2602 | |
| [O-]C(=O)C1[NH2+]CC11CC1,0.2625 | |
| O=CC1=CC2COC2C1,0.1909 | |
| CC1C2CC3CC2C13O,0.3208 | |
| CCC(=O)C1(O)CC1O,0.2108 | |
| CC(=O)C1C2CCC1O2,0.2165 | |
| [NH3+]CCC(O)CC([O-])=O,0.2791 | |
| CC1(C)COC1C(N)=O,0.2626 | |
| CC(C=O)C#CC(C)=O,0.2033 | |
| [NH3+]CC1NC1C([O-])=O,0.261 | |
| c1c(c(no1)C=O)N,0.1552 | |
| CC1(CC2CC12O)C=O,0.2256 | |
| C[NH2+]CC(=N[O-])C(C)=O,0.1213 | |
| COC12CC1COC2C,0.3325 | |
| CC12CC3(O)C=CC1C23,0.2378 | |
| c1c(oc2n1ncn2)N,0.2265 | |
| NC(=O)NCCOC=N,0.2758 | |
| O=C1C(OC11CC1)C#N,0.2175 | |
| C1NC2COC1C1NC21,0.2863 | |
| OC12C3CC=C1C=CC23,0.1729 | |
| OC1C2C3NC3C12O,0.2787 | |
| CC1C(=O)C(O)C1(C)C,0.2235 | |
| CC12OCCC1CC2O,0.3058 | |
| CCN1C(C)C1CO,0.2798 | |
| CC1=CC2OC1(C)C=C2,0.1999 | |
| CC12NC1COC2C#N,0.2768 | |
| CC12OC(N)=NC1C2O,0.2653 | |
| CCC1CC2CC12,0.3391 | |
| CC12OC1C1C(C#C)C21,0.2624 | |
| COCC1OC2CCC12,0.3124 | |
| N=C1CC=C2CCC2O1,0.249 | |
| CC1=NC(=N)OC(N)=N1,0.1974 | |
| CCCCCC#N,0.3523 | |
| CC12CC3C(C13)C2C#N,0.2931 | |
| CC#CC(C)CC(C)O,0.2997 | |
| CC12CC1CC(C)(C)C2,0.3349 | |
| OCC1=CCC(C1)C#C,0.2595 | |
| CC1(C)C2CC(C2)C1O,0.3364 | |
| CCC1=C(N)OC(=N)N1,0.2206 | |
| OC1(C2CC2)C2CC1O2,0.2932 | |
| COC(C=O)C(O)C=O,0.1998 | |
| C#CC12CC1C=CC2,0.2433 | |
| CN1C(C=O)C1C#N,0.1961 | |
| CN1C2C3OCC2(C)C13,0.2891 | |
| COC(CO)C(C)C=O,0.2168 | |
| CC12NC1C1OC=NC21,0.2596 | |
| C1C=CCN1CC#N,0.2348 | |
| O=C1NCC2C3OC1C23,0.2469 | |
| c1cc(=O)oc(c1N)F,0.1546 | |
| CCC1(O)COCC1=O,0.2137 | |
| COC1COC2CC12O,0.3046 | |
| COCC1NC1C#CC,0.2777 | |
| O=C1C=CC2C3CC2C13,0.1801 | |
| CC1CC1C1C(C)C1O,0.3083 | |
| N=C1NC23CC4C2OC134,0.2444 | |
| OC(C=O)C1CCCO1,0.2193 | |
| OCC1=CCCN2CC12,0.2369 | |
| CC#Cc1c(con1)N,0.1908 | |
| COC(CO)C1NC1C,0.2967 | |
| O=C1COC(O1)C1CO1,0.2761 | |
| CC1C(C)C2(C)OCC12,0.3074 | |
| CC12C(O)C1CNC2=O,0.2722 | |
| CC1(COC1=N)N1CC1,0.2663 | |
| CC(C)OC1OCC=C1,0.2611 | |
| O=CC12CN1CC21CO1,0.2031 | |
| CC1(C#C)C2CC1C2O,0.2833 | |
| COC12CC1(C)OC2,0.3063 | |
| N#CC12CC(C1)C21CO1,0.2946 | |
| CC1(OCC11CO1)C#N,0.2859 | |
| O=CN1C2C3C2C2C3C12,0.2564 | |
| CC1(CC1C#C)C1CC1,0.2842 | |
| [NH3+]CC#CC#CC([O-])=O,0.1065 | |
| CC12CN1C(C)(CO)C2,0.2955 | |
| O=C1CC2CC(CO2)N1,0.2669 | |
| CN1CCN(C1=O)C=O,0.2379 | |
| N#CC1CC=CCN1,0.2495 | |
| N#CC12NC1C1CC2O1,0.2646 | |
| c1c(c(c[nH]1)NC=O)N,0.2165 | |
| OC1CC1C1=CN=CO1,0.222 | |
| CCN=c1n(cno1)C,0.219 | |
| CC12CC3C=CC1CN23,0.2223 | |
| COC1C2CC(C)OC12,0.3027 | |
| CC(=O)C1=CCCCC1,0.1971 | |
| C1CN=COCC(=O)N1,0.2409 | |
| C1C2C3C4C5C(C5N14)N23,0.278 | |
| CC1C=CC2NC12C#N,0.2432 | |
| CC1OC1C1=CNN=N1,0.2436 | |
| Cc1ccnc(=O)[nH]1,0.1802 | |
| CCC1CC2C3CC1C23,0.3342 | |
| CC1OC1C(O)C1CN1,0.2881 | |
| CC1OCC(CO1)(C)C,0.3304 | |
| CC1CC11COC1CO,0.303 | |
| CCOC1COCC1C,0.3179 | |
| Cc1c(=NO)cnon1,0.1698 | |
| CNc1cnoc1OC,0.2069 | |
| CN1C2COC(C)(C)C12,0.2973 | |
| COC(=O)C1COCO1,0.2663 | |
| Cn1cccc1C#N,0.2076 | |
| Cc1c(n[nH]n1)C(=O)N,0.2249 | |
| C1OC2C3CCC12CC3,0.3241 | |
| Cn1cccc(c1=O)N,0.1687 | |
| CC12CC1N1C2CC1=O,0.2318 | |
| N#CCC12CC3CN1C23,0.2861 | |
| CC12CCC(C)(OC1)O2,0.3263 | |
| Cc1c([nH]cn1)NC=O,0.1956 | |
| C(=O)Nc1nc(on1)N,0.2266 | |
| COC1C2C3CN=C1N23,0.1913 | |
| C#CCCc1ccc[nH]1,0.2376 | |
| CC1C2CC3CC2C13C,0.346 | |
| Cc1c(n(nn1)C)C#C,0.208 | |
| OCC#CC1CC2OC12,0.2738 | |
| CCC12NC1CC2=NO,0.239 | |
| C1C2C1C1COCCC21,0.3166 | |
| c1c(con1)NCCO,0.2076 | |
| CCC12C(C)N1CC2=O,0.2157 | |
| CC1(CN1)C#C,0.2885 | |
| CC1=C(F)C=NC(=N)O1,0.1547 | |
| CN1CCN(C=O)C1=N,0.2168 | |
| C1C=CC23OC12C1OC31,0.2384 | |
| Cc1ccc([nH]1)N,0.2317 | |
| CC#CC1NC1C,0.2773 | |
| CC(C)(CNC=O)CO,0.2817 | |
| CC1C(O)C(=O)N1C=O,0.2092 | |
| COC1C2CC(C)=CC12,0.2384 | |
| OCC1CN(C=O)C1=O,0.2167 | |
| CN(C)c1cc[nH]n1,0.2189 | |
| OC1CCC2C3CC3C12,0.3056 | |
| CC(C)C1C2C3OC3C12,0.284 | |
| OC1C2OCC12C#N,0.2694 | |
| CC1C2CC1(O)C=C2,0.2405 | |
| N#CC12C3CN=C1OC23,0.1593 | |
| NC12C3NC3C1OC2=O,0.2473 | |
| C#CC1C2NC1C21CO1,0.2871 | |
| CC1CC2(CO2)C2CC12,0.3313 | |
| CC1C2(CC2)OC1(C)C,0.3015 | |
| N=C1OC(=O)CC11CC1,0.263 | |
| C1C2C3C4OCC(C13)C24,0.3276 | |
| C#CC1C2C1C1CC2O1,0.2898 | |
| C1CC1n2c(=O)[nH]nn2,0.2165 | |
| CC(NC1(C)CC1)C#N,0.2736 | |
| O=C1C2CC2N2CC12,0.2109 | |
| N#CC12CCC1C=CC2,0.263 | |
| CC1CC2OC2(C)C1O,0.3238 | |
| CCC1COCC1(C)C,0.3115 | |
| C#CC1CCCCC=C1,0.2535 | |
| CC(=NO)C1C2CC1C2,0.2526 | |
| CC1(C)OC2CC12C#N,0.2706 | |
| COCc1cnncn1,0.1657 | |
| CCC(=O)N1CCC1,0.2685 | |
| CCC1(C)C2C3CN3C12,0.2797 | |
| COC(C#C)C(C)(C)O,0.302 | |
| N#CC12CC3CCC1N23,0.2616 | |
| O=CN1CC2CCC1C2,0.2688 | |
| CC1(C)C2C(O)C2C1=O,0.2237 | |
| c1cnoc1OC2CC2,0.2361 | |
| NC(=O)N1CCC1CO,0.2797 | |
| CC12COC1C(=N)O2,0.2631 | |
| CCC1CCCOC1C,0.3192 | |
| c1cocc1CCC=O,0.2047 | |
| CC1N(CC=C1C)C=O,0.2455 | |
| CC12CCC(CC1=O)C2,0.2228 | |
| CC1NC2C(O)C2C1=O,0.2124 | |
| C1OC1C12OC3CC1C23,0.3015 | |
| CC(C)(CNCC#N)O,0.2696 | |
| FC1=COC(=N)C(F)=N1,0.158 | |
| CC1CC1C1=CON=C1,0.2376 | |
| CC1=CCC2(O)COC12,0.2518 | |
| C1CC1C1CCCO1,0.3257 | |
| N#CCC12CC3OC1C23,0.2725 | |
| CC12C3C1C1OC3C2=C1,0.1949 | |
| O=C1CCC2C3C1CN23,0.2074 | |
| O=C1OC2CCC2O1,0.3347 | |
| NC(=O)OCC(O)CO,0.2865 | |
| OC1CC(C2CO2)C1O,0.3185 | |
| CC12CC=CC3CC1C23,0.2555 | |
| CCn1ccc(c1N)O,0.229 | |
| c1nc(c(=O)on1)CO,0.1682 | |
| CC1(O)CC1C1CC1,0.3225 | |
| OC12C3CC1=CCC23,0.1739 | |
| CCCC1(CC1O)OC,0.3204 | |
| CC(C)Nc1cc[nH]c1,0.223 | |
| CN1CC(C1)(C(=O)N)O,0.2495 | |
| CC12COCCC1O2,0.3372 | |
| CC(C)CC(C)C(N)=O,0.2775 | |
| OC1CN2CC12CC#C,0.2768 | |
| CC(O)C1=C(N)NN=C1,0.2376 | |
| CCC12CC1(O)CC2C,0.3182 | |
| CC1(NC1CCO)C=O,0.2272 | |
| C1C2CC3OCC3C12,0.3225 | |
| O=C1CCC(N1)C1CC1,0.2736 | |
| N=C1OCCC2CCC12,0.2767 | |
| CC1OCCCOC1=N,0.2772 | |
| C(C=O)C(=O)NC=N,0.2188 | |
| Cc1cn2c(c1C)CC2,0.2483 | |
| N=COC12CC3OC1C23,0.2492 | |
| CC(O)C12CC(O1)C2=O,0.2397 | |
| COCC1COCC=C1,0.2649 | |
| C1OC2C3OC12C=C3,0.2259 | |
| CCC1C(C)C(O)C1C,0.3056 | |
| N=C1NN=CC(=O)C=N1,0.1468 | |
| CC(CO)C1C(C)N1C,0.2852 | |
| NC(=O)C1COC1=O,0.2539 | |
| N#CC1CCC=C1,0.2654 | |
| CCC1N2CCC12C=O,0.2093 | |
| CCC1C2CC1C(=N)O2,0.2856 | |
| CC(O)C1COC1,0.3064 | |
| OCC1C=CC2CC12O,0.2456 | |
| C#CCCc1n[nH]nn1,0.2359 | |
| O=C1CC(CC#C)CO1,0.2772 | |
| CN=COCC(C)C#C,0.2734 | |
| CC(=O)c1c(nno1)O,0.1692 | |
| CCC1C2C=CC1C=C2,0.2171 | |
| CC(O)C12CC(CC1)O2,0.3135 | |
| CC1C(O)CC11CC1,0.3203 | |
| CCCCc1nc[nH]n1,0.2679 | |
| COCC(C#C)C#CC,0.2907 | |
| CC(C)(C)C1OCC=C1,0.2453 | |
| NC1=NNC(F)=NC1=N,0.1903 | |
| CC(O)C1=NNN=C1,0.2507 | |
| c1cc(oc1C2CC2)N,0.211 | |
| CC([NH3+])C1=C([O-])C=NO1,0.1535 | |
| CCc1c(c(n[nH]1)C)N,0.2312 | |
| CCCC(OC)C(N)=O,0.2649 | |
| CCN1CC2(C1)OC2C,0.2977 | |
| COCCNC(=O)CO,0.2768 | |
| OC12CC3C4C(OC13)C24,0.305 | |
| CC1C(=O)OC2CC12O,0.268 | |
| C1CC2NC2COC=N1,0.2651 | |
| CC(C)CC1CC2CC12,0.3321 | |
| CC1(CC#C)CCO1,0.2897 | |
| c1cc([nH]c1)CCCO,0.2422 | |
| CC1NC1C(=O)C1CC1,0.2188 | |
| CC12NC1CC2C1CO1,0.2981 | |
| CC1COC(=N)NC=N1,0.2337 | |
| CC1NC2COC12CO,0.2822 | |
| CC1=CC(=N)C=C(F)O1,0.2029 | |
| CCC(CN1CC1)C=O,0.2253 | |
| COC1COC2CCC12,0.3146 | |
| CC1(C)CC2OC(=O)C12,0.2772 | |
| CC1OC11CC(C1)C#C,0.3029 | |
| CC1C=CC2CC(=O)N12,0.2416 | |
| CC1CC2(O)C(C)OC12,0.3018 | |
| CC12COC(O1)C1CC21,0.3321 | |
| CNc1c(c(n[nH]1)O)O,0.228 | |
| C1C2(CO1)COCO2,0.3151 | |
| CC(O)C1=CCCC1C,0.2547 | |
| CC1CN1C1=CC=CO1,0.22 | |
| CCN1C(=N)C=CC1=O,0.173 | |
| CC1=CC2(CN2)C2NC12,0.2245 | |
| CC1CC2NC(=O)OC12,0.3072 | |
| OCCCC1CCCO1,0.3219 | |
| Cc1c(nn[nH]1)NC=O,0.224 | |
| C#CC(=O)COC(=O)N,0.2056 | |
| NC1COC2=NNN=C12,0.219 | |
| CC(O)(CO)C(F)(F)F,0.3254 | |
| CC1C2CC(=O)CCN12,0.2073 | |
| C#CCOc1c[nH]nn1,0.2243 | |
| C1OC2C3CC12CO3,0.2797 | |
| CCCCOC(=N)CO,0.2968 | |
| CCC1CCC(C1)C#N,0.3449 | |
| CC1CCC1(C)CCO,0.3385 | |
| CC1CCC=CC11CC1,0.2519 | |
| CC(CC#C)(C=O)C=O,0.1953 | |
| Cc1cnc(oc1=O)F,0.1953 | |
| CC1NCC(N)=CC1=O,0.1934 | |
| N#CC1C2C3CCC1N23,0.2741 | |
| CC1(C)OCC2CC12,0.3292 | |
| CN(C(=N)C#N)C(=O)N,0.1995 | |
| CC(CC=O)C(C)=NO,0.2282 | |
| CC1(C)NC1(CO)C#C,0.2683 | |
| OC(C#C)C1CCC1=O,0.2165 | |
| NC(=O)CC1CCC=C1,0.2639 | |
| CC(O)C(N)=NCC#C,0.259 | |
| C1C=CC2NC3C1OC23,0.2386 | |
| FC(F)(F)C1=NCCN1,0.235 | |
| CCC1CCCC=C1,0.2642 | |
| CC1OC=NC2CC12O,0.2479 | |
| N#CC1CCCCCN1,0.2679 | |
| C1CC1(CO)C#CC#N,0.2262 | |
| Cn1ccc(c1CO)N,0.2109 | |
| CCC1=CC(C)CC1C,0.2566 | |
| CCC1(CC(O)C1)OC,0.3188 | |
| CC1C2NC=NC12C#N,0.2445 | |
| c1cc(c(=O)oc1)C=O,0.161 | |
| Cc1c(cccn1)O,0.2113 | |
| CC(C)(C)C1(COC1)O,0.3085 | |
| CC1OC2C3OC3C2=C1,0.2263 | |
| CC1CC=CC(C)=CC1,0.1944 | |
| c1c(oc(n1)N)NC=N,0.1936 | |
| CC1N2CC1(C2)OC=N,0.2703 | |
| CC1OC(CC1=O)C#C,0.2167 | |
| C#CC1OCCCC=C1,0.2465 | |
| CCOC1(CC1O)C#N,0.2745 | |
| CCOCC1(CO1)C#C,0.2835 | |
| C#CC1=C(CCN1)C=O,0.1536 | |
| CCC(=O)C1OCC1C,0.2143 | |
| CC1(CO)C2NC2C1=O,0.2148 | |
| c1c(nncn1)C=O,0.1492 | |
| C1C2CC3CC3C=CC12,0.2523 | |
| c1cnn(c1CO)C=O,0.2068 | |
| CCC1(NC1C#N)C=O,0.2208 | |
| Cn1c(c(nc1O)O)O,0.2309 | |
| [NH2+]=CNCC1=N[N-]N=N1,0.1478 | |
| CC#CC(O)C1CCC1,0.285 | |
| OC12CC(C1)OC2,0.302 | |
| C#CC12OC1CC1NC21,0.2634 | |
| OCC(O)C1CC(O)C1,0.3144 | |
| O=C1CN=C2CC3C1N23,0.2093 | |
| C(c1c(c(n[nH]1)O)O)O,0.2254 | |
| C1C2OC3CCC3C12,0.3032 | |
| CCOCC1CO1,0.3407 | |
| c1c2n(nn1)C(=O)OC2,0.2284 | |
| COC12CC(C)C1C2C,0.3177 | |
| COCC1OC1CO,0.3345 | |
| COCC1CC1CC=O,0.2251 | |
| CC1N2CC2(C)C1=NO,0.2321 | |
| CC1CCC(C)C(=N)O1,0.2777 | |
| CCOC(=O)C#N,0.2473 | |
| N#CC1CNC1C1CN1,0.2673 | |
| CC(C)C1N=COC1=O,0.2422 | |
| Cc1[nH]nnc(=NC)n1,0.1667 | |
| CC12CC(CO)(O1)C2O,0.3207 | |
| CC(=O)c1ncnn1C,0.2013 | |
| CC12CC1C(CC#N)C2,0.2998 | |
| CC(C)(CO)C1CC1,0.337 | |
| C1CCC(C1)CC#N,0.3502 | |
| c1c(c(n[nH]1)O)C=O,0.2045 | |
| OC1CC(C1)C#CC=O,0.2038 | |
| CC1OC(=N)CCC=C1,0.2591 | |
| C#CC1(CCC1)N2CC2,0.2756 | |
| CC1C2C=CC(O)CN12,0.221 | |
| CCC(C)(C)COCC,0.3272 | |
| CC(=O)OC1CC1C=O,0.2271 | |
| O=C1C2OC2CC2OC12,0.2041 | |
| CC(=N)N1C=CCC1=O,0.2052 | |
| Cc1ncccc(=O)n1,0.1614 | |
| CC1(CCOCC1)C=O,0.2212 | |
| CC12C3CC1N3C2C#C,0.2619 | |
| C1C2N1C13CCC21OC3,0.2591 | |
| CC1N2CC2CNC1=O,0.2528 | |
| c1cc2n(c1N)CCN2,0.2274 | |
| OCCC1C2CC1(O)C2,0.3369 | |
| OCC1NC(C#C)C1O,0.2575 | |
| CC(C=O)C1CC1O,0.2049 | |
| CC1CCC(OC1)C#N,0.289 | |
| CC12CC(CC#N)(C1)C2,0.3379 | |
| CC12C3CC1CCC23,0.3293 | |
| Cc1ccn(n1)CC=O,0.2013 | |
| C1C2C3CCOC1C23,0.3231 | |
| NC(=O)C#CC(O)CO,0.2332 | |
| Cc1cnncn1,0.17 | |
| CC1=CCC2(CO2)C1=O,0.1861 | |
| CC12CC(C1)C=C2,0.2391 | |
| N#CC1CCC2CC2N1,0.2619 | |
| Cn1ccc(c1O)CO,0.2301 | |
| CC1(C)C2C3OCC3N12,0.271 | |
| CN1CC1CN1CC1,0.3075 | |
| C1C2OCCC3CCC123,0.3294 | |
| c1cnoc(=O)c1C#N,0.165 | |
| c1c2c(ncn1)non2,0.1622 | |
| CC12CCOCC1N2,0.3146 | |
| CC1C2CN2C1CCO,0.3097 | |
| C#CC12OCC1C1OC21,0.2528 | |
| c1c(c(c(=O)on1)N)F,0.1689 | |
| NC1=COC(=N)C(=N)O1,0.1853 | |
| CC12CC(N1)C2(C)C#N,0.2769 | |
| CCC12C(C)N3C1CC23,0.3046 | |
| CCC1CC(C)(O)C1=O,0.2164 | |
| CC(=O)CN1CC1C#N,0.231 | |
| COC1C2N3CC2(C)C13,0.3076 | |
| CC12OC(=O)C1C2O,0.2752 | |
| C1CNC=CC(=O)NC1,0.205 | |
| CCc1c(con1)N,0.2167 | |
| CCC1C2CC(C#C)C12,0.2982 | |
| CC1C2C3OC3(C)C12O,0.3139 | |
| CC1(N)C(C#N)C1C#N,0.2559 | |
| CC1=NC(=N)ON=C1F,0.1613 | |
| O=CC(C#C)C1COC1,0.2108 | |
| COCCC(C)C#N,0.3018 | |
| CC(O)C1(O)C2COC12,0.2935 | |
| C1C23CCC12OCO3,0.2977 | |
| CC#CCCC(=O)CO,0.2262 | |
| C1CC23CCC=C2CC13,0.2402 | |
| CN=COCC1(CC1)O,0.2449 | |
| CC([NH3+])C1=NOC=C1[O-],0.2144 | |
| CC12OC1(C)C1CC21,0.3257 | |
| CC(C#C)C1CCC1O,0.3138 | |
| N=C1OCC2C3CC1C23,0.2762 | |
| O=CC1(OC1C#N)C=O,0.1864 | |
| CN1C=NC2CCN=C12,0.22 | |
| CC1C=CCC1(N)C#N,0.2604 | |
| CC1CC2C3OC1C23C,0.3027 | |
| CC1C(O)C(O)C=C1C,0.2542 | |
| CC12COCC3CC1N23,0.316 | |
| c1c(nco1)C2CC2,0.24 | |
| CC12C3OCC1C=CC23,0.2291 | |
| CC1OC2OCC1C2=O,0.2073 | |
| OC1COC11CC(=O)C1,0.2156 | |
| CC12NC1C(O)C2C#N,0.2813 | |
| CCC12CC1C1OC21,0.2906 | |
| CC(C)COC(=O)CO,0.2744 | |
| OC12CCC1CC2C#N,0.2898 | |
| CC(O)COC(=O)C#C,0.2267 | |
| CCC(O)CC(=O)OC,0.2811 | |
| CCC1(N)COC1=O,0.2504 | |
| CCC12CC3C1C(C)N23,0.3122 | |
| O=C1NC2CCC2O1,0.3149 | |
| C1C2OC22CC1OCC2,0.3258 | |
| O=C1COC1C#C,0.2149 | |
| CC1C([NH3+])C1CC([O-])=O,0.2726 | |
| C1C2C3CC4C(CN24)N13,0.2815 | |
| C1C2COC3CCOC123,0.3196 | |
| C1OC2C3OC=NC2C13,0.2356 | |
| CCOCCCOCC,0.3348 | |
| OC1CC=C(C=O)C1=O,0.1611 | |
| OCCC1C2C3CC3N12,0.2779 | |
| CCC1CCOC(C)C1,0.3293 | |
| CCC1C2CCC1C=C2,0.2573 | |
| OCC#CC1CC1C#C,0.2584 | |
| NC1C2CC(O)C12C#N,0.2517 | |
| CC1NC(=[NH2+])C1C([O-])=O,0.1802 | |
| N#CC1CC2CCCC12,0.3291 | |
| Cc1cc[nH]n1,0.2689 | |
| O=C1CCCNC1C#C,0.1943 | |
| CC1CC2CN2C(=O)N1,0.2849 | |
| C1C2C3OC4C1C4OC23,0.2583 | |
| CC1OC2(CC12)C=O,0.2191 | |
| CC12C3OC3C1(O)C2O,0.2947 | |
| OCC1C(O)CN1C=O,0.265 | |
| CC1(O)CCCCC1O,0.3171 | |
| C1C2CCOC3CC3C12,0.3015 | |
| C1C=C(C(=O)O1)C(=O)N,0.1899 | |
| NC(C#N)C1=NC=CO1,0.2394 | |
| O=CC12C3C4C3C1CC24,0.2131 | |
| CC1OC1C1C2CCC12,0.3315 | |
| CCn1nc(nn1)C#N,0.2442 | |
| C#CCn1ncc(n1)N,0.2166 | |
| COC12CCC(CC1)C2,0.3156 | |
| CC1COC(C1)C(C)=O,0.2175 | |
| OC12CC1CC21CCO1,0.2961 | |
| CC12CN1C1(CC21)C#C,0.2426 | |
| COC1CCCCC=C1,0.2561 | |
| CC1(C)CC(N1)C#N,0.2695 | |
| Cc1cnc(nc1F)N,0.2021 | |
| CC(=O)C12COC1C2O,0.2204 | |
| C#CC1C2OCC=CC12,0.2349 | |
| O=CNC12CC3CC1C23,0.2635 | |
| COC1C2CC(O)C12,0.3215 | |
| CC1C2OC1C2CO,0.3031 | |
| CC1NC2(CC1C2)C#N,0.2665 | |
| COC1CCC1OC=O,0.279 | |
| CC12C=CCC1OC2=N,0.2551 | |
| CCNC12CC1OC2=O,0.2363 | |
| CC1CC2CCC(C2)C1,0.3606 | |
| OC1CC2OCC12O,0.305 | |
| CC#CCC(O)C#C,0.2731 | |
| CC(OCCC#C)C#C,0.2925 | |
| OCC1=CCC2OC2C1,0.2628 | |
| C1CC1NC(=O)CC=O,0.2205 | |
| OCCCOC(=N)CO,0.2967 | |
| Cc1c(=O)cnn(n1)C,0.179 | |
| CNC(=O)C1C2CCC12,0.2659 | |
| CC1(CCC1O)C#C,0.2941 | |
| C1C=CC2C3C4C(C13)N24,0.2381 | |
| c1c(nn[nH]1)NC(=O)N,0.2237 | |
| CN=C1OCC2C(C)C12,0.2673 | |
| C1COc2n1nc(n2)O,0.2485 | |
| CN=C1ON=CNC1=N,0.2003 | |
| C(C1CN1)C1=COC=C1,0.242 | |
| CN1C2CCC2=CC1=O,0.2068 | |
| CC#CCC1COC1C,0.2957 | |
| CC12CC1C(O)C2(C)O,0.3118 | |
| CC1OCCC(=O)CO1,0.2129 | |
| OCCC12CN1C1CC21,0.2911 | |
| CC(O)CC(=O)N(C)C,0.2667 | |
| CCCC1(CC1)COC,0.3308 | |
| O=CNC1CC1C=O,0.2247 | |
| CCNc1cc(oc1)N,0.2222 | |
| CC1C2N3C1C(=O)C23C,0.2338 | |
| c1nc(nc(=O)o1)CO,0.1885 | |
| c1c2c(on1)COC2,0.2295 | |
| CC1C=CCC(=O)C1O,0.2137 | |
| CC1(CC#C)CC1CO,0.3085 | |
| CCc1cc[nH]c1C,0.2397 | |
| CC1(CC(=[NH2+])N1)C([O-])=O,0.247 | |
| COCC(C)CCO,0.3312 | |
| C1CC12CC(=O)CC=C2,0.2168 | |
| COC1C2C(=N)OC12C,0.2729 | |
| OCC1(O)CC(C1)C#N,0.3021 | |
| CCc1c(c(n[nH]1)C)C,0.2528 | |
| CC12OC3C1C2OC3=N,0.2421 | |
| C#CC12C3CN4C(C13)C24,0.2532 | |
| C1CC11C2OCC3C2N13,0.3172 | |
| CC1CC2(C)OCC12C,0.3131 | |
| CC#CC12CC3C1N3C2,0.2631 | |
| C1C=CC23C4C5C(C24)C135,0.2157 | |
| C#Cc1cc(on1)N,0.2022 | |
| O1C=C2C=NC=C2C=N1,0.1497 | |
| CC(CC#N)C1(C)CN1,0.2869 | |
| [O-]C(=O)CC1CC2[NH2+]C12,0.133 | |
| OC1C2CC1(C2)C#C,0.2857 | |
| OC1CCC2C1C1CN21,0.2883 | |
| N#CC1C2CNC1CN2,0.2667 | |
| C1CC2OC(C1)C1NC21,0.2983 | |
| OC1CNC(=O)C11CO1,0.2521 | |
| CC(C=O)C12CN1CC2,0.2156 | |
| CCc1cocc1C#N,0.2199 | |
| OCC12C3C1C1CC3C21,0.3071 | |
| N=C1C=CC=NNC1=O,0.1617 | |
| OCCOC1CCC=C1,0.265 | |
| CC12N=COC1C2CO,0.2533 | |
| Cn1c(nc(=O)cn1)N,0.1873 | |
| NC(CCO)C(F)(F)F,0.3334 | |
| CN1CC(=O)C12CCC2,0.2007 | |
| OC1=C(O)N=CC(=N)O1,0.1315 | |
| CC1C2(O)CC2C11CC1,0.316 | |
| Cc1c(c[nH]n1)C#N,0.2404 | |
| N=CN1CC(=O)CC1=O,0.1947 | |
| Cc1cncoc1=O,0.1936 | |