Spaces:
Paused
Paused
| smiles,gap | |
| CCN1C2C3OC2C13,0.2855 | |
| c1[nH]c2c([nH]nc2n1)N,0.2103 | |
| COc1[nH]nc(n1)N,0.2472 | |
| CC(C)C(=NO)C(C)C,0.257 | |
| CC1C2CCC1(C)C2O,0.3312 | |
| O=COCC(C=O)C#C,0.2208 | |
| C1C23OC=NC12C1OC31,0.2144 | |
| c1cc(c(c(c1)N)N)N,0.2124 | |
| CC1(C#N)C2NC(=O)C12,0.2375 | |
| C1CC(C1)C2(CCC2)O,0.3196 | |
| CC12C3C4C(C14O)C23O,0.2827 | |
| Cn1cc(c(c1)O)O,0.2319 | |
| CC1CC(=O)COCO1,0.2179 | |
| Cc1[nH]c(cn1)CC#C,0.2416 | |
| COc1c2n(nn1)CC2,0.2255 | |
| Cc1c(c([nH]n1)O)NC,0.2534 | |
| N=C1OC(C#N)C2CC12,0.2745 | |
| c1c(c(oc(=O)n1)F)N,0.1559 | |
| CCNC(=O)C1CC1O,0.253 | |
| CCc1ccnc(n1)O,0.2147 | |
| CC1=C(NC=N1)C1CO1,0.2342 | |
| O=C1NC(C#N)C2CN12,0.2766 | |
| N=C1OCC2CC3C2N13,0.2712 | |
| CC(=O)C1CCOC1,0.2312 | |
| N=C1CC(=O)CN1C=O,0.1998 | |
| C#CCC1(CN1)C#C,0.2812 | |
| C#CCCN(C=O)C=O,0.2153 | |
| OC12C=CC3CC1C23,0.2367 | |
| Cc1c(c[nH]c1C#N)N,0.1862 | |
| CC1CC1(O)C1CO1,0.3239 | |
| CCC12OC3CC1CC23,0.3216 | |
| CC1CC=CCC11CO1,0.2686 | |
| FC1=NC(=N)N=C(F)O1,0.2361 | |
| C1C2CC3(CC4NC34)N12,0.3041 | |
| c1cn2c(n1)CCC2,0.2512 | |
| O=C1CCC2(CCO2)C1,0.2204 | |
| N1C=CN=CC=CN=C1,0.1777 | |
| COC1OC(=O)C=C1C,0.2229 | |
| CC12CC(C)(C1)OCO2,0.3247 | |
| OC12COC1C(=O)C=C2,0.1748 | |
| CC12CN1CC1OC21C,0.2948 | |
| OC1C(O)C2OCOC12,0.2931 | |
| CC1C2CC2C2COC12,0.318 | |
| Cc1c(c(n[nH]1)C)C=O,0.2071 | |
| CC12CC(C1)C2C(N)=O,0.2664 | |
| CC12CC3NC3(C)C1N2,0.3203 | |
| C#CCc1cc[nH]c1N,0.2363 | |
| c1nc(nnn1)O,0.1675 | |
| CC(O)C(CCO)C#N,0.3117 | |
| C#CCC1(CC1)C#N,0.3005 | |
| NC1=CC(=O)C2CC1O2,0.187 | |
| CC12CC(O)C(O)C1N2,0.2874 | |
| CC1OCC(C)(C)C1O,0.3045 | |
| CC1NC1(C=O)C1CC1,0.2186 | |
| C1CC(=NCCO)OC1,0.2596 | |
| CN1CC(O)C1=O,0.2678 | |
| N=C1NN=CN=CC1=O,0.1412 | |
| OCC12C3C4CC1C4N23,0.3057 | |
| CC(C)C12CC1(C)CO2,0.3027 | |
| c12c(n[nH]c1[nH]nn2)N,0.2007 | |
| OC1C(COC1=O)C=O,0.2273 | |
| COC(=O)CCC1CO1,0.2829 | |
| C1C2CC(C12)C1CCO1,0.3256 | |
| C1CC2CCC3OC23C1,0.3296 | |
| CC12OC3C4C(CC14)C23,0.3183 | |
| CC12CC1C1OCC1C2,0.3155 | |
| CCN=C1N=CNN=N1,0.165 | |
| N=CN1CC1(C=O)C#C,0.2102 | |
| CN(CCOC=N)C=O,0.2678 | |
| CC(O)C1N2CCC12C,0.2966 | |
| CC12C3C(N=CN13)C2=O,0.1988 | |
| CN1CCCC(O)C1=O,0.2605 | |
| c1cn(cn1)C=O,0.1969 | |
| OC1C2CC1C21CO1,0.312 | |
| C#CC1OC2CC1CO2,0.2836 | |
| COC1C2OC(=O)OC12,0.3065 | |
| CC1C2N3CC3C12C#N,0.2467 | |
| N#CC1CC2C3CC2C13,0.3425 | |
| C1C2C3C=CC1C1C3N21,0.2453 | |
| O=CCC12CC1CC=C2,0.2141 | |
| COC1CC2C(O)C2O1,0.2961 | |
| CN=COCCOC,0.277 | |
| N#CC1CC(C1)C#N,0.3194 | |
| OCC1OC(CO)C=C1,0.2413 | |
| O=COC(CC#N)C#N,0.2801 | |
| c1c(nc(c(n1)N)O)F,0.1748 | |
| CN1CC(=N)N(C)C1=O,0.2435 | |
| CC1NC1(CC=O)C#C,0.2179 | |
| O=C1CCC2OCC2O1,0.2734 | |
| CC1(C)CC(O)C2CN12,0.2972 | |
| CC1(O)C2C3NC3C12,0.2729 | |
| C(CO)c1c(non1)N,0.2122 | |
| OCC1NCC1=O,0.2163 | |
| CCC1OC(=NC)C1C,0.278 | |
| OCC1CCN2CC2C1,0.2891 | |
| CC12C3C4CC1(O)C2C34,0.2837 | |
| CC1COCC=C1C#C,0.2108 | |
| CC1CC2(CC2O)C1O,0.3049 | |
| CN=COc1cocn1,0.2198 | |
| CC(=O)C1(CN1)C#N,0.2327 | |
| ON=C1C2C3CC1CC23,0.2498 | |
| CC12OC(=N)C1C1NC21,0.2693 | |
| C#Cc1ccnc(c1)F,0.2052 | |
| O=C1C2COC2C11CO1,0.1954 | |
| CC(=O)NCC(=O)C#N,0.1629 | |
| OC1C2CN2C(=O)C1=O,0.1487 | |
| O=C1OCC2C(C#C)C12,0.2619 | |
| CCc1c(nn[nH]1)OC,0.2172 | |
| C#CC(=NO)CC1CC1,0.2065 | |
| OC12CC1C(O)(C2)C#N,0.2886 | |
| c1[nH]c(c(n1)N)O,0.2385 | |
| NC1=C(O)N=NNC1=O,0.1578 | |
| CCN1CC(N)C1C#N,0.2544 | |
| CC(=O)n1nc(nn1)O,0.1994 | |
| CCC1(O)COC1C#C,0.2703 | |
| c1c([nH]cn1)C2CCC2,0.2454 | |
| OC1CCCC11CCO1,0.2995 | |
| CC(C)C1C(C)C1(C)O,0.3095 | |
| CC1=CC(C)(O)CC1=O,0.1954 | |
| CC1C2(O)CC1(O)C=C2,0.2401 | |
| C1CC2OC1CC1OC21,0.3279 | |
| C1CC23OC2CNC3=N1,0.2422 | |
| CC1=C(C)C(CO)CC1,0.2534 | |
| CC1(C)CC1C1CCC1,0.335 | |
| c1coc2c1CC=C2,0.1794 | |
| CC1=C2NCC2OC1=O,0.2003 | |
| CC12C3C4C=C1CC4N23,0.1222 | |
| CCC1(NC1C#C)C#C,0.2544 | |
| CC12CC3C(O)C(C1)N23,0.2804 | |
| CC1(CN1)C1=CC=CO1,0.2297 | |
| C1C(CO1)(C(=O)N)N,0.2625 | |
| CC(C=O)C1NC1C=O,0.2214 | |
| C#CC1NC1CC1CC1,0.28 | |
| OC1C2C1C1OCC21,0.3043 | |
| CN=C1OC(C)CC1C,0.2721 | |
| CC1CN=C(C1)OC=O,0.2426 | |
| OC1CC11CC2CC12,0.3043 | |
| COC1OCC=CC=C1,0.1916 | |
| OCC12CCC3C1CC23,0.3369 | |
| OC1C2C3CC1CN23,0.3027 | |
| CC12OC3(C)C1CC23,0.3192 | |
| CC12CC3(C)C1CN23,0.3202 | |
| OCC1=NON=NC1=N,0.1754 | |
| CN=C1OC(C)OC1=O,0.1974 | |
| CC12CN1C(=O)C1CC21,0.2352 | |
| CNc1c(n[nH]c1O)N,0.2542 | |
| Cc1ccc(c(=O)[nH]1)F,0.1774 | |
| CC12NCC1C2(N)C#N,0.2661 | |
| CC12NC3C(C1=O)C23O,0.2275 | |
| ON=C1CC2C(O)C12,0.2438 | |
| OC12COC1C1COC21,0.2875 | |
| CCc1ccccc1,0.241 | |
| CC1NC(=O)C1(N)C#C,0.258 | |
| CC12C3CC1(CN23)C#C,0.2619 | |
| CC1COC(=N)C2NC12,0.2637 | |
| CCC1C2COC(C)C12,0.3229 | |
| OC1C2CC1(O)CC2O,0.3162 | |
| CN(C)C(=O)NCC#N,0.2646 | |
| C(C#N)N=C(C#N)N,0.2242 | |
| CC#CCc1cc[nH]c1,0.2504 | |
| CC12C3CC1(NC23)C#N,0.2522 | |
| FC(F)(F)C1(CN1)C=O,0.2263 | |
| CC12C3CC=C1COC23,0.1997 | |
| O=C1OC2COC12C#N,0.2354 | |
| c1c[nH]c(=O)cc1F,0.1857 | |
| CC12CC3(C)C1CC23O,0.3177 | |
| O=CC(CN1CC1)C#C,0.2128 | |
| O=C1C2CC3(C2)OCC13,0.222 | |
| N=C1NC=NC11COC1,0.2194 | |
| CC(O)C1CNC(=O)O1,0.3134 | |
| c1c-2n[nH]nnc2cn1,0.1295 | |
| CN=C1OCC2C1N2C,0.251 | |
| CC(C#N)N1CCC1,0.2676 | |
| CC1OC11C2NC1C=C2,0.2233 | |
| CCC1(CCO1)C(C)=O,0.2159 | |
| CC1NC(=O)NC1(C)C,0.306 | |
| CC(=O)N1CC(C1)(C)C,0.2684 | |
| CCC(=O)C1(CN1)C#C,0.2241 | |
| CC(=O)C(C)(C)CC#C,0.2284 | |
| COC1CC2CC2(C)C1,0.3268 | |
| CNC1(CC1)C(=O)C#N,0.1586 | |
| C1N2C3CC4CC2C13C4,0.291 | |
| O1C2C1C1OC21,0.2955 | |
| CCn1c(c(nn1)O)O,0.2194 | |
| O=C1NCCC2OCC12,0.2636 | |
| O=C1C2C3CC1(C#C)N23,0.2257 | |
| OC1CNC2=C1N=NN2,0.2214 | |
| CC1C(O)C1([NH3+])C([O-])=O,0.2672 | |
| c1c(c(n[nH]1)C#N)C#N,0.2319 | |
| OCCC1(CO)CN1,0.3116 | |
| CC1OC1C1=NNC=C1,0.2497 | |
| CC1C2C3CN3C12C#C,0.2386 | |
| CC1CCC2C3CC3C12,0.3149 | |
| C1CC2CCC=CC2=C1,0.1948 | |
| C1C2CCC3OCC1C23,0.3086 | |
| OC1CC(=O)CC11CC1,0.2186 | |
| C1C(CC(=O)C1=O)CO,0.1429 | |
| CCC(C)C1(C)CC1O,0.3301 | |
| COC(C=O)C1CC1O,0.2114 | |
| CN=C1COC(O1)C#C,0.2705 | |
| C1CC1C(=O)C(=N)N,0.1845 | |
| CC1CC(C)(C1)OC=O,0.2764 | |
| OC1CNC2C1OC2=O,0.2368 | |
| CN=COCCC1CC1,0.2728 | |
| Cc1ccc(nc1)O,0.2063 | |
| O=CC1CN=C2OCC12,0.2143 | |
| C1NC11CCCC2NC12,0.2989 | |
| C#CCCN(C=N)C=O,0.226 | |
| OC12CC3C=CC(C1)C23,0.2524 | |
| CN1C(CO)C1C#N,0.2595 | |
| CC1CN1C1(C)CC1C,0.2998 | |
| CN=CNC(=NC)C#N,0.1826 | |
| COC12CC3C1C(C)C23,0.3388 | |
| C1C2C3C2C2C1OC32,0.3092 | |
| Cn1cc(nc1O)N,0.2299 | |
| CCN1CCCC(=O)C1,0.2048 | |
| O=C1C=CC2C3CC12N3,0.1734 | |
| CC(=O)C1(C)COC1=N,0.2259 | |
| C1C2CC3CCC2C13,0.3663 | |
| CCCC(=O)N1CC1C,0.2562 | |
| CC1OC1C#CC#C,0.2149 | |
| C#CC1CC(C1)C#N,0.2891 | |
| CC1(O)C2CCC12CO,0.3017 | |
| CCC12CC1CC2(C)O,0.3086 | |
| CC1(C)OC1(C=O)C#N,0.2139 | |
| CC(C)OC(C)CCO,0.3191 | |
| CC1OC2C3NC3C12C,0.2937 | |
| c1c(c(oc1N)O)N,0.2141 | |
| NC(=O)C1N=CN2CC12,0.2258 | |
| CCCc1cc(c[nH]1)C,0.2412 | |
| N=C1NC(=CO1)C1CC1,0.2183 | |
| CC(=O)C(C#C)C#N,0.2216 | |
| CC1CC2CC1COC2,0.3203 | |
| CCC12NC(C=C1)C2=O,0.2454 | |
| O=C1CC2CC2C=CN1,0.2083 | |
| COCCCCOC=O,0.2695 | |
| CC1=NC2CCC2(C)O1,0.2639 | |
| CC12CC1C1C=CCC21,0.2626 | |
| C1CC1(C#N)C(=O)C#N,0.208 | |
| N#CC1CC2(CN2)C1,0.2865 | |
| CC1CC(C1)C1CC1O,0.3303 | |
| OC1=C(F)N=CC(=N)O1,0.1442 | |
| NC(C(N)=[NH2+])C([O-])=O,0.2317 | |
| Cn1cnc(c1O)C=O,0.1984 | |
| OC12CCOC1C1OC21,0.2889 | |
| CNc1c[nH]cc1O,0.23 | |
| CC12OC1(CC2=O)C=O,0.1926 | |
| CC(CC#C)C(C)(C)O,0.3083 | |
| CC1CC2CC(=O)C2C1,0.2155 | |
| CN1CC2CCC(=O)C12,0.1951 | |
| CC1(CC(=O)C1)C2CC2,0.2208 | |
| CC1CC=CC2OC2C1,0.254 | |
| CCC#CC(=O)NCC,0.2337 | |
| CC1(CN1)C(=NO)C#C,0.204 | |
| CC12C3OC1CC(=O)C23,0.2228 | |
| CC1(C)OCC1(C)C#N,0.286 | |
| CC1CC1C(=O)C=O,0.1563 | |
| CCN1CC1C1CC1C,0.3015 | |
| COCC1C(C)C2CN12,0.3042 | |
| C1OCC11C2CC1OC2,0.3131 | |
| CC12CN1C(=O)NC2=O,0.2355 | |
| CN=CN(C=O)C(=N)N,0.2129 | |
| CC1C(C=CC1=O)C#N,0.1903 | |
| C#CC12CCOCC1O2,0.2757 | |
| CC1OCC(N)C(=O)O1,0.259 | |
| CC12COC(CC1O)O2,0.3137 | |
| CNC(=O)COCC#C,0.2651 | |
| CC(C)CCN1CC1,0.3142 | |
| Cc1cc(oc1NC)C,0.212 | |
| N=COC12CN(C1)C2,0.2721 | |
| OC1=CC=CC(=N)N=C1,0.1441 | |
| CC#CC(CO)C(C)O,0.292 | |
| C(C#CC(=O)N)NC=O,0.2292 | |
| N#CC1OC23CN(C2)C13,0.2363 | |
| O=C1NC2C3CC(C3)C12,0.2734 | |
| OC1C2C3C4C=C1C2N34,0.18 | |
| O=C1OC2C3C=CN1C23,0.2155 | |
| CC(CO)CC1CCO1,0.3198 | |
| CCC1C2C(O)C2C1=O,0.2245 | |
| C1CC11CCOC2CC12,0.3177 | |
| OCC1=CC2C3C1CN23,0.2279 | |
| c1cncc2c1non2,0.1638 | |
| O=CC1NCCNC1=O,0.211 | |
| OC12CC1(O)CCC2,0.297 | |
| CCN(C=O)C(C)C#N,0.2719 | |
| CCCC(=O)C(C)OC,0.2292 | |
| CC1(CN1C(N)=O)C#N,0.2812 | |
| NC(=O)C1C2CC(=O)C12,0.2281 | |
| CC1(CO1)C(O)CC=O,0.2237 | |
| CC1OCC(C=O)C1O,0.2237 | |
| OC(CN1CC1)C1CC1,0.294 | |
| CC1CC(C1)C(=O)CO,0.2374 | |
| C(=O)Oc1c([nH]nn1)O,0.2278 | |
| c1(nnc2n1nno2)N,0.1616 | |
| CC(C)N1CC2(C1)CO2,0.293 | |
| O=C1C2CC1C2CC#N,0.2517 | |
| CCC12OC3CC1C2O3,0.3284 | |
| OCC(=O)C1CCOC1,0.2279 | |
| CC1OC(C=O)C=C1,0.203 | |
| CC1C2OC=NC12C#C,0.2465 | |
| CCC1C2OC1C2C=O,0.2037 | |
| O=C1CC=CC1C1CN1,0.2169 | |
| O=CN1CC2NC2C=C1,0.2041 | |
| N#CC12CC3OC3C1N2,0.2771 | |
| C#CCOCC1CO1,0.2888 | |
| CC1CC(C=C1)C(C)=O,0.214 | |
| OC1C=CC2OC12C#C,0.2271 | |
| CC1C2CC1C(C)C2C,0.3638 | |
| CC1OC(C2CC2)C1C,0.3204 | |
| N=C1OC2C3CC12CO3,0.2635 | |
| NC1=NOC(=N)C(=N)O1,0.1876 | |
| CC1(CCCC1O)C#C,0.3123 | |
| CC1C2OC3(CC3)C12,0.3036 | |
| CCC12OC(C=C1)C2C,0.2324 | |
| O=CC(=O)C12CCC1N2,0.1585 | |
| CC1C(O)CCC1=NO,0.2488 | |
| N=C1OC2C3C4NC13C24,0.2603 | |
| CCC12CN1C(C2)C=O,0.2158 | |
| N#CC1OCOC1C#N,0.2882 | |
| N=C1OC2OCC3C2C13,0.2789 | |
| COC1CC11COCO1,0.3006 | |
| COC1(CO)CCCO1,0.3181 | |
| CC(=O)CNC(=N)C=O,0.1723 | |
| C1OCC2NC12,0.3149 | |
| O=CC12C3C4OC1C4N23,0.2182 | |
| c1c2c([nH]n1)OCOC2,0.2484 | |
| OCC(CC#N)C=O,0.2249 | |
| CC1=CC2C3CC2(C1)O3,0.2384 | |
| C1C(CN1)(CC#N)C#N,0.2653 | |
| CC(C)(CNC(=O)N)O,0.2957 | |
| CC(O)C#CC(C)C#C,0.2852 | |
| C#CC12CC1C(O2)C#N,0.2374 | |
| COC1CCC(O1)=NC,0.2757 | |
| OCC12CCN3CC1C23,0.2986 | |
| N=C1COC(=O)O1,0.281 | |
| C1C2CCC3CCCC123,0.3361 | |
| c1cc(cc(c1)F)O,0.223 | |
| CC(C)C(C)(C)C(C)O,0.3283 | |
| CC1NC11C2C3OC2C13,0.3051 | |
| CC1OC2CC12CC=O,0.2074 | |
| CC1OCC(CC#N)O1,0.305 | |
| C#Cc1c[nH]cc1N,0.2031 | |
| OCC1CCC2OC12,0.3342 | |
| CN1C2CCC1C2=O,0.2375 | |
| CC1OC(=N)C11CCO1,0.2611 | |
| CC12C3CC1OC2CC3,0.3131 | |
| OC1(C=O)C2NC(=O)C12,0.194 | |
| O=CC1CCC1C#C,0.2234 | |
| CC1C2N3CC3C12C=O,0.2095 | |
| c1c2c(co1)C=CC2,0.2001 | |
| CCOC=NCCC=O,0.2234 | |
| c1c(onc1OC=O)N,0.2183 | |
| COCC(C)(O)CC#N,0.3106 | |
| CC(C)Nc1n[nH]nn1,0.2046 | |
| CC12CC3C1N3C2,0.314 | |
| OC1C2CC2C1C1CC1,0.3132 | |
| CC(C)CCOC=NC,0.2728 | |
| CCN1C2CC2C1C#N,0.2415 | |
| Cc1ccc(=O)[nH]c1C,0.1704 | |
| CC1OC2CCC2=C1,0.2362 | |
| CNC1(COC1=N)C#C,0.2477 | |
| CC1CCC(C1)C=O,0.2293 | |
| CC12CC1C1(CC1O)C2,0.3086 | |
| COC1C(CC1=O)C=O,0.2015 | |
| CCc1ccc(nc1)O,0.2065 | |
| CN=C1OC(C)C1(C)C,0.2816 | |
| c1nc2n(n1)CC2,0.2752 | |
| CC#CC1C2CN=CN12,0.2267 | |
| CCOC1(CC1O)C#N,0.2745 | |
| CC1CC(=O)NC(C)=N1,0.2366 | |
| COC1CC2C1NC2=O,0.2693 | |
| CC12C3C(C=O)C1CN23,0.2255 | |
| CC1OC2CC2C(C)O1,0.3308 | |
| NC(=O)N1CCC1=N,0.2466 | |
| C#CC12OC(C=C1)C=C2,0.2018 | |
| C(=O)c1c([nH]c(=O)[nH]1)N,0.1634 | |
| O=C1CC2NC2C11CC1,0.2265 | |
| Cc1cc(=O)ocn1,0.1981 | |
| N#CCCC1CCOC1,0.2924 | |
| CN1CCNC1=O,0.295 | |
| CNc1c(cc([nH]1)N)O,0.2243 | |
| CC1CCCC11CO1,0.3293 | |
| CCC1(CC1)C(F)(F)F,0.3821 | |
| N=C1COC(=O)OCO1,0.2728 | |
| OCC1CN1C(=O)C#C,0.2139 | |
| CC(CCC=O)C#N,0.2278 | |
| N#CCC1C2CC1OC2,0.283 | |
| N=C1NC=NC(=N)C=N1,0.1721 | |
| CN(C=O)C12CN(C1)C2,0.2701 | |
| COCC(C)C(=O)CO,0.2321 | |
| CCOCC1CCC=C1,0.264 | |
| CC(O)C12CCCC1O2,0.3202 | |
| CN(C=N)c1cocn1,0.2051 | |
| ON=C1C2C3C=CC1N23,0.2009 | |
| CC1=C(C(=O)CNC1)C,0.1682 | |
| CCCC(O)(CC)C#N,0.3111 | |
| COCC1(O)CC(C)C1,0.3262 | |
| N#CC1CC1C1CN1,0.2747 | |
| CCNCC(O)C#N,0.28 | |
| CC1(O)C2CC1C2C#C,0.2797 | |
| CN1CC(C1)NC(=O)N,0.2734 | |
| O=C1NC2C3CN(C3)C12,0.258 | |
| CC#CC1(CC1)OC=N,0.2635 | |
| c1cc(n(c1)C2CC2)N,0.2267 | |
| CC#CC1=COC(=N)O1,0.1894 | |
| NC(=O)C1CC(C1)C=O,0.2257 | |
| CC1C2CCC1OC2,0.3128 | |
| CC12CC1C1CN1C2=O,0.2361 | |
| c1cnc(c(c1F)O)O,0.2132 | |
| CCC1CC(=O)OC=N1,0.2491 | |
| OCCC1OC1CO,0.335 | |
| C1CC1(CC=O)O,0.2209 | |
| C1CC2(OC12)C1COC1,0.3246 | |
| CC1N2C3CC2C1(C)C3,0.3068 | |
| C1CN1C(=O)CC=O,0.2213 | |
| OC1(C=O)C2OCOC12,0.2039 | |
| CC1(C)OC2CC12C#C,0.264 | |
| ON=C1CC(C1)OC=O,0.2469 | |
| CC(CO)C1C(C)N1C,0.2852 | |
| C1C2C1C1COC3C2C13,0.2994 | |
| c1c(nnc(n1)F)C#N,0.1654 | |
| CCC1=CC(OC1)C#N,0.2532 | |
| CC1C2CC3N2C13C#N,0.269 | |
| C1C2C1C1OC3C2OC13,0.2983 | |
| CC12CC3C(C1)C23C#N,0.2742 | |
| CC12C3OC4C(C13)C24C,0.312 | |
| CC12COC(C#N)C1N2,0.2764 | |
| NC(=O)C(C#C)C1CO1,0.2647 | |
| COc1cocnc1=O,0.2017 | |
| OCC1CCC2OC2C1,0.3316 | |
| OC1CC(O)C2CCC12,0.3172 | |
| c1cnc-2[nH]cncc12,0.1555 | |
| c1coc(=O)n1CCO,0.2378 | |
| CC1=NON=NC1=N,0.176 | |
| c1cnc(cn1)N=CN,0.1757 | |
| CC(O)CC1=CC=CN1,0.2386 | |
| Cc1cn[nH]c1OC,0.2523 | |
| O=CNCC1C2CC1O2,0.2563 | |
| CC1CNC1(C=O)C#N,0.2072 | |
| CC12CN3C1C(C=O)C23,0.2044 | |
| CC1CN(C)CC(=O)O1,0.2468 | |
| CCC(=O)C(O)C#CC,0.2193 | |
| CC1(CC(O)C1)N1CC1,0.2998 | |
| COC1C2CC3C2OC13,0.3049 | |
| O=C1N2C3CC4C(C23)N14,0.2363 | |
| COC12CN3C1C(C)C23,0.3207 | |
| O=C1CN2CCC2C=C1,0.1557 | |
| N=COC1(CCC1)C#C,0.2776 | |
| C1C2N1C13CC21OCC3,0.2573 | |
| CC1=CNCC=CC1=O,0.1622 | |
| CN1C2CC1C2(O)C#C,0.2356 | |
| C1C2C3OC1C1OC1C23,0.3163 | |
| COCC1OCC(=N)O1,0.2926 | |
| CC(C)COCCOC,0.3356 | |
| O=C1CC2NC1C2C#N,0.2092 | |
| OC1CC2CN3C2C13,0.2904 | |
| NC1=NN2C3CC3C2=N1,0.202 | |
| c1c(nc([nH]1)N)OC=O,0.2126 | |
| CC12C3C(CCN13)C2=O,0.2201 | |
| C(C#N)N,0.2855 | |
| CC(=O)c1ccnn1C,0.2039 | |
| CNc1ncc(o1)OC,0.2268 | |
| OCC1C2CN1C2,0.3099 | |
| OC12CC1(O)C=CCC2,0.2401 | |
| OC12CC1C1(NC21)C=O,0.1876 | |
| N=CN1CC2CN2C1=O,0.2355 | |
| CC1=CCCNC1=O,0.2135 | |
| CN1C2C3NC2(CO)C13,0.2676 | |
| CC12CC1CC2CCO,0.3246 | |
| C(C#N)C(=O)C#CC#N,0.189 | |
| CC(OCC#C)C#N,0.2735 | |
| CC1(CNC(=O)N1)C#N,0.2788 | |
| C#CC12C=CC3C1CN23,0.2054 | |
| C1C(CO1)C(C=O)C=O,0.2004 | |
| CCCC(C)CO,0.3411 | |
| CC(O)C12CC1OC2,0.301 | |
| CC(=O)C1CC(C1)C=O,0.2219 | |
| C1CC11CC2OC3C2C13,0.305 | |
| OC1CC2C3CC1C23O,0.3094 | |
| C#Cc1cocc1C=O,0.1869 | |
| CCN=C1NC2COC12,0.2411 | |
| CCCC1C(C)CC1O,0.3155 | |
| CCN1CC1CCCO,0.2989 | |
| CCc1cnc(nn1)F,0.1659 | |
| c1cc(=O)c(=O)onc1,0.1584 | |
| OCCC(CO)C1CC1,0.3334 | |
| COC1C2CC3CC2C13,0.3339 | |
| CCNc1[nH]c(=O)on1,0.2599 | |
| CCN1C2CC1(C)C2O,0.27 | |
| COC1(C)OCCC1O,0.3352 | |
| CCCNC(=O)CC#N,0.2781 | |
| COc1conc1C=O,0.1805 | |
| CC1(CO)C2CC1C2=O,0.252 | |
| CC1CC(=O)O1,0.2861 | |
| CC12CN3C(C13)C(=O)C2,0.2142 | |
| O=C1OCC11COC=N1,0.2497 | |
| CC(=NC)NC(=O)C,0.232 | |
| CC1OCC1C(C)(C)O,0.3211 | |
| CCc1cnoc1N,0.2244 | |
| c1c([nH]c(=O)c(=O)o1)N,0.1675 | |
| N=C1NC2CC2NC1=O,0.197 | |
| CCc1[nH]cc(n1)C#N,0.2276 | |
| CC(CC#CC#N)C#C,0.2338 | |
| C(COC=NCC=O)O,0.2215 | |
| COC1C2NC1C2O,0.3043 | |
| CC1C=CC2C3OC1C23,0.2376 | |
| OC(C#N)C1=CN=NN1,0.244 | |
| OC1C=CCC2CCC12,0.2588 | |
| Cc1cnc(o1)CO,0.2377 | |
| N#CC12CC3C4C(C13)N24,0.2614 | |
| c1coc(c1C#N)C#N,0.189 | |
| C1CC(=O)C=CC=C1,0.1693 | |
| C1C2CN1C1=NON=C21,0.2388 | |
| COC(C)C1OCC1C,0.3118 | |
| O=CCC1C2C=CC1C2,0.216 | |
| Cc1cc2n(n1)C=CC2,0.1989 | |
| C#CCC(=NO)C1CC1,0.2429 | |
| O=C1CCC(CO1)C#C,0.2704 | |
| CC12C3C1C1C3N2C1=O,0.2271 | |
| CC12C=CCC1C2O,0.2327 | |
| CN1CC1C1=CC=NO1,0.2128 | |
| CC(O)C1(C)CN2CC12,0.2919 | |
| C#CCC(=O)NCC=O,0.2202 | |
| CCC(C)OC(=O)C#C,0.2374 | |
| CCc1c(oc(n1)O)C,0.2386 | |
| CC(O)CC1CCC1,0.3278 | |
| OC12CC(O)(C1)C1OC21,0.3202 | |
| C#CC(=O)OC1CCC1,0.2368 | |
| C#CCNC1(CC1)C=O,0.2102 | |
| C(C(CO)(C=O)C=O)O,0.2048 | |
| CC(O)C1C(O)C1O,0.2829 | |
| C1C2C3OCC=C3CN12,0.2397 | |
| COCC1CCC11CO1,0.3316 | |
| NC1=NC2CC(O1)C=C2,0.2193 | |
| Cn1c(cnn1)C#N,0.2234 | |
| CC1(COC(=N)N1)C#C,0.2614 | |
| CCc1cc(c(o1)N)C,0.2283 | |
| C#CC12C3CC1CN2C3,0.2351 | |
| CC12C3CC1C3C2C=O,0.2181 | |
| CCC(=N)N(C)C(=O)C,0.241 | |
| COC(=O)N1CC1C#N,0.2797 | |
| OCCCC(C#C)C#N,0.2872 | |
| N=C1NCCOC1=O,0.1981 | |
| CC1C=C(C)C2C(O)C12,0.2324 | |
| OCC(O)C1=CN=CO1,0.2375 | |
| CC1CC1C1=COC=C1,0.2391 | |
| CCC(OC(C)C)C#C,0.298 | |
| CC12CC1OC1COC21,0.3023 | |
| Cc1coc(=O)c(=O)[nH]1,0.1764 | |
| CNc1nc(on1)C#N,0.1724 | |
| N#CC1=C2CCC2CC1,0.2073 | |
| CC(O)CC1=CN=CO1,0.2416 | |
| CC1(CO)CC(C1)=NO,0.249 | |
| CC1=NNC(=N)C(O)=N1,0.1677 | |
| OC1CC2(OC12)C1CC1,0.3207 | |
| NC(=O)OC(=N)CCO,0.2616 | |
| CC1C(C)C1(N)C#N,0.2975 | |
| CN1C2C3C4OC2C1C34,0.3127 | |
| OCC#CC1OCC1=O,0.2119 | |
| CCC1NC(=O)C(C)=C1,0.2217 | |
| OC1C2C3C1C(O)C23O,0.3099 | |
| NC1C2NC=NC12C#N,0.2291 | |
| CC(=O)N1CC(O)C1=O,0.2166 | |
| CC1C(NC1=O)C=O,0.2144 | |
| CN1C(COC1=N)C#N,0.2504 | |
| c1c(=O)c(c([nH]n1)N)N,0.1696 | |
| CCc1ccoc1C#N,0.2049 | |
| FC1=NOC(=N)NC1=N,0.1884 | |
| CCn1c(cc(n1)O)C,0.2375 | |
| OCC1(NC1C#N)C#N,0.2624 | |
| NC(=[NH2+])OCCC([O-])=O,0.285 | |
| N=C1C=NNN=N1,0.1763 | |
| CC1CCC=CC1O,0.2625 | |
| C1C2CC11CCCOC21,0.3337 | |
| c1cnn(c1)C(=O)C#N,0.1897 | |
| C1OC11CN2CCC12,0.2826 | |
| c1c(ocn1)C(F)(F)F,0.2455 | |
| OC1CC2NC12,0.3133 | |
| OC1C2CC3(CC3)OC12,0.304 | |
| CCC1=CC2OC2CC1,0.2355 | |
| COC1CCOC1=N,0.2691 | |
| CC#CC12OCC1C2C,0.2433 | |
| OCC12NC1CC2C#N,0.2836 | |
| CC(O)CN1C=CC=C1,0.2433 | |
| Cc1c(c([nH]n1)OC)N,0.2501 | |
| C1C2C1C1OC2C2OC12,0.3321 | |
| Cc1coccc1=NC,0.1883 | |
| CC(O)C1(CN1C)C#N,0.272 | |
| CN=C1OC=NC(O)=C1,0.1704 | |
| OC12CC3C(NC13)C2=O,0.2037 | |
| OC1(CNC1=O)C=O,0.2016 | |
| COC(CN)(CO)C#N,0.2595 | |
| CC1(C)CC2C3OC2C13,0.2939 | |
| C#CC1=CC2(CN2)CC1,0.1929 | |
| CC(CO)C#N,0.3246 | |
| CC1CC1(C#N)N1CC1,0.2798 | |
| C1C2=CC3C=C1C1C2N31,0.0835 | |
| CC1(OC(=O)C=C1)C#C,0.2216 | |
| CC1C2CC2(O)C=C1C,0.2366 | |
| OC1=COC(=N)C(O)=N1,0.148 | |
| OC1C2C3NC1C23C#N,0.2519 | |
| CN(C)Cc1conn1,0.1919 | |
| CCC1(NCC1=O)C#N,0.2136 | |
| O=C1CC(CC2CC2)O1,0.2856 | |
| C1CC12CCOCC2,0.3255 | |
| OCC(=O)C1CN2CC12,0.2094 | |
| Cc1cc(oc1N)NC,0.216 | |
| CNC(=O)OCC1CN1,0.2937 | |
| C1CC1CC(=O)N,0.2738 | |
| CC1(O)C2C3C2C(=O)C13,0.2414 | |
| CC(C=O)C1CNC1=O,0.223 | |
| OC1CN2C3CC1C23,0.2974 | |
| C#CC1NC1C1COC1,0.2756 | |
| CC1C2C3COC2C13O,0.2995 | |
| CCC12NC1CC2(C)O,0.2956 | |
| C1C2OC34CC3(CC4)C12,0.2927 | |
| CC1(O)CCC1(O)C#C,0.2764 | |
| NC(=O)C12CC3C(C1)N23,0.2681 | |
| CCC1(CCCN1)C#N,0.2823 | |
| C1C(=CC(=O)CO1)C#N,0.1566 | |
| c1cn(c(c1N)N)C=O,0.172 | |
| CCC1=CC(C)OC1=O,0.2287 | |
| CNc1c(c[nH]n1)C#C,0.2001 | |
| C1C2OC2C2OC12,0.3201 | |
| CC1(O)CC2(CN2)C1,0.3087 | |
| OCC(=O)C1OC1C=O,0.1967 | |
| OC1CCCCC11CC1,0.3252 | |
| N=C1NC(=O)C2CNC12,0.2315 | |
| C#CC1OCC11CCC1,0.2703 | |
| Cn1ncc(n1)OC,0.2287 | |
| CCC1(C#C)C(C)C1C,0.2889 | |
| O=C(CC1CN1)C1CN1,0.216 | |
| CC(=O)CC(O)C1CN1,0.2057 | |
| O=C1C2NC2CC1C#C,0.2054 | |
| CCC1(C)OC1C(C)=O,0.2204 | |
| CC(C)(C1(CCC1)O)O,0.3156 | |
| CC1(CC2CN2C1)C#N,0.2797 | |
| COC(=O)N1CC1,0.2898 | |
| OCC1CC2NC(=O)C12,0.2695 | |
| COC12CC(C)(C1)C2O,0.3327 | |
| CN1C2CC(C=C2)C1=O,0.2186 | |
| COC1(C)CCC1O,0.3217 | |
| CC1C2NC2C11CO1,0.3043 | |
| N=C1ON=C2C3CC3N12,0.2133 | |
| NC(C#C)C1(CC1)C#N,0.2769 | |
| CC(=O)C(=NC1CC1)N,0.1753 | |
| N=C1CCCC(O1)C#N,0.278 | |
| OC12CC1(OC2=N)C#C,0.2269 | |
| C#CC(=O)C#CCCO,0.1887 | |
| CC1NC11C2CCC1O2,0.3136 | |
| N#CC12CN(C1)CCO2,0.2526 | |
| COC12C3C1C1OC3C21,0.3131 | |
| CC1CN1CC(N)=O,0.2719 | |
| CNc1c(cco1)OC,0.2103 | |
| O=CC1(OCC=C1)C#C,0.2058 | |
| CC(C)C1COC=NC1,0.272 | |
| Cn1ncc(=NO)cn1,0.1581 | |
| NC(C#C)C1=NC=NN1,0.2569 | |
| OCC1OCOC1C#N,0.2724 | |
| CC(=O)C1CC1(O)C=O,0.2021 | |
| c1cc-2cconc2c1,0.1311 | |
| OC1=COC(=N)C=C1,0.1547 | |
| C#CCC1(CC1)CC=O,0.2234 | |
| CCC(CC)CC1CC1,0.3595 | |
| CNc1cnc([nH]1)C#N,0.1839 | |
| Cc1[nH]c(c(n1)O)C=O,0.1737 | |
| N=COC1OCCC1=O,0.2157 | |
| OC1CC1N1C=NC=N1,0.2663 | |
| CCC1C2OCC12O,0.2874 | |
| CC1CC1CC1(C)CO1,0.3428 | |
| C1CC23CC(C=C2)C13,0.2288 | |
| NC(C#C)C#CC#N,0.2225 | |
| CC1C2NC(C2O)C1=O,0.2084 | |
| CNc1ccc(n1C)N,0.2283 | |
| C1CN=COCCOC1,0.2542 | |
| N#CC12CC1NC=N2,0.2476 | |
| O=C1NC2C3C4CC13C24,0.2485 | |
| [NH2+]=CNC1=COC(=O)[N-]1,0.0984 | |
| OC12COC11CN(C1)C2,0.3116 | |
| COC1CC=CC1(C)C,0.2636 | |
| CCC1C(C)N1CC#N,0.2682 | |
| CC1C(O)C(O)CC1=O,0.2132 | |
| CC12COC1CC(=N)O2,0.2847 | |
| O1C=NC2C3C=CC2C13,0.2265 | |
| C#CC12CN=C3OC1C23,0.1608 | |
| FC1=CC(=N)N=CN1,0.1929 | |
| CC12NC3C1(O)CC23O,0.2856 | |
| CC1(O)C2CC1C2CO,0.3216 | |
| OCC1(CC#N)CO1,0.3012 | |
| C#CC1C2CC3CN1C23,0.2372 | |
| OCC1CC2OCC12O,0.3021 | |
| CC1CC1(CC#N)C=O,0.2258 | |
| NC(=O)C1CN1,0.2697 | |
| CCN1CC2OCCC12,0.3004 | |
| OC1C=CC2(NC12)C#N,0.2297 | |
| OC1CC(O)C2(O)CC12,0.3167 | |
| C#CC1=NC2C3CN1C23,0.1875 | |
| C1C(=NO)C=CC(=O)O1,0.1762 | |
| OCC1CCC11CC1,0.3365 | |
| C1CC12CN=C(O2)C=O,0.1738 | |
| CCC1CC(O)C1=O,0.2202 | |
| CCC(C#C)(C#C)C#N,0.291 | |
| OCC1C2OC(=O)C12O,0.2448 | |
| COC1(CC1)C#N,0.2923 | |
| CCCOCC,0.3409 | |
| Cc1coc(c1O)NC,0.2142 | |
| Cc1c(cncn1)O,0.2103 | |
| CNc1c(cn[nH]1)O,0.2265 | |
| CC1C2COC(C)C1O2,0.3073 | |
| OC1CC(CC1O)C#N,0.3069 | |
| c1c(onn1)NC=O,0.2064 | |
| CCCC1C2OC2C1=O,0.2116 | |
| N=C1OC(=O)C(=O)C=C1,0.1521 | |
| CC1NC1CC(=O)C#N,0.1777 | |
| CC1=CC2(CC2O)OC1,0.2286 | |
| CN1CC(C1)(C#C)O,0.2459 | |
| CC1C2OCC2C1(C)O,0.3104 | |
| CC(C)(OC=N)CC=O,0.2237 | |
| C#CC12CC1(CC2)C#N,0.2426 | |
| CC1=CCC(=O)N2CC12,0.2364 | |
| CC12CC=CC1(CO)N2,0.2356 | |
| c1(c([nH]c(n1)O)O)N,0.2267 | |
| CC1=Cn2ccnc2C1,0.1986 | |
| C1NC11CC2CC2C=C1,0.229 | |
| CCN1CC(=O)C1C#C,0.2084 | |
| CC1=NC2(C)CC2CO1,0.2511 | |
| COC(=O)C(N)C#N,0.2587 | |
| CCOC12CC(C)(C1)C2,0.3369 | |
| CC1(C)NC(=O)NC1=N,0.2596 | |
| O=CC(CC#N)C#C,0.2183 | |
| CC1C23CCC12CCC3,0.3024 | |
| c1cn2c(coc2n1)N,0.2261 | |
| CCC1(CO1)C#N,0.3021 | |
| CC1N2C3C2C1(C)C3O,0.2951 | |
| N=COC1C2COC12,0.2734 | |
| C1C2OC11CCN3C2C13,0.2274 | |
| CN1CC(=N)OCC1=O,0.2589 | |
| CCCC1COC1C#N,0.2782 | |
| OC12CN3C1CC23C#N,0.2681 | |
| c1c[nH]c2c1[nH]cn2,0.2088 | |
| N#CC1CC2OC=NC12,0.2625 | |
| CNC1COC1=N,0.2554 | |
| OC12CCC(CC1)OC2,0.305 | |
| CN(C)c1nc(co1)N,0.2187 | |
| COCc1ncnnn1,0.1604 | |
| CC1OC11CN(C)C1,0.2975 | |
| CCCC1C2C3CC1C23,0.3284 | |
| CC1CN=COC(=O)C1,0.2376 | |
| O=CC1OC2(CC12)C#N,0.2154 | |
| CC1CCC=C(C1)C#N,0.2249 | |
| CC12CC(N)(C#N)C1O2,0.2905 | |
| Cc1nc(n(n1)C)CO,0.2476 | |
| COC1CCCC1C#N,0.2956 | |
| C1CC1n2nc(nn2)O,0.2255 | |
| CC1CC1(C)NC(C)=O,0.2708 | |
| N#CC12CNC3CN1C23,0.265 | |
| O=C1NC=C(O1)C1CO1,0.2229 | |
| CC(C)(CO)C(=O)C#N,0.2009 | |
| CCN=C1OC2C(C)C12,0.2681 | |
| C1C2OCC3C4CC23C14,0.2443 | |
| C1CN2C3C4OC3C24C1,0.2838 | |
| NC=[NH+]C1=COC(=N)[N-]1,0.0812 | |
| COC1=NC=CNC1=N,0.1686 | |
| NC1=NC2CC(=O)C2O1,0.1956 | |
| CC(C)C1CC2CC1C2,0.3744 | |
| CC1=C(CC2CC12)C#C,0.1983 | |
| CCN=c1cnocn1,0.1942 | |
| CC1C(O)C2(C)CC12C,0.3068 | |
| OC12CC1NC2=O,0.2435 | |
| CC(C)CNC(=O)C=O,0.175 | |
| CC#Cc1c(nno1)C,0.1918 | |
| CN1C(C#C)C11CCC1,0.2552 | |
| COC(C)C1(C)CCC1,0.3289 | |
| N#CC12CC3C(C1)C23,0.2893 | |
| CC1N2C3CC2C1(O)C3,0.2935 | |
| Cc1cc(cnc1O)O,0.1894 | |
| O=C1C=CCCC11CO1,0.1852 | |
| O=C1CC2N1CCC2=O,0.2042 | |
| CN=C1OC2(C)CC12N,0.2605 | |
| CC#Cc1c(nco1)O,0.186 | |
| CC1(C)C2CC1(O)C2O,0.316 | |
| CC12NC1C(=O)C2CO,0.212 | |
| CC(O)CC1(CO1)C#N,0.2876 | |
| CC12CN3CC1(CO)C23,0.2857 | |
| C1OC11C2CC1OCO2,0.3184 | |
| CC1=CC(N)=NC(=[NH2+])[N-]1,0.2084 | |
| CC(=O)C(CO)OC=N,0.223 | |
| CC12NC1C1CC21O,0.2772 | |
| c1cn[nH]c1CN2CC2,0.2582 | |
| CCC1CC2OC=NC12,0.2613 | |
| N=C1NC=C(C#N)C1=O,0.1484 | |
| OC12C3CC11CCC2N31,0.3164 | |
| N=C1CC(C=O)N1C=O,0.2077 | |
| CC(=O)C(=O)C(=O)C#N,0.1319 | |
| CC1(C=CCC1O)C#C,0.2526 | |
| CCC1(CC(O)C1)OC,0.3188 | |
| OCC1CC2=CC=CN12,0.2503 | |
| CC12CCC(=O)C1(C)O2,0.2115 | |
| C1CC2C3COCC2C13,0.331 | |
| CCCOC1CC1OC,0.3178 | |
| CC(C)C12C3CC1CC23,0.3166 | |
| CC#CCC1CC2CC12,0.3004 | |
| N=C1CNCCC(=O)O1,0.2205 | |
| CC1(O)CN2CC2C=C1,0.2258 | |
| CC(=N)Nc1cnno1,0.2042 | |
| CC12C3CC11CCN2C31,0.2989 | |
| CC1OCC2CC2(C)O1,0.3283 | |
| N#CC1=CC2CN2C1,0.1915 | |
| CCNC(=O)OC,0.3125 | |
| OCCCC1CN=CO1,0.2718 | |
| NC1CCOC1C#N,0.2669 | |
| OCC1CC2OC2C=C1,0.2469 | |
| CC1OCC1(CO)CO,0.2944 | |
| OCC1C(O)C2CCC12,0.2978 | |
| COC1(CC1C)C#N,0.2911 | |
| OC1C(O)C1(O)CC#C,0.2901 | |
| CNC(=O)CC(=O)CO,0.209 | |
| O=CNCC1CN=CO1,0.2667 | |
| CC1CC2(O)CC2C1=O,0.2213 | |
| CN1C2COC2C1=O,0.2496 | |
| C#CC1CCNC1C#N,0.2665 | |
| COC1CCC1C(C)=O,0.2319 | |
| CC1CN2C3CC1(C)C23,0.3095 | |
| C(C(CO)(C#N)C#N)O,0.2969 | |
| CN1C(C=O)C1C#N,0.1961 | |
| CC12CC(COC1=N)N2,0.261 | |
| CCCC1OC(=N)C1O,0.2828 | |
| O=CNC1CNC(=O)C1,0.2673 | |
| CC(CO)C(=N)NC=O,0.2295 | |
| CCC1NC1CC=O,0.2208 | |
| C1NC1C12CCCC1N2,0.3079 | |
| ON=C1C2NC1C1OC21,0.2542 | |
| CCC(=O)CC1CN1C,0.2086 | |
| CCCCC1CC1CO,0.3358 | |
| C(C#CC1CO1)C1CC1,0.2753 | |
| CC1CC23CN1C2CO3,0.2589 | |
| CCC1C(CC=O)N1C,0.1985 | |
| CC#CC1(C)CCCO1,0.2942 | |
| O=C1CC23CCC2OC13,0.1943 | |
| CCC(C)C(C=O)C#C,0.219 | |
| CC1CC1(O)CC(C)=O,0.2158 | |
| Cn1ccc(n1)N(C)C,0.2151 | |
| CC1=C(C)C2(O)CC2C1,0.2419 | |
| c1c(cn[nH]1)CC#N,0.2626 | |
| O=CCC12CC1N1CC21,0.2021 | |
| COC(=O)c1ncco1,0.2071 | |
| C#Cc1c[nH]nc1N,0.2081 | |
| CC12CCC(O)(C1)C=C2,0.2577 | |
| C1OC11CCC2NC12,0.3112 | |
| Cc1nc(on1)OC,0.2606 | |
| CC1CCCCC1,0.374 | |
| CCOC=NC1CC1,0.2512 | |
| CCOC(CO)CC#C,0.3034 | |
| CC(C)C1CC(C1)(C)C,0.3561 | |
| CC1(CCO)CCO1,0.318 | |
| N=CN1CC2NC2C1=O,0.2175 | |
| OCC12CCN3C1CC23,0.2948 | |
| c1c(noc1OC=O)O,0.2264 | |
| CCC12OC1C(C)C2C,0.322 | |
| CC(O)C(O)C1(O)CC1,0.3035 | |
| CC#CC#CC1OC1C,0.2117 | |
| CCC12CN1CC2O,0.2919 | |
| CC1=CC2CC(CC1)O2,0.2379 | |
| CCC(O)(CC=O)C=O,0.2147 | |
| C1CC1CNCC#N,0.2677 | |
| CC1(C)C2NC(=N)C12O,0.2437 | |
| CCC1C2C3C=CC2C13,0.2259 | |
| CCC(=O)N(C)CC,0.2687 | |
| O=COCC1CC2NC12,0.256 | |
| CCOC(C)(C)C=O,0.226 | |
| O=COC12CCC1CC2,0.2734 | |
| C1NC1C12OC1CC=C2,0.2458 | |
| CC12OC1C=CC21CC1,0.2359 | |
| CCC(C#CC)C(N)=O,0.2694 | |
| CC1N(C)C1(C)C(N)=O,0.2559 | |
| O=CC12COC1CCO2,0.2156 | |
| CC1(CC1)c2[nH]ccn2,0.2435 | |
| CC1=CC(=N)NN=C1O,0.1535 | |
| C#CC12NC1CC1OC21,0.2583 | |
| C1CC(C1)C2CCC2,0.3589 | |
| CC(CC#N)C#N,0.3346 | |
| N1C2C1C1NC3C2NC13,0.2793 | |
| CCC1CC=CC1OC,0.2586 | |
| O=CCN1CC2CC12,0.199 | |
| COC1OC(C)(C)C=C1,0.2622 | |
| CN=C1CCC=CCO1,0.2394 | |
| OC12C3CC1N3C21CC1,0.3094 | |
| CN=C1CCC2(O1)CC2,0.2671 | |
| CC(OCC1CO1)C#C,0.2948 | |
| COc1cc[nH]c1N,0.2312 | |
| OCC1(CO1)C(=O)C#C,0.1956 | |
| CN1CC2(C1)CO2,0.2969 | |
| N#CC1COCC2CC12,0.301 | |
| Cc1cn(cc1N)C,0.2264 | |
| CC1=C(COC1=N)C#C,0.1848 | |
| CC1CCC2OC12C#N,0.2891 | |
| O=C1CC23COC12CO3,0.1982 | |
| NC1=[NH+]C(CC1)C([O-])=O,0.2489 | |
| OC1C2CNC2C1C#N,0.2748 | |
| CC(C#C)C(C=O)C=O,0.1993 | |
| OCC1CC=CCC=C1,0.2531 | |
| COC1COC2C(O)C12,0.2904 | |
| CC12CC1OC(O2)C#N,0.2837 | |
| CC1C2OC3C2OC13C,0.3072 | |
| C1C2(N1CC=O)COC2,0.2203 | |
| CCOCc1cnno1,0.2326 | |
| CC1COC1(CO)C=O,0.2095 | |
| CC(C)(C#C)C1CO1,0.3098 | |
| C(=O)C(=O)C(=O)NC=O,0.121 | |
| CC1CCC2(O)CC12O,0.2929 | |
| C1C2C=CC1C1OC21,0.2374 | |
| c1c(nn[nH]1)OCCO,0.2255 | |
| CC1=CCCC=CC1=O,0.1807 | |
| CCC(C)(O)CC(C)O,0.2999 | |
| NC1=C(O)C(=N)N=NN1,0.1536 | |
| O=C1C2CC3CC1C2O3,0.2162 | |
| CC1OCCC(C)=C1,0.26 | |
| CC1C2CC(C)C(=O)C12,0.2215 | |
| CC1(O)C2NC1C21CO1,0.3073 | |
| CCC(OC(C)=N)C#C,0.2882 | |
| CC(O)C1(C)CCO1,0.3028 | |
| CC1CC(=O)C11CC1O,0.2167 | |
| N=CN1CC1(C#N)C#N,0.244 | |
| CCOC1COC11CC1,0.3006 | |
| CC(C)C1OC2CC1C2,0.3239 | |
| CC(O)C1=NN(C)N=N1,0.243 | |
| CC1(O)CCOC1C=O,0.2158 | |
| C1CCC(C1)C(=O)C=O,0.1559 | |
| C1CC2NC2COCO1,0.3047 | |
| CC(C)C1COC1C#N,0.2784 | |
| c1c2n(cn1)C(=O)NC2,0.2211 | |
| NC12CC1(O)COC2=O,0.2466 | |
| OCC12CCC=C1CO2,0.2361 | |
| C1N2CC11CC3NC3C21,0.286 | |
| COC1CC2OC(=N)C12,0.2811 | |
| CC12C3N1C1=NC2C3=C1,0.1257 | |
| CC(C#N)C1CC(=O)O1,0.2872 | |
| O=C1COCC2(CO2)C1,0.218 | |
| OC1=C2CCN2C(=O)N1,0.223 | |
| CC12OCC1OCC2O,0.294 | |
| c1c(cn(c1O)C=O)N,0.1689 | |
| CC12CC(CC1)C2=O,0.2285 | |
| C1C2NCCN=COC12,0.2561 | |
| CC12OCOC1(C)C2O,0.2955 | |
| CC(O)C1(C)OC1C=O,0.2174 | |
| CC1(O)C2CC3(CC3)C12,0.3146 | |
| C1C2C3CC4OC4C2C13,0.3419 | |
| CC(C#N)C1CCOC1,0.2948 | |
| CC12CC(CC1C=O)O2,0.2197 | |
| OC1C2C3NC3CC12O,0.2798 | |
| c1nc2c(o1)nno2,0.1919 | |
| C#CCC#CCCC=O,0.2213 | |
| OC1C2C(C#N)C2C1=O,0.2093 | |
| N=C1OC2CC1COC2,0.2855 | |
| OC1(CC2CC12)C1CO1,0.3211 | |
| CC1C(=O)NCC1=NO,0.238 | |
| OC1=NC(=N)C=CC=N1,0.1502 | |
| C1CN1CC#CC=O,0.1928 | |
| OC1CCC2OC(=N)C12,0.2867 | |
| CCC(C)(CC)C(=O)N,0.2727 | |
| NC(C#N)C1(CC1)C#N,0.2802 | |
| O=C1CC2OCC2=C1,0.1907 | |
| CC1OCC(O1)C1CO1,0.3384 | |
| CNC1(C[NH2+]C1)C([O-])=O,0.2484 | |
| CN1CC1C1=CN=CO1,0.229 | |
| CCCC(CC)NC=O,0.2825 | |
| COCC(=O)NCCO,0.2642 | |
| CC12CC(C)(C1)CCC2,0.3472 | |
| CC1OC2C1C2C(C)=O,0.2187 | |
| CC1C2CC(C)CC12O,0.3206 | |
| CC(CO)C1CCC1C,0.3377 | |
| CC1C=CC2C(O)CN12,0.2338 | |
| Cn1c(c(c(n1)N)N)O,0.2477 | |
| OC1CC1(O)C1COC1,0.2993 | |
| CNC12C(C)C1OC2=N,0.2482 | |
| CCC1(CC1)OC(C)=N,0.2866 | |
| CNc1ccc([nH]1)OC,0.2311 | |
| c1c(non1)C2COC2,0.2211 | |
| CCC1(CN1)C#N,0.2955 | |
| OC1C2C3OC(=O)C2C13,0.2704 | |
| O=C1C2CC3C4C3C1C24,0.2129 | |
| C1CC11C2CC3CC1N23,0.2867 | |
| CCOC1CCOC1,0.3267 | |
| CC1C(O)C2(CN12)C=O,0.213 | |
| C#CCC(C=O)C=O,0.2061 | |
| CC12CC3(O)C1NC23,0.2945 | |
| CC1(OC(=O)C1N)C#N,0.2489 | |
| OC12CN3C4C(C14)C23,0.2841 | |
| OCC1OC2CN3C2C13,0.3088 | |
| C1C2CC3=CC1N1C2C31,0.1708 | |
| CC1=CC2CC1C1OC21,0.2367 | |
| CCC1(CC)OC2CC12,0.3139 | |
| C#CC1OC2CNC12,0.2506 | |
| CC12CN3C4C(O1)C4C23,0.2734 | |
| CNc1c([nH]cn1)C#N,0.1846 | |
| CCc1cccnc1N,0.2004 | |
| CC1C(CC1(C)O)C#N,0.3065 | |
| CC(CC1CO1)OC=N,0.2804 | |
| c1c(c2cn[nH]c2[nH]1)O,0.2121 | |
| CC12C3CC(N13)C2=O,0.2337 | |
| CC1=CC(O)=COC1=N,0.1577 | |
| CN(CC1CCC1)C=O,0.2713 | |
| OC1CC23OC4C2C1C34,0.2957 | |
| CC1C2N1C=NCC2=O,0.1978 | |
| COC1COC1C(N)=O,0.2618 | |
| CC(=O)C12CN1CC=C2,0.21 | |
| [NH3+]CCCC([O-])=O,0.2737 | |
| CCNc1cnc(o1)O,0.2286 | |
| COC(C=O)C=O,0.197 | |
| N=C1OC(C#C)C11CO1,0.2659 | |
| OC1CCCOC(=O)C1,0.2706 | |
| OC(CC1CCC1)C#C,0.295 | |
| C#CC1NC1C1CC1,0.279 | |
| CCN1CC(C#N)C1C,0.2603 | |
| COC(C)C12CN(C1)C2,0.2975 | |
| CC1(O)C2C3C(O)C1N23,0.3015 | |
| OC1=NOC(=O)C(=N)O1,0.1973 | |
| OC1(C=O)C2CC1C=C2,0.1917 | |
| COC12CN(C1)C2CO,0.315 | |
| COC(C)C#CC1CN1,0.2625 | |
| CC12CCC1C(CO)C2,0.3325 | |
| C#Cc1ncc2n1CC2,0.2026 | |
| COCCC#CCOC,0.2849 | |
| CC1C2C3NC3C12,0.2763 | |
| CC1CC(O)C(=O)C1,0.2231 | |
| OC12C3CC1C(=O)C2N3,0.1999 | |
| CC(=O)C1CNC(=O)N1,0.2178 | |
| O=CC12C3C1C1C3CC21,0.2253 | |
| CC(C)C1OC2(C)CC12,0.3111 | |
| CC1CC(CO)CC1O,0.3102 | |
| OC1CC1N1N=CN=N1,0.221 | |
| CCC1(N)C(C)OC1=O,0.2661 | |
| c1[nH]c(=O)on1,0.2527 | |
| CC1(C)OC(CO)C1O,0.2981 | |
| CC1=CC(F)=NNC1=N,0.1581 | |
| CC(O)C(O)C1CO1,0.3205 | |
| c1coc(n1)CCO,0.2458 | |
| CCCOCC1(CC1)O,0.3246 | |
| c1c[nH]nc1N(=O)=O,0.2059 | |
| CC12C3C(CN13)OC2=N,0.2555 | |
| O=C(C#N)C1OCC=C1,0.1707 | |
| CC12COC1CCOC2,0.3204 | |
| C#CCNc1cnon1,0.2095 | |
| CC1OC(=N)C1N(C)C,0.2457 | |
| c1c2c(c([nH]1)N)[nH]nn2,0.1775 | |
| CC12CC1(O)C1(CC1)C2,0.3026 | |
| CNC1=NC2CC2(C)O1,0.2681 | |
| CC12C3OC3C1N2C=O,0.2443 | |
| C#CC#CC#CC#N,0.1661 | |
| CC12CC1C1(CC1)C2O,0.3153 | |
| CC1(C)CC(O)C1(C)O,0.2987 | |
| N=C1NC(=O)C2(CC2)O1,0.2429 | |
| C1C2C1C13CC4C1C2C34,0.3379 | |
| CC1=CC(=N)OC(N)=N1,0.1845 | |
| CNC(=NC)NC=O,0.1993 | |
| C(COCC(=O)N)C#N,0.2761 | |
| Cc1cn[nH]c1C2CC2,0.2367 | |
| CC1(CC1C=O)N1CC1,0.2156 | |
| OC1=COC=C1OC=N,0.1879 | |
| CC12CC(C1)CC2(C)O,0.3265 | |
| CC1=C(N=NO1)C1CN1,0.1995 | |
| CC1NC1C#CC#N,0.2246 | |
| Cc1cn[nH]c1CC#N,0.253 | |
| O=C1OCC2OCC2O1,0.3001 | |
| c1cnoc(=O)n1,0.1647 | |
| CC(=O)Cc1ccco1,0.2054 | |
| O=CCC12CC1COC2,0.2234 | |
| COC1C(OC1=N)C#N,0.2608 | |
| C1CC1C1COC11CC1,0.3056 | |
| N=C1OCC2(CC2)C=C1,0.2087 | |
| NC(C#N)C1=CN=NN1,0.24 | |
| CC1C=CC2C=CCC12,0.2534 | |
| C#CC#CC(=O)NC=N,0.1823 | |
| OC12CC1(C#C)C1CC21,0.2592 | |
| CC(C)OCCC#C,0.3093 | |
| c1cnc2c(n1)non2,0.1555 | |
| CC1=CN2C(CC2=O)C1,0.213 | |
| OCC12CC(C1)C2C#N,0.303 | |
| Cc1c(cn[nH]1)NC,0.2163 | |
| NC(=O)NC1CC1C=O,0.2249 | |
| CCC1(C#C)C2CN1C2,0.2573 | |
| CC1CC1C1OC1C#C,0.2746 | |
| CC1=CC2OC11CNC21,0.2227 | |
| CCOC(C)C(O)C=O,0.2285 | |
| CC1C2CC1N1CC21,0.3227 | |
| COC1=C(N)NC(=N)O1,0.2299 | |
| OC12CC(C1C#N)C2=O,0.2413 | |
| OC(C#C)C1=COC=C1,0.2398 | |
| c1coc(c1N)OC=O,0.1999 | |
| c1c(c[nH]c1O)NC=O,0.2014 | |
| CC(=N)N(CCO)C=O,0.2209 | |
| OCC1CC2OCC1O2,0.3209 | |
| Cc1c(c[nH]c1O)OC,0.231 | |
| Cc1cc(c([nH]1)C)CO,0.2308 | |
| C1C2C=CC3CCOC123,0.2321 | |
| C1C2CCC3CC2OC13,0.327 | |
| OC1C(O)C1OCC#C,0.2555 | |
| CC1OC2CC2C11CN1,0.304 | |
| C#CC12C3OC1COC23,0.2541 | |
| CN1C2C(CO)CC12C,0.3019 | |
| N=C1OCC1CCC#N,0.2871 | |
| CC1C2CC2(C)C1=NO,0.2445 | |
| C1C2CC3C=CC2C13,0.2479 | |
| CC1OC(C2CO2)C1O,0.3235 | |
| CNC1=CC(=O)OC1C,0.2183 | |
| CC1(COC=O)CC1O,0.2783 | |
| OC12C3CC1OC(=O)C23,0.2631 | |
| CC1C2C1C1(C)C2N1C,0.2726 | |
| COC1CC2CC1CO2,0.3162 | |
| C1OC11C2CCC1CC2,0.3313 | |
| CNC1=NNN=NC1=N,0.1702 | |
| CC1C2CC2C11CO1,0.3308 | |
| CC12C=CC3C1COC23,0.2322 | |
| C#CC12CC3CC(C1)C23,0.2861 | |
| COC1C2C3CC2(C)C13,0.3369 | |
| C1C2C3CC4(COC24)N13,0.2997 | |
| CC(C)(C)CC(N)C#N,0.2835 | |
| CCn1c(ncn1)CO,0.2556 | |
| C#CCn1c(ncn1)N,0.2387 | |
| C1CC2C1C1COC21,0.3064 | |
| c1cn[nH]c1NCC#N,0.244 | |
| CNc1connc1=O,0.1425 | |
| COc1ccc([nH]1)C#N,0.196 | |
| COCCC(O)COC,0.3273 | |
| CCC1C2CC1(O)C2C,0.3314 | |
| CC1(CO)CC2CC2C1,0.3319 | |
| O=CC12CC(O1)C21CO1,0.215 | |
| C(COCCO)C(=O)N,0.2796 | |
| CC12CC1CC=C2C=O,0.1879 | |
| CC(O)C(N)C(N)C#N,0.2664 | |
| CCC1C2OC(=N)OC12,0.3005 | |
| Cc1cccn1C(=O)C,0.186 | |
| CC1(C)CC2OCC12,0.3153 | |
| CC1OCC2OCC2O1,0.3296 | |
| OCC1C2OCC=CC12,0.2403 | |
| CCOCC1(C)OC1C,0.3368 | |
| Cc1c(coc1N)O,0.2246 | |
| C1C2CCCOCOC12,0.3226 | |
| CC1=CC(CC1)C#N,0.2598 | |
| O=CCCC1CN1C=O,0.2255 | |
| CNc1cc([nH]c1O)O,0.2162 | |
| OC(COCC=O)C#N,0.2294 | |
| C#CC1(CC1)CCCO,0.2956 | |
| CC(C)CC(C)C(C)C,0.372 | |
| C(C(=O)C(=O)CO)O,0.1576 | |
| CC12COCC1CO2,0.3255 | |
| CN1C2C3OC2(C=O)C13,0.1885 | |
| CC12CC3CC1C1C3C21,0.35 | |
| CCCOC1CC1CC,0.3324 | |
| CNC(C#N)C(O)C=O,0.208 | |
| CC1OC2(C)CC1CO2,0.3284 | |
| Cn1ccc(n1)C#C,0.2221 | |
| COCc1c(nc[nH]1)N,0.215 | |
| CC(C)CC1(C)CCO1,0.3149 | |
| CC1OC2C3CC1(C)C23,0.3067 | |
| c1[nH]c(=O)c(c(n1)N)N,0.1712 | |
| C1OC2=NCC3OC1C23,0.241 | |
| C1NC2=NCCCOC12,0.2509 | |
| CC1C(C)C11CN=CO1,0.2568 | |
| NC1=COC(=N)C(N)=N1,0.1471 | |
| CC(C)(O)C(O)C#N,0.2883 | |
| CCOC1CC1C(N)=O,0.2655 | |
| CC1CCCC1(O)C#C,0.2964 | |
| C#CC1C2NCC12C#N,0.2461 | |
| CN=C(C#N)NC1CC1,0.2025 | |
| CN1CCCC1(C)C#N,0.2687 | |
| CCCC(CC#N)C#C,0.3061 | |
| C1C=C2CCOC3C1C23,0.2301 | |
| CCN(C)C1(CC1)C#N,0.2681 | |
| CC1COC11CC1C#C,0.2707 | |
| CC12CC1COCCC2,0.327 | |
| CC1CN1C1(C)COC1,0.2979 | |
| COCC(C)CC=O,0.2294 | |
| OCC12OC1CCC2O,0.3152 | |
| C#CC1COC11CCC1,0.2818 | |
| COCCC1OC1C=O,0.219 | |
| N=C1C=CNN=CC1=O,0.151 | |
| CC12CC(OC1)C2C#C,0.2774 | |
| CC1OC2CC3NC3C12,0.2939 | |
| C1OC2C3CCOC2C13,0.3027 | |
| CC(COC=O)CC=O,0.2288 | |
| CCc1c([nH]c(n1)C)O,0.2341 | |
| CCC1CCNC(=O)O1,0.3071 | |
| CC1CC(CO)N=CO1,0.2631 | |
| O=C1NCC2(CN2)C=C1,0.2066 | |
| OC12CC1OCC21CN1,0.2848 | |
| OCCCOCC1CO1,0.3328 | |
| C1C2OCC11N=COC21,0.251 | |
| CCC(COC)CC=O,0.229 | |
| CC1OC11C(O)CC1O,0.2952 | |
| CN(C)C(=O)OC=N,0.2578 | |
| c1nc(on1)N(=O)=O,0.1969 | |
| CC1CC2C3CC1CC23,0.3331 | |
| O=C1CC2COCOC12,0.2059 | |
| CC1C2COCC12C,0.3276 | |
| OCCC1OCCC1=O,0.2177 | |
| OC12CC3C1C1(CO1)C23,0.3285 | |
| NC(=O)C1C2C=CCN12,0.2287 | |
| COC1C2C(O)C2C1O,0.3151 | |
| OC1COC2=C1NN=C2,0.217 | |
| CC1CC2OC(=N)CC12,0.2824 | |
| CCC#Cc1ccn[nH]1,0.2099 | |
| O=C1OC2CC1C=CC2,0.2417 | |
| CCNc1cc[nH]c1C,0.2168 | |
| NC(=O)C1(CN1)C#C,0.2598 | |
| NC(C#N)C1(N)COC1,0.2761 | |
| CC1(C)CC(O1)C#C,0.2776 | |
| N#CC12CCC3C1NC23,0.2746 | |
| CN1C(CO)C1(C)C#N,0.268 | |
| N#CC12CC(O1)C1CC21,0.2749 | |
| OC12C3CC1C(=O)C23,0.2407 | |
| O=CCC(C#C)N1CC1,0.2283 | |
| CC12CC3OCCN1C23,0.3055 | |
| CC1CCC(C1)NC=O,0.2818 | |
| COC1C2C3CC2C13,0.3389 | |
| O=C1N2CCC2C11CC1,0.2319 | |
| CC(C)C(=O)C#CCO,0.2055 | |
| CC(C)Oc1cnc[nH]1,0.2494 | |
| c1ccc2c(c1)cc[nH]2,0.1962 | |
| CC1CC2(CCC2)C=C1,0.2576 | |
| COCc1c[nH]cc1O,0.2427 | |
| CC(NC=O)C(=O)CO,0.2148 | |
| NC1C2C(O)CC12C#N,0.2779 | |
| OCC(O)COC=N,0.2798 | |
| Cn1cc(cc1OC)N,0.2269 | |
| CC1(C)C2C3CC1(O)C23,0.3113 | |
| CN1CC(OC=N)C1=O,0.2594 | |
| O=C1[CH-]C(=O)C2CC1[NH2+]2,0.184 | |
| CC(C#C)C1CC1,0.3126 | |
| CC12COC1C1(O)CC21,0.3036 | |
| C1OC2C3CNC12CO3,0.2777 | |
| CCC(C#C)C1CO1,0.307 | |
| CC12COC3CC1C2O3,0.3183 | |
| CC1C2C[NH+]1C2C([O-])=O,0.2121 | |
| CN1C2C(O)CC12CO,0.2964 | |
| O=CC(=O)C1CN=CO1,0.1454 | |
| C1C2CC1C1=CN=NN21,0.2506 | |
| C[NH+]=C(N)C(CO)=N[O-],0.138 | |
| C1NC11CCC11CO1,0.3005 | |
| COCC(CC=O)C#C,0.2237 | |
| COC(CO)C1CC1,0.3181 | |
| CC1OC(C#C)C2NC12,0.2825 | |
| CC1(CCC1)OC,0.3257 | |
| OC1CN(CC1O)C=O,0.2651 | |
| CC1=CCC2(C)CC12,0.2468 | |
| CN=C1OCC(=O)C1C,0.2101 | |
| N=C1CC2(CC2O1)C#C,0.2653 | |
| CC1COC2(COC2)C1,0.3131 | |
| OC(CC1CC1O)C#N,0.2868 | |
| Cn1c(nc(n1)C#C)N,0.2144 | |
| CC1CC2CC3C2C13O,0.314 | |
| CC(C)c1ncccn1,0.2084 | |
| CCC12COCC1N2,0.3296 | |
| CC1C=CCC1(C)C=O,0.222 | |
| C1C2C=CC3OC3CN12,0.2274 | |
| CC1=C(CC=CCC1)C,0.2401 | |
| NC1=CC(=N)OC(=O)N1,0.2029 | |
| CC1(O)C2OCCC12O,0.2806 | |
| N=C1OCC=C1C=O,0.1792 | |
| CC1CN2CC(O)C12,0.2628 | |
| Cc1c(nn[nH]1)NC,0.2051 | |
| CN1C2C1C1C2OC1=N,0.258 | |
| c1c(nc(c(n1)N)F)N,0.1636 | |
| c1c(nc[nH]1)NCC=O,0.167 | |
| CC12COC1(CO)CN2,0.2791 | |
| CN1C(CO)C(O)C1=O,0.2687 | |
| CCC1C2C3C2C2C3N12,0.2976 | |
| OCC(O)CNC=O,0.2814 | |
| CC1C2CC2C=C1C#N,0.2062 | |
| CCc1c(coc1N)N,0.2187 | |
| COC1CCN=C(C)O1,0.2754 | |
| CCCCC1(CO)CN1,0.312 | |
| CC12COC1C2(O)C=O,0.2184 | |
| Cc1c(nno1)NC=N,0.1959 | |
| C1CC1C12OC3C1NC23,0.2927 | |
| CC1COC(=N)C1=O,0.1879 | |
| CC(O)CCCC#N,0.3147 | |
| CC(CO)N1C=CN=C1,0.2536 | |
| CC1(COC1)C1CCO1,0.3094 | |
| OC1C2CC3(O)C2CC13,0.3159 | |
| C1CNc2c1c([nH]n2)N,0.228 | |
| N=C1ON=CC(=O)C=N1,0.1532 | |
| CC12CCC1C(=O)C2,0.2176 | |
| CCn1cnoc1=NC,0.2183 | |
| CCOCC1CC1,0.3402 | |
| CCCOC(C)CC#N,0.3029 | |
| C#CC1=CCCC2OC12,0.2025 | |
| O=C1OC=NC2CNC12,0.2131 | |
| C1C2OC22CC1CCC2,0.3242 | |
| CC(O)CC(O)C1CN1,0.2886 | |
| N=C1N=NOC(C=O)=N1,0.1622 | |
| OC1CC11COC1C#N,0.2712 | |
| OC12CC1(COC2)C#N,0.2773 | |
| N=COC1CC1CC=O,0.2272 | |
| CCN1CCC(=O)C1,0.1933 | |
| CCCC1(CO1)C(N)=O,0.263 | |
| c1c([nH]cn1)NCC=O,0.1817 | |
| c1c2c(c[nH]1)NCCN2,0.2238 | |
| CC1C2C3C2C1C3C=O,0.2232 | |
| C1C(CO1)(C#N)O,0.2716 | |
| C1CC2(C1)C1CCC2O1,0.322 | |
| CC1CC1CC#C,0.3138 | |
| CC1(C)CC2COC2C1,0.3212 | |
| CC12CCC1C1CC21,0.3197 | |
| CCC1NC2CC12C#N,0.2528 | |
| CCC1NC1C(C)OC,0.3156 | |
| CC1CC(C2CC2)C1C,0.3406 | |
| COc1c(cc([nH]1)N)O,0.2262 | |
| O=C1NCC2(CN12)C#N,0.2684 | |
| O=CC12NC1CC2=O,0.2004 | |
| CC1C2OC2C(=O)C1C,0.2093 | |
| CC1C2CN1C2CC#N,0.2736 | |
| CCNC12CC1OC2=O,0.2363 | |
| O=CC1CCC(O1)C=O,0.206 | |
| C1COCC(=C1)C(=O)N,0.219 | |
| CC1=CC2CC2COC1,0.2432 | |
| NC(C#C)(C#N)C1CC1,0.2719 | |
| CC1(C)C2C3CC2C13,0.3705 | |
| CCCC12COCC1N2,0.3289 | |
| CC#CC1CCC(=O)C1,0.2187 | |
| CC(C)(O)C(C=O)C#N,0.218 | |
| OC1C2CC2C2CC12,0.3111 | |
| COC1CN2C(C)C12,0.2971 | |
| c12c(nc([nH]1)N)non2,0.2046 | |
| OC1C(O)C11CNC1=O,0.2688 | |
| CC1OCC2CC1CO2,0.3169 | |
| CC1(C)C[NH2+]C1C([O-])=O,0.2622 | |
| N#CC12CCNC1CO2,0.2555 | |
| CC1OC2COC12C,0.3055 | |
| OC1(CC2CN2C1)C#N,0.2572 | |
| CC(C=O)C1=CN=NN1,0.1995 | |
| CCC(=O)OCC1CC1,0.2863 | |
| CN1C2C3C1C2(C)N3C,0.29 | |
| CCC12CC(C)C1CO2,0.3098 | |
| CC1C2C3C2C2C3OC12,0.3074 | |
| CC1=NC(C#C)C2CN12,0.2489 | |
| CCC1OC(CC)C=C1,0.2471 | |
| C#CC1CC2C=CCN12,0.2361 | |
| CC#CC(CO)CC#N,0.2722 | |
| ON=C1C2CC2C11CN1,0.2353 | |
| OC1CC11CC(O)C1O,0.308 | |
| CCC1(C(=O)CO1)CC,0.2214 | |
| CC12NC1C1CC1C=C2,0.2448 | |
| FC1=NC(=N)NN=N1,0.1642 | |
| COCC1N2CC1(C)C2,0.2991 | |
| Cc1ccc([nH]1)CO,0.2274 | |
| CC1OCC1CC(C)=O,0.2243 | |
| CC1COC=NC1,0.2727 | |
| NC1=NC2CC2C(=O)N1,0.2266 | |
| CC1=COC(=N)C(F)=C1,0.1673 | |
| C1C2OC3OCC=C3C12,0.241 | |
| COCC1(C)C(C)N1C,0.2879 | |
| CCC(=N)OCCCO,0.2966 | |
| N#CC1NCC2OC12,0.2732 | |
| CC(C#CC=O)C1CO1,0.2043 | |
| CC12CC(O1)C2CO,0.303 | |
| N#CC#CC1=NCCN1,0.1647 | |
| CC1OC(=N)C(C)=C1,0.2197 | |
| CCCC1=CC2CC2C1,0.2433 | |
| O=C1C=CC2COC12,0.1764 | |
| CCOc1c(nn[nH]1)N,0.2107 | |
| COC(=O)NCCC#C,0.2978 | |
| c1cnnnc1,0.186 | |
| OC1C2COC2C1C=O,0.2158 | |
| OC1C2OC1C(=O)C=C2,0.1722 | |
| C#CC1(CC1)C(=O)N,0.2714 | |
| CC(O)C1NC1(C)C,0.3125 | |
| CCC1CC1C1CC1O,0.3203 | |
| CC1COCC(C)=CC1,0.2479 | |
| CC1CC(CO)OC=N1,0.2704 | |
| c1c(=O)onc(n1)CO,0.1608 | |
| CC1(CC2OC12)OC=O,0.2718 | |
| CC1=CC(=O)N(C1=O)C,0.1804 | |
| C1C(=CC(=O)N1)N,0.2201 | |
| COC(=O)C1NC1C#N,0.257 | |
| COC1C2CC2(O)C1=O,0.214 | |
| O=CC1OC2COCC12,0.2198 | |
| CC1(CC1)C(F)(F)F,0.3903 | |
| CC1(CO)N=COC1=O,0.2424 | |
| CC(=O)C1CN1CC=O,0.2066 | |
| CC12CC3CN(C13)C2=O,0.225 | |
| Cc1cc(c(o1)C)O,0.216 | |
| CC1(CO1)C#CCCO,0.2783 | |
| CC(C)C1NC1(C)CO,0.3035 | |
| c1c(nc2n1C=CC2)N,0.1698 | |
| CC1COC(C)O1,0.3423 | |
| CC1COC(C)C(C)=C1,0.2601 | |
| CC1(O)C2CN3CC3C12,0.2929 | |
| C1C2N1CC1=C2C=CO1,0.2224 | |
| OC1CC1OC1CCC1,0.3096 | |
| CC#CC1(CN1)C(C)=O,0.2145 | |
| OC1CC(C1)(C=O)C#N,0.2308 | |
| CC1CC(O)C2OCC12,0.31 | |
| c1c(oc(n1)CCO)N,0.2221 | |
| C1C=C(CC(=O)O1)C#N,0.223 | |
| CN1N=CC(=N)OC1=O,0.1857 | |
| CC1CC(=O)C1C(C)=O,0.205 | |
| CC1C2C(CN12)C=O,0.2146 | |
| N#CC12C3C4C(CC14)N23,0.2644 | |
| COCCC1C(C)N1C,0.2917 | |
| Cc1cnn(c1N)C=O,0.1871 | |
| CNC=[NH+]C1=NC=N[N-]1,0.134 | |
| O=C1CC2NC2C11CO1,0.2083 | |
| c1cnc(nc1C=O)F,0.1702 | |
| CC(C)(CC(=O)NC)O,0.2669 | |
| [NH3+]CCOC1=NC=N[N-]1,0.2681 | |
| CCC12CC1C(=N)O2,0.2793 | |
| c1cnc(c(n1)C=O)O,0.1691 | |
| O1C=NC2C=CC3C1C23,0.2331 | |
| OCCN1CC1CC#C,0.2854 | |
| C1C2CC11C=CCC21,0.249 | |
| Cn1cnc2c1nno2,0.1936 | |
| OCC12C3OC1C=CC23,0.2241 | |
| C1C2C1C1C2C1N1CC1,0.2866 | |
| OC1CC1C1(CO1)C=O,0.1986 | |
| OCCCC(O)C#C,0.297 | |
| COC(=O)c1cc[nH]n1,0.2355 | |
| COCC(=O)NCC#C,0.2684 | |
| O1C2C=CC3OC3C12,0.2392 | |
| CC1(C)C=CC(O)C1O,0.2589 | |
| CC(O)(CC1CC1)C#N,0.3052 | |
| CC(=O)C1OC1C#C,0.2183 | |
| C(C(CO)(C#N)N)O,0.2921 | |
| Cc1c([nH]nc1C#N)C,0.2292 | |
| CC1OC2C1CC2=NO,0.2372 | |
| CC(=O)OC(C#C)C#N,0.2701 | |
| C1C2C=C3CCCC3C12,0.2368 | |
| CC12CC1C(C)(CO)C2,0.3175 | |
| CCC(C(C)[NH3+])C([O-])=O,0.1451 | |
| C#CC(=NO)CC#N,0.2074 | |
| COCC1COC(C)=N1,0.2625 | |
| CC1OCC2CC12C=O,0.2218 | |
| N#CCC1CC1N1CC1,0.2933 | |
| C1CC(C1)OCCCO,0.3224 | |
| COC(=O)n1cccn1,0.2301 | |
| c1[nH]c2c(n1)CC(=O)N2,0.2022 | |
| CC(O)C1CC1CC#N,0.3143 | |
| CC1NC11CC2NC12,0.303 | |
| CC12CCCC(=O)C1N2,0.2209 | |
| CC1COCC(O1)C#C,0.2768 | |
| c1c(c(nc(=O)o1)O)N,0.1671 | |
| OC1CC2OC2C(O)C1,0.3299 | |
| NC1C(OC1=N)C#C,0.2587 | |
| c1cc(=O)[nH]cc1O,0.1613 | |
| CC1(CC1)OC(=N)C#N,0.2332 | |
| CN1C=CC(=NO)C1=N,0.1389 | |
| c1c(nc(cn1)F)CO,0.2065 | |
| OC1C2C1C1C2CC1=O,0.2056 | |
| O=C1C=CC(=O)C11CN1,0.1509 | |
| NC1=NN2C3CC3C2=C1,0.2048 | |
| N#CC1CC11CCC=C1,0.2414 | |
| CN=C1NC(CO1)C#C,0.2482 | |
| OC12C3C4C1C2(C#C)N34,0.2312 | |
| CCC1CC(C)C1,0.3688 | |
| c1cocc(c1=O)O,0.1959 | |
| C1CC23OC2CC2C3N12,0.3061 | |
| CN(C)C(=O)C(N)C#C,0.2576 | |
| CC(O)CC1CC=CC1,0.2639 | |
| COCCC1OC1C#C,0.274 | |
| C1NC1C12CC3CC1N23,0.3095 | |
| OC12CC1(O)C1OC21,0.2972 | |
| CCN1C=NCC1C#N,0.2428 | |
| CC1(O)CCC(=O)C1=O,0.1404 | |
| CC1CC(C)=C(C1)C#C,0.2055 | |
| CC(=O)C12CCCC1O2,0.2229 | |
| O=CC12C3OC1C(=O)C23,0.1906 | |
| COC1(CC1)C2CC2,0.3102 | |
| Cn1cnc2c1cc[nH]2,0.2079 | |
| CCC1C2C(O)C(=O)N12,0.2224 | |
| N=C1C2NCC2N1C=O,0.2129 | |
| CC(=O)C(=O)C(=O)N,0.1569 | |
| CC12OC3CCC1C2O3,0.3057 | |
| CC#CC1C2OC1C=C2,0.2286 | |
| C(CCO)CC(=O)N,0.279 | |
| OCC(O)CC(O)CO,0.3048 | |
| OC12CC(C1)OC2C#C,0.2752 | |
| c1c(nncn1)C(=O)N,0.1649 | |
| CC1=C(C(=NC)OC1)C,0.2108 | |
| COC1(CC1)CCO,0.3281 | |
| CN1N=NOC1=N,0.2064 | |
| OCC1CC1(O)C#C,0.2712 | |
| CCC12NC1(C)C1CC21,0.3386 | |
| CN=C(C(=O)C#N)N,0.1612 | |
| CC1C(CC11CC1)C#C,0.3016 | |
| COC1OCC(O)C=C1,0.2464 | |
| CNC(=O)NCCO,0.2997 | |
| CCC1C=CC2CC12C,0.245 | |
| OC1C2CCC(N2)C1=O,0.2024 | |
| CCC(C)(C)C(C)(C)O,0.3247 | |
| OC12CC1N1CC21C#N,0.234 | |
| CCC(=NO)C(C)CO,0.2488 | |
| C1CC2OC(C1)C1OC21,0.3154 | |
| N=C1OC2(CC12)C#C,0.2507 | |
| COC1OCC2NC12C,0.3097 | |
| CCCC1CCCC1O,0.3295 | |
| Cc1ccncc(=O)c1,0.1525 | |
| CC1NC(=O)OC1C=O,0.2258 | |
| CC[NH+](C)C(C)C([O-])=O,0.2563 | |
| CC(C)C(O)(C=O)C#C,0.2114 | |
| OCC(O)C(O)CC#N,0.3116 | |
| OC1CC23CC12OC=N3,0.2327 | |
| OCC(O)C(C=O)C=O,0.1968 | |
| CC1=CC2C3OC2C13O,0.2224 | |
| CC1C2OCC12OC=O,0.2459 | |
| CC(C)C(O)C1CO1,0.3386 | |
| N#CCOCC1CCO1,0.2538 | |
| CC1C=C(CC1O)C=O,0.1923 | |
| CC#CC(C)(C#N)C#N,0.2789 | |
| CC1C2OC1C1CC2O1,0.2777 | |
| ON=C1C2CC1(N2)C#N,0.2443 | |
| OC(CC#N)C1(O)CC1,0.3013 | |
| OC1COC(=N)CC1O,0.2737 | |
| CC12CC(C1)(C2)OC=N,0.279 | |
| CC1CC2NC12C=O,0.2045 | |
| OC1(CC2CC1O2)C#N,0.2747 | |
| CC12CC1CCN1CC21,0.2999 | |
| C(=O)(C(=N)N)C(F)(F)F,0.1796 | |
| CC12OC3(C)CC1C2O3,0.3229 | |
| OCC12C3CN=C1NC23,0.168 | |
| OCC1CCC(=N)O1,0.2828 | |
| OC1CC(=O)C11COC1,0.2082 | |
| C1CC=CC(=O)C=CC1,0.1816 | |
| O=CC1CC=C2CCC12,0.2059 | |
| c1c2c(ncn1)C=CC2,0.1957 | |
| NC(=O)C(CC=O)C#C,0.232 | |
| ON=C1C2C(O)C1C2O,0.2647 | |
| CC1COCC=C1C,0.2597 | |
| CC1(CC=CC1=O)C#C,0.1856 | |
| O=CC1(CC1)C1CCO1,0.2222 | |
| CCC12NC1CC(C)=C2,0.2436 | |
| C1C=CC23NC12C1OC31,0.2484 | |
| OC1(COCC=C1)C#N,0.2556 | |
| NC1=NCCNC1C#N,0.2454 | |
| CC1=CC(F)=CC(=N)O1,0.1718 | |
| COC1C(C#N)C1(C)C,0.2874 | |
| OC1CN2CC1C2C=O,0.2057 | |
| CC12C=CC3OCC1C23,0.2334 | |
| CC1=CCC2CC(C1)O2,0.2611 | |
| CN=C1ON=CC=C1C,0.1628 | |
| N#CC12NC1CC1NC21,0.258 | |
| OCC1CCC11CC1O,0.3214 | |
| CC1(CC2(CO2)C1)C#N,0.305 | |
| OC1CC1C(=O)C#C,0.1829 | |
| OCC1(CN2CC2)CO1,0.3183 | |
| OCC1OCC1C#N,0.2785 | |
| CC12NC1CC2=NO,0.2395 | |
| CC12NC1C(C)(C)C2=O,0.2153 | |
| OCC1C2CCN12,0.294 | |
| CCN(C)CC(O)C#N,0.2677 | |
| Cc1c(=NO)cc[nH]n1,0.1686 | |
| COC1C2CC1(CO)O2,0.3076 | |
| OC1C2NC1C(=C2)C#N,0.1923 | |
| CC1(C)CC=C2CCC12,0.2461 | |
| N=COC1CC1CC#N,0.2807 | |
| CC12CC1(O)COC2,0.3202 | |
| CCC12NC1C1(C)OC21,0.277 | |
| C1CCC(C1)(CC#N)O,0.3048 | |
| CN1CC1CC(O)CO,0.2843 | |
| CC(C)C(O)C(C)=NO,0.2543 | |
| CC1CC(O)C1C1CC1,0.3234 | |
| CC12C3CC1(C3)OC2=O,0.2485 | |
| CC(O)C1CCOC1,0.3006 | |
| CCCCC#CCOC,0.2833 | |
| c1cnc(nc1F)CO,0.2117 | |
| CN1C2CC3CC2(C)C13,0.2904 | |
| CC1C2C3N1C(C)C23O,0.2867 | |
| CC1(CC#N)CCCO1,0.2914 | |
| C1CN2C1C21CC2OC12,0.313 | |
| CC1CC2OC2C(C)O1,0.3351 | |
| O=C1COCC2CC12,0.2131 | |
| CCC12CC3(C)C1CN23,0.3159 | |
| COCC1NC1C,0.325 | |
| O=CNCC1CN1,0.2776 | |
| CC(C=O)C(C#C)C#C,0.2239 | |
| NC(C#C)C(N)=O,0.2595 | |
| CC1=CCC2CCC=C12,0.1966 | |
| OC1CC2NC(=O)C2C1,0.2779 | |
| C1C2C3OC22CC1CC32,0.2129 | |
| CC1C2C1C1C2C1(C)C,0.2768 | |
| OC12C=CC3OC1C23,0.2162 | |
| OC1CC11CCC11CC1,0.2995 | |
| O=C1CC(=O)C2(CO2)C1,0.1925 | |
| OC1COC(=O)N2CC12,0.2669 | |
| CC1COC(=N1)C(N)=O,0.2206 | |
| CC(=NO)CCO,0.2523 | |
| OC1=NNN=C1OC=N,0.2178 | |
| OC1C2OC(=O)C=CC12,0.2097 | |
| COC(C)C1CN1C,0.291 | |
| CC(OCC[NH3+])C([O-])=O,0.2669 | |
| N=C1OC2C1OC21CC1,0.2529 | |
| CC1=CCCOC(=N)C1,0.2488 | |
| CCN(C)C(=O)CC#N,0.2661 | |
| C(CO)COCC#N,0.2846 | |
| OCC1C2CC1C2O,0.3234 | |
| CN=c1n(cno1)C=O,0.1905 | |
| CC1OC(CC#N)C1C,0.2944 | |
| CCc1ccc([nH]1)N,0.2315 | |
| C1OC1C1=CC2CC1O2,0.2211 | |
| Cc1c(c(=O)ocn1)F,0.1916 | |
| O=C1CCC1CCC#C,0.2194 | |
| C1NC1C1=CC2CC1O2,0.2225 | |
| CC(O)C(=O)CNC=O,0.2135 | |
| O=CN1C2CC1(C2)C#C,0.2401 | |
| CC1C(O)C11OCC=C1,0.2238 | |
| CC12CC(C=C1)C1NC21,0.2547 | |
| CCC1OC1COC,0.3383 | |
| N#CC1CCC2(CC2)O1,0.2702 | |
| Cn1c(ncn1)C(=O)N,0.2272 | |
| C(=O)C(=O)n1nnnn1,0.1601 | |
| CN1C(CO)C1C(C)=O,0.2012 | |
| c1c(c(cnc1N)N)F,0.1813 | |
| c1c(coc1OC=O)N,0.1961 | |
| CC12COC1COCO2,0.3202 | |
| OCC12OC3C1COC23,0.3035 | |
| Cn1cc(cc1N)CO,0.2317 | |
| CC(C#C)C1(CO1)C#N,0.2809 | |
| OC1=NC(=N)N=C(F)O1,0.2321 | |
| OC1C2C=CC11COC21,0.2256 | |
| CCN=C1COC(=O)O1,0.2652 | |
| CCC1CCC11OC1C,0.3297 | |
| c1nc(c(o1)N)C(=N)N,0.2059 | |
| OC1C(=O)C2OCC12O,0.1932 | |
| OCCC1=NCC(=N)N1,0.2303 | |
| CC12CN1C1C2OC1=N,0.2503 | |
| C(=O)c1noc(=O)o1,0.1924 | |
| OC12CN(C1)C2C#C,0.2713 | |
| COc1ccc(o1)C#N,0.1894 | |
| CC1C2CN1C(C)CO2,0.2878 | |
| C1CN1CC#CC(=O)N,0.2197 | |
| CN1C2C3C(O)C1C23O,0.2703 | |
| Cc1c2c(c[nH]1)nn[nH]2,0.1743 | |
| CCOc1cc[nH]n1,0.2454 | |
| Cc1coc(n1)N2CC2,0.2313 | |
| COC12CC1C1OC1C2,0.3258 | |
| CC12OCC1C2C#C,0.278 | |
| CC1(CO)OCC1CO,0.3103 | |
| C1CC(=O)NC(=O)C=C1,0.1952 | |
| OCC1(CC2NC12)C=O,0.2058 | |
| COCC1(CC1)C2CC2,0.3275 | |
| CC12CCC3(O)CN1C23,0.2846 | |
| O=C1CC2C(CC#N)C12,0.2281 | |
| NC1=NC2C=CCC2O1,0.2434 | |
| CC(=N)NC(=O)OC,0.2549 | |
| CCc1c[nH]cc1OC,0.242 | |
| CC1C2CC2(C#C)C1O,0.2725 | |
| C#CC1CC2OCC12,0.2849 | |
| O=C1CCC1C1CCC1,0.2173 | |
| CN(C)C12CC1OC2=O,0.2244 | |
| CC1COCC(=O)CO1,0.2128 | |
| CC1N=C(CO)NC1=O,0.2369 | |
| c1c(onc1C#N)CO,0.2235 | |
| CNc1c(=O)cnon1,0.1557 | |
| O=CC12CC(CC=C1)O2,0.2035 | |
| COC12CC(C)(C1)CC2,0.3235 | |
| ON=C1COC(=N)OC1,0.2393 | |
| NC1=NOC(=N)N=C1,0.1473 | |
| CC1OC(=O)C1N,0.2499 | |
| CC1(CO1)C1C2CCN12,0.3122 | |
| OC(C=O)C1NC1C=O,0.197 | |
| CCC1=CN(C(=O)C1)C,0.2045 | |
| CC1OC(C#N)C1C#N,0.2804 | |
| COC1C2C3CC1(O)C23,0.3087 | |
| C1C(=O)OC1(C#N)C#N,0.2581 | |
| C#CCC1C2C3CC1C23,0.3028 | |
| Cc1nc(nn1C)N,0.2265 | |
| C(C=O)OC=O,0.226 | |
| O=CN1CCN2CC1C2,0.2562 | |
| O=C1C2C3CN1C23C#N,0.241 | |
| COC1C2C3C1CCN23,0.3211 | |
| C#Cc1nc(c(o1)N)O,0.1597 | |
| CCC1C2C(=O)OC12C,0.273 | |
| Cc1ncnc(n1)NC,0.2127 | |
| CC1OC1C1CC(=O)N1,0.2852 | |
| CC1COC2COCC12,0.3123 | |
| O=C1C2OC2C11CC1,0.2136 | |
| c1cc(cnc1)O,0.2118 | |
| CC12CCC1C=CCO2,0.2613 | |
| C1CC1NCC(=O)C#N,0.1425 | |
| COCCC(C)COC,0.3356 | |
| N=C1OC(=O)NN=C1,0.1941 | |
| C(=O)NC(=O)NC=O,0.2167 | |
| c1[nH]c(c(n1)N)CCO,0.2187 | |
| COCCC(=O)CCO,0.235 | |
| CC1=CCC2NC12,0.2482 | |
| Cc1cncc(c1F)N,0.2053 | |
| OCC12CC1C(=O)NC2,0.2665 | |
| C1CN=C(OC1)NC=O,0.2355 | |
| c1c(con1)C=O,0.2013 | |
| COc1c(nno1)O,0.1912 | |
| CN=C1OC2C3CN3C12,0.2502 | |
| OCC12CC1(O)C1CN21,0.3061 | |
| CNC(=[NH2+])C(O)C([O-])=O,0.2001 | |
| CC1(C)C2C1C1CCC21,0.3091 | |
| COCC1(C)OC1CO,0.3331 | |
| CC1(CC#CC#N)CN1,0.2239 | |
| CCCN=C1NCC1O,0.2575 | |
| COC12C=CCC1C2O,0.2302 | |
| N#CC12CN=C3OC1C23,0.1614 | |
| c1c(oc(n1)O)C2CC2,0.2315 | |
| CC12CN(C1)C2C(N)=O,0.2677 | |
| OC1CC2OC2C11CN1,0.3182 | |
| CC1=CC2NC2CC1O,0.2389 | |
| CC#CC1CC1(C)C#N,0.2619 | |
| CC1=C(C)C(=O)N=NO1,0.1996 | |
| C1C2C3C4CCCC13C24,0.355 | |
| c1c2c(on1)OCCO2,0.2145 | |
| CC12OC(=O)C3C1OC23,0.2426 | |
| CC1NC(=O)OC1CO,0.3136 | |
| CC1C2CC1(C)C1OC21,0.3329 | |
| CC(O)C1=C(C)CCC1,0.2522 | |
| COC1C2CC1(N2)C#N,0.2647 | |
| CC1=CNC(=N)C(=O)C1,0.1527 | |
| CC12OC3C4C1N4CC23,0.3069 | |
| CC(O)CC1=CNC=N1,0.2497 | |
| C1C=CC2=CCCOC12,0.1976 | |
| N#CC1=CC2C3OC1C23,0.1946 | |
| OCCC12CC1C(O)C2,0.3216 | |
| CC(C)(C#N)C(O)C#N,0.3045 | |
| CCNC1=CC(=O)NC1,0.2157 | |
| O=CC1OC2C3CC3C12,0.2174 | |
| CC1N(C)C11COC1=N,0.2541 | |
| CC12CC3(CC1C23)C#N,0.2856 | |
| CC1(C(N1)(CO)CO)C,0.3132 | |
| CCC1CCCNC1=O,0.2668 | |
| N=C1COCC(=O)O1,0.2499 | |
| CN(C)C(=O)C#CCO,0.2228 | |
| c1c(c(oc1N)O)CO,0.2265 | |
| [O-]C(=O)C12[NH2+]C3CC1C23,0.2596 | |
| CCC1CC2OC1C2C,0.3309 | |
| CN1CC1C(CO)C#N,0.2689 | |
| CCC1=NC(CO1)C=O,0.2134 | |
| C1C2C3OCCC1C23,0.3083 | |
| Cc1c(onc1O)CN,0.2373 | |
| CC1CC(C)C1C(N)=O,0.2672 | |
| COCC(C)N(C)C=O,0.2703 | |
| CC12CC3(C)OC1C2O3,0.3207 | |
| CC(=NO)C1C2CCN12,0.2315 | |
| C#CC1CC2CCC2C1,0.3024 | |
| COCC1C(O)C1(C)C,0.3134 | |
| CC1COC2=C1NC=N2,0.2135 | |
| C1OC11CCC=C1,0.2519 | |
| Cc1cnncn1,0.17 | |
| COCC1CCC(=O)C1,0.2228 | |
| CCN1C2C3C1C2N3C,0.2839 | |
| CN1CC2OC2C1C=O,0.1956 | |
| C1C=CC2C3C4C1C2N34,0.2528 | |
| CCC1C2CC(=O)CC12,0.2239 | |
| CC12CC1(N)C(=O)OC2,0.2549 | |
| CC12CC(CO)(C1)C=C2,0.2395 | |
| c1conc1NC2CC2,0.2237 | |
| O=C1OC2C3CCC12N3,0.2416 | |
| CCC1(C)OCC2NC12,0.3095 | |
| C1OC1C12CC(C1)C=C2,0.2392 | |
| Cc1ccc(=O)ncn1,0.1666 | |
| C1NC11CN2CC=CC12,0.2288 | |
| CC1C2CC3(C#N)C2N13,0.2748 | |
| Cc1nn2c(o1)ncn2,0.2352 | |
| CCC12OC(C1O)C2O,0.3039 | |
| CC12CCC1=CC(O)C2,0.2432 | |
| OC1CC2(O)C3OC2C13,0.3048 | |
| Cc1cc(cnc1C)F,0.2186 | |
| CN1C(CCC1=O)C=O,0.2005 | |
| CCC1(O)CC1(C)C#N,0.3092 | |
| CC1CN1C1CC(=O)C1,0.2196 | |
| OC1C2C3OC2C(=O)C13,0.2093 | |
| CCCC(C)CNC=O,0.2829 | |
| OC(C#N)C1NCC1=O,0.2225 | |
| N=C1C=NNN=CC1=N,0.1681 | |
| CC(=N)OCC1(O)CC1,0.2775 | |
| O=CC1COC2CN1C2,0.1952 | |
| CC(O)CCC1CC1O,0.3257 | |
| CC12OC3C1COC23C,0.3133 | |
| OCC12CN1C(=O)C=C2,0.1987 | |
| C1CC1C2=CCOC2,0.2421 | |
| C#CCC(C#C)N1CC1,0.2738 | |
| COCC1(COC1)C#C,0.2941 | |
| OCCC(=O)C1CC1O,0.2192 | |
| CC1CC1(C)CO,0.3343 | |
| CC1C=CC2(O)CCC12,0.2585 | |
| CCC(C)(CC)C1CO1,0.3394 | |
| O=CCOC1CC2NC12,0.2118 | |
| C1Cc2c(nno2)NC1,0.1873 | |
| OCC#CC(=O)C1CO1,0.2014 | |
| C1CC(=O)N(C1)C(=O)N,0.238 | |
| NC1=CC(=O)C2CC12O,0.1912 | |
| CC1(CC(=O)OC1)C,0.2783 | |
| C#CC12OC3COC1C23,0.2293 | |
| CC(=O)COC=NC,0.2136 | |
| CC1COC2(C)CN1C2,0.2899 | |
| NC1(COC1CO)C#N,0.2746 | |
| CC12CC3CC1C2C3O,0.3223 | |
| C#CC12C3CN=C1OC23,0.1571 | |
| N=C1CC(CCO1)C#N,0.2719 | |
| CCCC(CC)CC#C,0.3136 | |
| COCC(C=O)C#N,0.2206 | |
| CN1C2CC1C(=O)CC2,0.2028 | |
| CC1OCCC(=O)C1=O,0.1535 | |
| CC#CC([NH3+])CC([O-])=O,0.265 | |
| CN1CCc2c1ocn2,0.2026 | |
| CC1=C2C(O)CN2C=C1,0.2389 | |
| C(#N)c1c([nH]c(n1)N)O,0.2103 | |
| CC1[NH2+]C2C1C2C([O-])=O,0.2648 | |
| CC1=C2NCC2OC1=N,0.1963 | |
| COc1cncnn1,0.1694 | |
| OC(CC1CN1)C#N,0.2633 | |
| CC1(O)C2CC2C1=NO,0.2418 | |
| CCN1C(C)C=CC1=O,0.2087 | |
| CC1(CC1)NC(=N)C#N,0.2099 | |
| CC1(CC2(C1)CC2)OC,0.3267 | |
| CC1(O)CC=CC(=O)C1,0.1889 | |
| OCCC1C(O)C2CN12,0.294 | |
| CC12C3CN1C3C21CC1,0.3085 | |
| CC1C=CC(=NO)C1=O,0.1722 | |
| OCC1COCOC1=N,0.2523 | |
| CC1(CC1)CC(=O)C#N,0.1954 | |
| N#CC1CCCN1,0.2769 | |
| c1ccocccnc1,0.1866 | |
| CC12CC3CC4C1C2C34,0.3263 | |
| CCC12C3CC1N(C)C23,0.297 | |
| O=C1CC2CN2C11CC1,0.2073 | |
| CC(C)C12CC(O1)C2=O,0.2429 | |
| CCc1c(cno1)C#N,0.2288 | |
| C1CC23CC4OC12CC34,0.3094 | |
| N=C1NCC2(CC2)C1=O,0.1865 | |
| C1C2OC3C4CCC12C34,0.3074 | |
| CC(OC(C)C=O)C=O,0.2162 | |
| c1cnnn2c1ncc2,0.1629 | |
| CC1=CC2CC1(N2)C=O,0.2002 | |
| CN(C=O)C(=O)NC=O,0.2189 | |
| COC1C=CC(=O)C1C,0.1883 | |
| OC1C(C#N)C11CCO1,0.2718 | |
| C#CCn1cncc1O,0.2275 | |
| CC1CC2(CC12)C1CO1,0.3263 | |
| C#CCn1cc(cn1)N,0.218 | |
| CN1CCC(=C1)C=O,0.1734 | |
| O=CC12CC1C(=O)NC2,0.2163 | |
| OCC1CC11CC(=O)C1,0.2215 | |
| Cn1cc(nn1)NC=O,0.2242 | |
| CC1C(C)(O)C1(C)C=O,0.2268 | |
| N#CC1C2CC1C1OC21,0.303 | |
| Cn1c2conc2nn1,0.177 | |
| OCC12OC1C=CC2O,0.2404 | |
| OC(C#N)C1CNC1=O,0.2693 | |
| CC#CC(=O)CC(C)C,0.2081 | |
| N#CCC1(CN1)C#N,0.2884 | |
| C#CC1COCC2CC12,0.2972 | |
| CC(=O)c1noc(=O)o1,0.1963 | |
| O=CCC1C2C3NC3C12,0.2021 | |
| C#Cc1c(oc(=O)[nH]1)O,0.1966 | |
| CC(=O)C1(CC#N)CN1,0.2328 | |
| C#CCOc1ccno1,0.2371 | |
| N=C1NC(=O)C=C1,0.1865 | |
| CC12OC(CC=C1)C2O,0.2431 | |
| CC1(CC1)C1CCC1=O,0.2198 | |
| CC1C(O)CC2CC12O,0.3176 | |
| CC#CC1C(C#N)N1C,0.2437 | |
| Cc1cc(c([nH]1)C=O)O,0.1698 | |
| CN(CCC#N)CC=O,0.2089 | |
| NC1C(O)CC=C1C#N,0.2134 | |
| c1c(=O)c(noc1N)N,0.1954 | |
| CC1C2C3CC2C3C1=O,0.2202 | |
| O=C1OC2CC1OCC2,0.2467 | |
| Cc1cc(cn1C)C#C,0.216 | |
| CC1C=CCOCC1O,0.2632 | |
| CC1(CO)NC11COC1,0.2871 | |
| CCN1C(C)C1CC=O,0.197 | |
| CC12CC3CC(CO1)C23,0.3144 | |
| CC1C2N3C(C)C1C23C,0.316 | |
| c1c([nH]nn1)CO,0.2505 | |
| Cc1nc(cc(n1)F)N,0.2259 | |
| COC1C2CC1OCC2,0.3151 | |
| CC(CC#C)C(O)C=O,0.2208 | |
| CCCC1OC1CCC,0.3498 | |
| CC1N2C3CCC1(O)C23,0.284 | |
| CCC1(COC1=O)NC,0.2391 | |
| OC1C(=O)C(O)C11CO1,0.1936 | |
| CC1(O)C2CCC1C2O,0.2943 | |
| OC1CC23OCC2NC13,0.2627 | |
| CN=C1OCC11OC1C,0.2612 | |
| CC1CC2OC(=O)C2N1,0.2339 | |
| c1c(nc([nH]1)N2CC2)O,0.2258 | |
| OC1CC1C1(CC1)C#N,0.2663 | |
| C#Cc1ncco1,0.2013 | |
| OC1CCC2CC1C2=O,0.2229 | |
| CC1(OC1(C)C#N)C=O,0.2163 | |
| C(CO)N=C(N)NC=O,0.2186 | |
| CCc1c([nH]nc1O)O,0.2546 | |
| N=C1OC2C3CC1C2O3,0.2763 | |
| OC12C3OC1C1OC3C21,0.259 | |
| C(CC1CCC1)C1CO1,0.3512 | |
| CCC12CC1(CC)OC2,0.3009 | |
| CC(O)C(C)(C)OC=O,0.2764 | |
| N=C1NC2=C(ON=C2)O1,0.197 | |
| Cc1cc(c[nH]1)C#N,0.2219 | |
| CC1(C)CC2(NC12)C#N,0.2626 | |
| CC1CC1(C)C1COC1,0.321 | |
| CC(CC#C)(C#C)C#N,0.2823 | |
| CCNC(=O)COC=N,0.2544 | |
| CN1CC(C1)(C=O)C#C,0.1862 | |
| CC12CC3(O)CC1C23,0.3115 | |
| OC12CCC1CC2,0.321 | |
| CC(CC(=O)C=O)C#C,0.1536 | |
| CC(=O)C1C2N1CC2=O,0.2108 | |
| CCNc1cnncn1,0.178 | |
| O=CN1CCC(C1)C#N,0.268 | |
| CC(O)CN1C=CC=N1,0.2593 | |
| CC1OC(=N)CC11CN1,0.2813 | |
| CC1=NC2C(CC2=O)O1,0.2046 | |
| CC1OC1C1CC1(C)O,0.3269 | |
| CC1C=CC(O)C2CC12,0.2613 | |
| C1OC1C1CN=CO1,0.2724 | |
| CNC(=O)C(C)N1CC1,0.2746 | |
| OCC12NC(=O)C1C2O,0.2527 | |
| O=CC1CC11CC(=O)N1,0.2195 | |
| OC(CC1CCO1)C#C,0.2758 | |
| CC(CO)C1CC2OC12,0.3288 | |
| COCCC1NC1CO,0.3179 | |
| C#CC12COCC1O2,0.2752 | |
| C#CC12OC1CC=C2,0.2365 | |
| C[NH+]=C(N(C)C)C([O-])=O,0.1902 | |
| CC12C3CC1C3C1CN21,0.3235 | |
| CC1CC2(O)CC12C#N,0.2625 | |
| CC12CCOCC1CO2,0.3147 | |
| COC1(CC1)C(C)C=O,0.2142 | |
| CC1(O)C(CO)OC1=N,0.283 | |
| NC(=N)C1OCC(=O)O1,0.2514 | |
| C1CN1CCNC=O,0.2706 | |
| c1c(oc(=O)o1)CC=O,0.2023 | |
| CC(O)C1(CN1)C=O,0.2224 | |
| OC12CC1C(CC2)C=O,0.224 | |
| CC1COCCC(O)C1,0.3155 | |
| C1C(=O)C(=O)C(=O)CO1,0.122 | |
| CC1C2CC1C(C)CC2,0.3512 | |
| CC(CC#N)C1CC1O,0.3109 | |
| CCc1ncc(o1)N,0.2208 | |
| Cc1cnc([nH]1)COC,0.242 | |
| CCC1CC2(O)CC12O,0.2859 | |
| Cn1cc(c(=O)nc1)N,0.1858 | |
| CCOC1(CC)CC1C,0.3246 | |
| CCOCC1(CN1)C#C,0.2779 | |
| CC1C2NC2C2NC12C,0.2863 | |
| CC(=O)C(=N)N(C)C,0.1923 | |
| CC1C2C(=O)CC12CO,0.2292 | |
| OC12C3COC1OCC23,0.322 | |
| CC(C=O)(C=O)C=O,0.2049 | |
| CCC12OC1C=CC2C,0.2446 | |
| C1OC2C3NC3C3C1C23,0.2837 | |
| N=C1CNC(=O)CCO1,0.254 | |
| CC1CN(C)C(=O)C=C1,0.2015 | |
| c1c(nc(c(n1)N)N)F,0.1762 | |
| CC#CCOC1CC1O,0.265 | |
| CC1(CC(F)(F)F)CN1,0.3247 | |
| N#CC1C2C3CC2N13,0.2645 | |
| CCCCC(OC)C#N,0.3043 | |
| CC1CCC2(CC12)C#N,0.3091 | |
| CC#CC1(C)OC1(C)C,0.2778 | |
| CC1(O)CCOC(=O)C1,0.2715 | |
| C1Cc2c(n[nH]c2O)C1,0.2468 | |
| CC1CC2C(=O)NC12C,0.2711 | |
| CC(C)(c1cnno1)O,0.2326 | |
| CC12OC1CC21CC1O,0.3068 | |
| C1CC1c2c(nn[nH]2)N,0.2111 | |
| c1cc(oc1)NCC#N,0.2132 | |
| CC1CC2COC(=N)C12,0.2774 | |
| COC1CCC(O1)C#N,0.2981 | |
| CC#Cc1cc(n[nH]1)N,0.1938 | |
| CC1C2CC(CC12)=NO,0.2484 | |
| C(#N)c1nc(no1)N,0.1833 | |
| CCOCCCC(C)O,0.3173 | |
| C1NC1C1=CN=CC=N1,0.1962 | |
| CC#CC1CC(=O)N1,0.2734 | |
| c1c2c(no1)NCCC2,0.2215 | |
| O=C1CC2C1C21COC1,0.2286 | |
| CC1CN=C2OCC=C12,0.2058 | |
| O=CC1CC=CC1C=O,0.2046 | |
| O=CC1CC(C1)C#C,0.2256 | |
| c1c(c(cnn1)F)F,0.1976 | |
| CC#CC(O)CO,0.2787 | |
| NC(=O)C1CC(C1)C#C,0.2696 | |
| NC1(C#N)C(O)C1O,0.267 | |
| CCC1C2NC2C2OC12,0.3066 | |
| CC(C)OC(C#C)C#C,0.273 | |
| COC1C2CC3CC3C12,0.3104 | |
| C(COc1nnon1)O,0.217 | |
| CCN=C(C)NC(=O)C,0.2347 | |
| CC12CN1CCCOC2,0.3082 | |
| CC12C3CC1(OC23)C#C,0.2494 | |
| OCC1OC1(CO)CO,0.3136 | |
| CNC(=O)C1CC1C=O,0.2187 | |
| CN=C1COCC(=N)N1,0.2318 | |
| CCC#CC(=O)CC#C,0.2066 | |
| CC1=CC=C2C3CC3N12,0.213 | |
| c1cc(oc1)C#CC#N,0.1703 | |
| OCC1NC(C#C)C1=O,0.2067 | |
| CC1=CC2CC2(O)C1O,0.2321 | |
| CC#Cc1cnc([nH]1)C,0.2007 | |
| CC12CC3N1C3(C2)C#N,0.272 | |
| COCC(CO)C1CN1,0.3022 | |
| CC1(CC1)C(=O)C2CC2,0.228 | |
| CC(C=O)N1C=NN=N1,0.2224 | |
| CC1NC11CCC1C=O,0.2134 | |
| N=C1OC=NC(=C1)C#N,0.1644 | |
| CC1C2OCOC12C=O,0.2242 | |
| CC1(C)C2CC(O)CN12,0.2819 | |
| OC1=CN=C2C3CC3N12,0.2098 | |
| OC1C2COC1C21CC1,0.317 | |
| O=CC1=CCCC11CN1,0.1672 | |
| O=C1NC2C3NC2C3N1,0.2953 | |
| O=C1NC=NC2CNC12,0.2082 | |
| CC1(CC1)C1(CN1)C#N,0.2934 | |
| CC#CC1C(N)C1C#N,0.2481 | |
| C(=O)c1c(c([nH]n1)N)O,0.1772 | |
| N#CC1=CC2CC1CO2,0.2055 | |
| CC1(CO)C2CC(O)C12,0.3179 | |
| OCC1OC1(CO)C#C,0.2793 | |
| O=C1C2CC1C(N2)C#N,0.2046 | |
| C#CC1CC11C2CC1O2,0.2757 | |
| CC(=O)C1CCOCO1,0.2298 | |
| C#CC1(CC2CC2)CN1,0.2752 | |
| CCC1(CC1)CC1OC1,0.3377 | |
| COC1OC(=O)NC1C,0.3122 | |
| OC1=CC(F)=NC(=N)N1,0.1851 | |
| NC1=NC(OC=N)=NO1,0.2367 | |
| CC1OC2CCC2O1,0.3227 | |
| CN1C(CO)C2OCC12,0.2866 | |
| OC1CC11C2OC1C2O,0.2973 | |
| COC(=N)CNCCO,0.2785 | |
| OC1CC=CCC1O,0.2671 | |
| CC12OC1C1OC21C,0.2946 | |
| CCc1c[nH]cn1,0.2527 | |
| Cc1c(ncnc1F)O,0.2339 | |
| C1OC11CC2N=COC12,0.2635 | |
| C1C2CC3COCOC123,0.3282 | |
| OC1CC2CC1C1CN21,0.3136 | |
| OC12CCC1C2C=O,0.2169 | |
| CC1([NH2+]CC1O)C([O-])=O,0.2644 | |
| CCC1CC1C#CC#C,0.2168 | |
| COC1C(C)OC11CC1,0.3001 | |
| N#CC12C3C1C1C3OC21,0.2817 | |
| CC1=C[C-](OC1=[NH2+])C#N,0.1804 | |
| c1cnn(c1)CC#N,0.2579 | |
| C1C2OC3CC4C(C12)C34,0.2969 | |
| CC1(O)CC1(O)CC=O,0.2135 | |
| CCC#CCCC1CO1,0.2996 | |
| C1OCC11CC2NC12,0.3066 | |
| C1C(=NO)C(=O)C(=N1)N,0.1457 | |
| CC(=O)C(O)CCCO,0.2382 | |
| C1CC11C2C3CCC1C23,0.3322 | |
| C(C(CO)CO)O,0.3133 | |
| CCc1cn[nH]c1N,0.2376 | |
| CC(O)COC1COC1,0.316 | |
| N=C1NC(=O)ON=N1,0.1872 | |
| CC1=C(N)C(=O)OC1=N,0.1658 | |
| O=CNC12CC1C1NC21,0.2363 | |
| CC1CCC(=O)C11CO1,0.2033 | |
| CC1OCC1CC(N)=O,0.2641 | |
| CC1CC2CC(C2)O1,0.3181 | |
| Cc1cocc1C(C)C,0.2417 | |
| O=CC12CC1C(=O)C=C2,0.1883 | |
| COC1C2C3C=CC2C13,0.2256 | |
| OCCC1(CN1)C#C,0.2849 | |
| CCCC(CC#C)C#N,0.3049 | |
| CCC1CC1(OC)C#N,0.291 | |
| CNc1cnoc1C=O,0.1594 | |
| CCOC1C2NCC12O,0.2837 | |
| CC1C2C(C#C)N2C1=O,0.227 | |
| CCn1c(c(cn1)O)O,0.239 | |
| OCC1NC1C#CC=O,0.1966 | |
| CC1C2CC11NC(=O)C21,0.2496 | |
| COCC1C2C3CC1N23,0.3226 | |
| O=CC1C2CCCCN12,0.1934 | |
| N=C1OCC2CC12C=O,0.2233 | |
| OCC12CN3C1C(=O)C23,0.2316 | |
| CCC12COC1C1NC21,0.2922 | |
| CC1(COC1=N)NC=O,0.2691 | |
| CCC1C2(C)CC1(O)C2,0.334 | |
| OCC1C2CC3CN3C12,0.2913 | |
| CNc1c(n[nH]n1)C=O,0.1719 | |
| O=CC1OCCN=CO1,0.2169 | |
| C1CC11C2C3COC1C23,0.3257 | |
| CC#Cc1ncon1,0.2176 | |
| CCC([NH3+])(CO)C([O-])=O,0.2675 | |
| COCC(O)C1CN1C,0.2913 | |
| COC1CC2(CC12)C#C,0.2713 | |
| CC1(O)C2CC1C1OC21,0.3226 | |
| CC1C2COC(C)OC12,0.3259 | |
| CCC1CCCC1C=O,0.2258 | |
| O=C(C#C)C1CN=CO1,0.187 | |
| CC12OC1C(O)C2CO,0.3028 | |
| CCC12C3CC1C(O)C23,0.3124 | |
| O=CC1(C#C)C2CC1C2,0.2149 | |
| OC1CC(C=C1)C1CO1,0.2588 | |
| CC1CC2OCC1CO2,0.3188 | |
| O=C1NC2C3CC2C3O1,0.2991 | |
| O=CC12CC3C=CC1C23,0.2016 | |
| C1CCC2OC2CC1,0.3339 | |
| CCC1CC(O)(CC)C1,0.3197 | |
| Cc1nc(no1)C#N,0.2366 | |
| N#CC1C2C3CN2C13,0.2751 | |
| CC1(CCO1)C(=O)CO,0.2202 | |
| CC1CC2OC12C(C)=O,0.2215 | |
| CC12NC(CC1O)C2=O,0.2324 | |
| OC1CC11CNC(=O)O1,0.3069 | |
| CC(C)C(C)OC(C)=O,0.2847 | |
| Cc1ccc(o1)COC,0.226 | |
| CCC(C)C1(CO1)C#C,0.2872 | |
| CN1CC1C1OC1C#C,0.2364 | |
| CC12CC1(O)C(O2)C#C,0.2495 | |
| COC1CC(C)(C)C1=O,0.1971 | |
| CC[NH2+]CCC([O-])=O,0.2767 | |
| C1CC2COCC2=C1,0.2502 | |
| OCCC12CC1N=CO2,0.2603 | |
| C1OC23CC(C=CC2)C13,0.2372 | |
| N=C1OC2C3C=CN1C23,0.217 | |
| O=CC12CC3=CCC1C23,0.1742 | |
| Cc1ccc(o1)CCO,0.2286 | |
| CC1CCN2N=NC=C12,0.2554 | |
| CC#CC1CC2NC12,0.2821 | |
| CC1C(C#CCO)N1C,0.2409 | |
| C1OC2C1NC1COC21,0.2771 | |
| OC12CCC1=CCC2,0.2451 | |
| CCC1OC11CCC1=O,0.2042 | |
| C1C(CC1=O)C(=O)C#N,0.1686 | |
| COCC(CCO)C#N,0.3037 | |
| c1cc(n(c1)CC#N)N,0.2147 | |
| CC(C)C1C(O)C1(C)C,0.306 | |
| CC1(O)CCC11CN1,0.299 | |
| CN=C1C(O)CN1C=O,0.2237 | |
| CC12C3CC1N3C21CC1,0.3197 | |
| C1C2CC34CC(O3)C4N12,0.2924 | |
| c1c2c(nc[nH]2)n[nH]1,0.2131 | |
| O=C1CCC(C1)C#N,0.2222 | |
| CC1CC11COC(C)O1,0.3262 | |
| CC1(C)OC1C1CN1,0.3319 | |
| Cc1cc[nH]c1NC,0.2385 | |
| CN=COC1CC2OC12,0.2702 | |
| ON=C1C2C3COC1C23,0.2438 | |
| c1nc-2n[nH]nnc2n1,0.1648 | |
| O=C1CC2C3CC3C2N1,0.2757 | |
| ON=C1CC2(CN2)C=C1,0.1863 | |
| [NH3+]C1(CC1C#C)C([O-])=O,0.2504 | |
| CC1NC(=O)CC=C1C,0.2518 | |
| CCC12CN1C=CC2=O,0.1881 | |
| OC12C3CC4C(OC13)C24,0.2894 | |
| CC1CCC=CC11CC1,0.2519 | |
| CNc1c[nH]cn1,0.2203 | |
| c1nc(c(o1)NC=N)N,0.2033 | |
| OC(CNC=[NH2+])C([O-])=O,0.2585 | |
| CCCN(CC#N)C=O,0.2701 | |
| CC1OC2(C#C)C(O)C12,0.2447 | |
| CN1CCC(=O)C(O)C1,0.2015 | |
| C#CC1(CCOC1)C#N,0.2819 | |
| Cc1ccc(c(n1)O)F,0.206 | |
| CC1(CO)C2CC2C1O,0.3112 | |
| CC(C)c1cnn[nH]1,0.2527 | |
| c1c(cc(cc1F)F)O,0.2344 | |
| O=C1CCC2OC2C1,0.2277 | |
| CC1(C)CC2OC=NC12,0.2606 | |
| CC1OCC=C1C1CC1,0.242 | |
| OC1C2C(=O)NC12C=O,0.2137 | |
| CC12CN1CC(=C2)C#N,0.1907 | |
| N=C1OCC11CC2NC12,0.2576 | |
| CC12CC1OC2CCO,0.3083 | |
| COCC12CC1CO2,0.3039 | |
| CC1COC1C#CC#N,0.2206 | |
| FC1=NOC(=N)OC1=O,0.19 | |
| NC1=NC2=C(O1)N=NO2,0.1431 | |
| CCCCC(=O)N(C)C,0.2697 | |
| CC1CN2C1COC2=O,0.2877 | |
| c1c2n(cn1)C(=O)CN2,0.1702 | |
| CC(=N)OC1(C)CCC1,0.2908 | |
| CC12CC1COC2(C)C,0.3236 | |
| OC(C#C)C(O)C1CC1,0.3003 | |
| O=CCC1NC1C#C,0.2199 | |
| CC(O)(CO)C(=O)CO,0.2333 | |
| OC1(C=O)C2CCC12,0.2189 | |
| O=CC12CC1CCO2,0.2255 | |
| OCC1OCCC1C#C,0.2916 | |
| C1CC11CC2CC1CO2,0.3272 | |
| CC1C2CC1C(O)C2C,0.3253 | |
| OC1(C#C)C2NC1C2=O,0.2313 | |
| O=CCC1OCC2NC12,0.2249 | |
| C1CC1C#CC#N,0.2282 | |
| CC12CC(O)C1(N2)C=O,0.2171 | |
| CC(O)(C#N)C#CC#C,0.222 | |
| CCC1CC(C)(C)C1O,0.3115 | |
| CC1CN1C(=O)C=O,0.17 | |
| CC1=CNC=C(F)C1=N,0.1864 | |
| OC1C=C2COC2C1=O,0.2188 | |
| N=C1CN=C2C=CCN12,0.1765 | |
| CNc1cccc(c1)O,0.205 | |
| O=CC12COC3C1OC23,0.2045 | |
| CCNC(=N)C(F)(F)F,0.2486 | |
| CC1NCCOC1C#N,0.2628 | |
| Cn1cc(c(c1)OC)N,0.2256 | |
| OC1CC2CC1N=CO2,0.2671 | |
| O=COC12CC(C1)C2,0.279 | |
| CCN(C)C(=O)OC,0.2971 | |
| C1CC12COC(=N2)C=O,0.168 | |
| c1cnc-2nc[nH]nc12,0.1496 | |
| Cn1c2ncnn2nn1,0.2209 | |
| CC1C2C3(C)CN3C12C,0.2868 | |
| CC1C2CCC1C(=N)O2,0.2856 | |
| CC1(N)C2CC1(N2)C#N,0.2656 | |
| O=CC1NC11CCC1=O,0.1992 | |
| OC1C=C(C#N)C2NC12,0.2029 | |
| CC12CC3(CO)C1CC23,0.3356 | |
| CC1=NC(=N)OC(N)=N1,0.1974 | |
| N#CCCC1CN1,0.2918 | |
| CCCCC(C)(N)C#N,0.301 | |
| NC(=[NH2+])C1NC1C([O-])=O,0.2561 | |
| CCc1ccnc(=O)o1,0.1829 | |
| CCC1(O)C(C)OC1C,0.3023 | |
| CC12CNC(=O)C1N2,0.2573 | |
| c1cc2c(nc1)NCC2,0.1887 | |
| CC1CC2OC3CCC123,0.3005 | |
| COCC1=CCCC1O,0.2604 | |
| CC(CNC(N)=O)C#N,0.3013 | |
| OCC1C2CC(=O)C1O2,0.2107 | |
| CC1CNC(=O)C(C)C1,0.2651 | |
| CC(=O)C1(CC1)C(=O)N,0.224 | |
| O=C1C2CC(O2)C1=O,0.1417 | |
| c1cnc(cc1C=O)O,0.1698 | |
| CC1(CC1C#C)OC=O,0.2557 | |
| OCC1COC1C1CN1,0.3098 | |
| CCC1=NCCC(C)O1,0.2737 | |
| O=CC1CC2(CC12)C#N,0.2135 | |
| CCC1OC(C)C11CO1,0.3272 | |
| Cc1cc(n[nH]1)C=O,0.2004 | |
| C1C2C=CC3CCCC123,0.2471 | |
| CC1(CCN1)C(F)(F)F,0.3063 | |
| CC1C(C2CO2)C1(C)O,0.3197 | |
| N#CC1NC1C1CC1,0.2864 | |
| C1OC23CC4C(C2)C4C13,0.3189 | |
| CC1(COC1)CCO,0.3141 | |
| C1C2CC1C1OCC1=C2,0.2372 | |
| NC1(C#N)C(O)C1CO,0.2758 | |
| CC12CC3(CO3)C1CO2,0.3066 | |
| CN1C2CC(CC=O)C12,0.2139 | |
| c1cc(=O)[nH]c(c1F)N,0.1643 | |
| CC(O)C1COC1C,0.3061 | |
| CCC1OCC1(O)C#N,0.2714 | |
| O=C1C2CCC11COC21,0.2292 | |
| CC1OCC23CN(C2)C13,0.2877 | |
| CC(O)C12OC1CC2O,0.3229 | |
| CC1(O)C(O)C1(C)CO,0.2968 | |
| C1C2C3OC4C=CC2C134,0.1774 | |
| C1=CC(=O)NC1=O,0.1749 | |
| C#CCc1c[nH]nc1O,0.2471 | |
| NC(=O)C12COC1C2O,0.2571 | |
| CNC1=NON=NC1=N,0.1579 | |
| C1C2C3OC4COC2C134,0.2383 | |
| CC12CC3C=CC1(C)C23,0.2346 | |
| C1CN2C3COCC23C1,0.3056 | |
| CC(C)(O)C1(CO)CN1,0.2969 | |
| C1C2NC22CC1OCC2,0.3101 | |
| CCC1COC2CC2O1,0.307 | |
| CC12CC3OC3C1C2O,0.2996 | |
| CC1(CCC=O)CCO1,0.229 | |
| CC1(COC1)C(C)(C)O,0.292 | |
| CC1(C)C(NC1=O)C#C,0.2678 | |
| CCC1CC11CC2NC12,0.3061 | |
| CC1(C)OC1C#CC#N,0.2228 | |
| CC1CN1C(=O)N(C)C,0.2773 | |
| OCC1C2CC1C(=O)N2,0.2577 | |
| CC1(C)CC(O)C(=O)O1,0.2729 | |
| OCC1C(CO)N1C=O,0.2505 | |
| CC1CN2C(C3CO3)C12,0.3052 | |
| NC(C#N)C(C#C)C#C,0.2691 | |
| c1ccoc(=O)c1,0.1788 | |
| CCC(=O)C(O)C1CC1,0.2334 | |
| C#CCC1NC1CC#C,0.2973 | |
| c1(=O)n(nno1)C(=N)N,0.2042 | |
| CC1(O)C(O)C1(N)C#N,0.2788 | |
| c1coc2n1cnn2,0.227 | |
| COC1CCNC1=O,0.2503 | |
| O=CC12OC3CC1NC23,0.2005 | |
| C#CC(C#C)OC1CC1,0.2619 | |
| CC1CC2COC(C)C12,0.3167 | |
| COCC1CCOC1,0.3318 | |
| CCC#CC1OC1CO,0.2729 | |
| COCC1C(O)C1C#N,0.2831 | |
| N=C1OCC1NCC#N,0.2611 | |
| N=C(NCC#N)C1CO1,0.2551 | |
| CC1CC2(C)CC12C#C,0.2653 | |
| NC(=O)NC(CO)C=O,0.2242 | |
| CCC(O)C1CC2OC12,0.3165 | |
| CC12C3C4C3N3C(C13)C24,0.3082 | |
| c1c2n(cn1)C(=O)OC2,0.2178 | |
| Cc1cc(ccc1N)F,0.1978 | |
| CC1(O)C2CC=CC1O2,0.2345 | |
| CCC12CC3(O)C(O1)C23,0.2895 | |
| CC(C#N)(C#N)N=CN,0.2499 | |
| N#CC1CC(O1)C1CO1,0.2718 | |
| CC1C=CC2NC2C1C,0.2438 | |
| [O-]C(=O)C[NH2+]CC1CO1,0.2698 | |
| CCC1(O)COC1(C)C,0.2991 | |
| OC1(CC=O)CN2CC12,0.2224 | |
| C#CC12CN3C(CO1)C23,0.2635 | |
| CC(CO)C1CN1C,0.2962 | |
| COC(=O)C(=O)CCO,0.1823 | |
| CC1NC(=O)C1O,0.2703 | |
| OC1CN(C=O)C(=O)C1,0.2162 | |
| CCCC1CC(=O)O1,0.2861 | |
| CC(CO)C(O)C=O,0.2244 | |
| CC1=NC(CCO1)C=O,0.2183 | |
| NC1=NC2CC2C1=O,0.1734 | |
| CC1(C(=O)CCCO1)C,0.2108 | |
| COC1OC(=O)NC=C1,0.2291 | |
| Cc1ncc(cn1)C#C,0.1991 | |
| C(=O)Nc1n[nH]nn1,0.2258 | |
| CC(NC=O)C1CCO1,0.2815 | |
| N=C1NCCCC1=O,0.1866 | |
| CC1CC(N)(C1)C#N,0.2936 | |
| Cc1ccc(o1)C(=O)C,0.1836 | |
| CC(C)c1cnno1,0.2344 | |
| CC1(CO)NC2COC12,0.283 | |
| Cc1cnc(o1)NC=O,0.2051 | |
| CC12CC(O1)C(=O)OC2,0.248 | |
| CC1(C)OC2CC2C1=O,0.2185 | |
| N=C1OC2=C(O1)N=NO2,0.136 | |
| CC1C2CC3(C)CC1C23,0.3364 | |
| CC1CC2CC(C)C12,0.3313 | |
| CCC#CCC(C)C,0.297 | |
| CCN=CN(CC)C=O,0.223 | |
| c1c(c[nH]c1C2CC2)O,0.2217 | |
| CC(=O)OC,0.2859 | |
| N=C1NC=NC(=N1)C#C,0.1617 | |
| CC1(CC1CO)C#N,0.3123 | |
| C#CCC1CC11CCO1,0.2804 | |
| CC1=CC2CC3C1C23O,0.2381 | |
| FC1=NOC(=N)C(=N)N1,0.1988 | |
| CCC1C=CC2NC12C,0.2407 | |
| CC1OC(C)C2(C)CC12,0.3341 | |
| OC1C2C(C=O)C2C1=O,0.2065 | |
| CC1CC(CCC#C)C1,0.3152 | |
| CC12CC1C1OC2C=C1,0.2411 | |
| OCC1C2CC(CO)N12,0.2893 | |
| ON=C1C=CCN2CC12,0.1847 | |
| N=C1CC2CC(=O)C2O1,0.199 | |
| C1CC(C1)N=C2CCO2,0.27 | |
| O=C1NC2CNC2=C1,0.212 | |
| COC(CO)CC=O,0.2237 | |
| CC12C3C1C1(C)C3C21C,0.2987 | |
| CC12CC1C=CN2C=O,0.2028 | |
| COCC1CC(C1)OC,0.3295 | |
| OCC12CC3C1N3C=N2,0.2376 | |
| OC1(CC1)C12CCC1O2,0.3161 | |
| CCC12CC=C3CN1C23,0.1724 | |
| CC1C2CC(CC12)C#N,0.3159 | |
| CN=C1CC(CO1)C#N,0.2634 | |
| C1CC(O1)C1=COC=N1,0.244 | |
| Cc1coc(n1)CNC,0.2346 | |
| CN1C2CC2C11COC1,0.2884 | |
| Cc1c(con1)CC#C,0.2505 | |
| C#CC1C=C2CN3C1C23,0.1717 | |
| Cn1cc(cc1O)O,0.2333 | |
| CC1(C)NC1(C)CC#C,0.2838 | |
| C#CCc1cocc1N,0.2198 | |
| O=C(C#C)C1C2CCC12,0.1924 | |
| CC1C2CC1(O)C(=O)C2,0.2298 | |
| COC1(C)C(C)C1C,0.3125 | |
| COC(CO)(C=O)C=O,0.1959 | |
| CC#CC12NC1CC2=O,0.2104 | |
| CCCC12CC(O)C1N2,0.314 | |
| Cn1c(cnc1C#C)O,0.1926 | |
| N=C1OC2CC1C2C#N,0.2686 | |
| CC1C2CC=CC1O2,0.2379 | |
| OC12C3CC1C(C=O)C23,0.2214 | |
| OCC1CN2N=CN=C12,0.269 | |
| C1C2(COC2)OC(=O)N1,0.3098 | |
| c1[nH]c2c(n1)CCCO2,0.2351 | |
| C1CC1C#CC1CN1,0.263 | |
| OC1CCC1NC=O,0.2781 | |
| NC(=O)C#CC(O)C#N,0.2298 | |
| CC12CC(C)(C1)C2C#C,0.2953 | |
| OCC(O)C1COC1,0.2916 | |
| COC1(C)CC11CCC1,0.3261 | |
| CC1C2CC(C)(O)CN12,0.2789 | |
| CC12OC3C1C(C#C)C23,0.2747 | |
| OC1CC2(CC#N)NC12,0.273 | |
| CC1CC1CC#CC#N,0.2432 | |
| CC(=O)NC=NCC=O,0.2147 | |
| CC12OCC3C=CC1C23,0.2269 | |
| O=CNCC1CC2CN12,0.2778 | |
| C1CCc2c(nno2)C1,0.2216 | |
| CC(C)n1cccc1N,0.2407 | |
| OC12CC(CC1)C2C=O,0.2186 | |
| C1C2CN1C1=C2ON=N1,0.1617 | |
| CC1(C)CC2C(O)CC12,0.3215 | |
| CC1C(O)C2CN12,0.2923 | |
| O=CC1OC1C(=O)C#N,0.1617 | |
| CC(C)([NH3+])C#CC([O-])=O,0.2219 | |
| CC1(C)C2OC2C11CC1,0.3307 | |
| c1c[nH]c(cc1=NO)F,0.1701 | |
| CCOCC(CC)C#C,0.3073 | |
| CC12N=C(N)C3OC1C23,0.2252 | |
| c1c(nc([nH]1)CC=O)O,0.1528 | |
| CC12CCC(O1)OCC2,0.3265 | |
| C1OC2CC1C1OC1C2,0.3307 | |
| CC12CCC1C2(O)C=O,0.2169 | |
| COC1C(O)C(O)C1=O,0.1779 | |
| CC(C)C1=CCC2OC12,0.2437 | |
| CCc1ncncn1,0.2187 | |
| CNC(CC1CN1)C#N,0.271 | |
| CC1CCC2=NC=CN12,0.2511 | |
| c1nc(nn1C2CC2)O,0.2405 | |
| CCC(C#C)(C#C)OC,0.2783 | |
| CC1C=CC(C)C1C#N,0.2648 | |
| CC1CC2(C1)CC(C)O2,0.3173 | |
| O=C1CN2CC2C11CN1,0.1968 | |
| OC12CC(C1)C=CC2,0.2548 | |
| CNC(=O)CCCC=O,0.226 | |
| CCOC(=N)C(O)C#C,0.2796 | |
| CC1(C(=CC(=O)O1)N)C,0.2236 | |
| CCC1(NC1C)C1CO1,0.3207 | |
| Cn1c(cnn1)N(C)C,0.2281 | |
| CC1(C#N)C2CC1N2,0.2758 | |
| C1CNC(=O)OC=NC1,0.2532 | |
| CC(C)C12CC1(C)CC2,0.3148 | |
| CC1CCC2OC2CC1,0.3344 | |
| C1C2NC2C11CCCC1,0.3086 | |
| C1CC2(CC1=O)COC2,0.2202 | |
| CC1C2CCC1C(=O)C2,0.2222 | |
| CNC1C(CO)OC1=O,0.2416 | |
| C(=O)(N)N,0.3051 | |
| OCC12NC3CC1OC23,0.2972 | |
| C1CC12CCO2,0.3051 | |
| CCC1(O)CC(C)C1C,0.3216 | |
| CCOC1CC1CO,0.3343 | |
| O=C1CC(=O)C2CC2N1,0.217 | |
| O=CC12CC1C=CC2,0.224 | |
| CC1(O)CC2C3CC2C13,0.3328 | |
| CC1=CC(=N)NN=C1F,0.1569 | |
| OC1C2OC=NC1C=C2,0.2329 | |
| OC1CC2(CCC2O)C1,0.2964 | |
| CC1C2C=CCC=CC12,0.253 | |
| O=COC1CC2CC2C1,0.2849 | |
| CC(C)(CC=O)O,0.2242 | |
| CC1NC1(C)C(C)=NO,0.2409 | |
| O=C1NCC1NCC#N,0.2573 | |
| N#CC12CCC1OCC2,0.2924 | |
| OC1C2CC2(O)C11CN1,0.3106 | |
| CC12CCC11CC(C1)O2,0.3184 | |
| C#CC1NC1(C#C)C#N,0.2434 | |
| N#CC1=CC2OCC1O2,0.2044 | |
| N=COCCCNC=O,0.2765 | |
| CCC12CC(C=C1)C2C,0.2364 | |
| CC(C#N)C1(C)CCO1,0.2905 | |
| CC(C#C)N1C2CCC12,0.29 | |
| CC1(CO)NC11CCC1,0.2997 | |
| CC#CCOC(=O)NC,0.2841 | |
| Cc1cc(oc1)NC=O,0.197 | |
| CC12CC(C1)C1(CC1)C2,0.3475 | |
| CCC1CNC(=O)OC1,0.3065 | |
| CC12CC(CC1=O)C=C2,0.204 | |
| O=C1CC2C(CC#C)N12,0.2338 | |
| CC1C2(C)OC(=N)C12C,0.2762 | |
| CN=C1NC2C(N)C12O,0.2393 | |
| O=C1CC2C3C4CC13N24,0.217 | |
| CCC(C#N)C(F)(F)F,0.3524 | |
| CC1N=COC2COC12,0.265 | |
| CC1CCOCC1CO,0.3124 | |
| C1CC(C1)OC2COC2,0.3143 | |
| C1CN1C1C2CC1CC2,0.3255 | |
| O=C1C2C3OCC1C23,0.2385 | |
| CC12CC34CCC(C13)N24,0.323 | |
| CNc1ncno1,0.2411 | |
| CCC1CCCN1C=O,0.2648 | |
| OC1CCC2C1OC2=O,0.2792 | |
| CC12OC3C(C13)C2C=O,0.2081 | |
| CN1CC1C([NH3+])C([O-])=O,0.2549 | |
| O=C1OCC1N1CC1,0.2394 | |
| O=C1COC2CC1C2,0.2276 | |
| CC(O)C1=NCCCO1,0.2711 | |
| OC1C2CCCC1C2O,0.3106 | |
| CC1C2CC(C1C)C2=O,0.2303 | |
| C1C2C3CCC4C1C4C23,0.3102 | |
| CC(O)C#CC(C)O,0.2872 | |
| CCC(=O)C(C)(C)OC,0.2302 | |
| C1CC1(CCO)CC=O,0.2243 | |
| N#CC1CC2NC2CO1,0.2785 | |
| CC1C2N1CC21CC1O,0.2953 | |
| CC1(CO)C2CN=CN12,0.2378 | |
| N#CC1CCC11CCO1,0.2819 | |
| C(=O)NC(=O)NC(=O)N,0.2313 | |
| CC(=NO)C1C(O)C1O,0.2114 | |
| Cc1cnoc1OC,0.2301 | |
| COC1CC(O)C(C)O1,0.3324 | |
| COc1c(nc(o1)N)O,0.2197 | |
| ON=C1C(O)CC11CN1,0.2202 | |
| C(c1c(nc([nH]1)N)O)O,0.2181 | |
| CC12N=C3OC4C1C2C34,0.155 | |
| CC1(C)CC2OC1C2O,0.3352 | |
| OC1COC(=N)C2CC12,0.2706 | |
| C1CC2(C1)CC1CC2C1,0.3688 | |
| CC1(C#N)C2CC=CC12,0.2392 | |
| NC1(CC1OC=N)C#N,0.2289 | |
| CC(C)(C=O)NCC#N,0.2193 | |
| c1cnc([nH]1)NCC#N,0.2263 | |
| c1coc2c1cncn2,0.1997 | |
| CN1N=CC(=N)N=C1F,0.1848 | |
| CC12C3CC(C13)C2C#N,0.2901 | |
| CC(O)C1OC2CCC12,0.3016 | |
| CC1CC(=O)C11CCO1,0.1958 | |
| COCC(O)C1CCC1,0.3232 | |
| c1cnc(cc1C#N)F,0.2033 | |
| CC1C2C3C(O)C1N23,0.3048 | |
| CN(C)C1C2NC1C2O,0.2656 | |
| CCC(=O)CCCO,0.2356 | |
| CC(C)OCC#CC#N,0.2313 | |
| OC(C1CN1)C1CC1O,0.2848 | |
| CCc1c(coc1C)C,0.2329 | |
| CC1OC2(CC1C2)C=O,0.2219 | |
| CC12OC3CC(C=C1)C23,0.2345 | |
| COc1c(cn[nH]1)C#N,0.2384 | |
| CC1COC(=N)CN1C,0.2502 | |
| Cc1c(c(no1)N)C=O,0.1799 | |
| C1C2OC=NC1C1NC21,0.2673 | |
| C1C2CCC3=C2N1N=C3,0.1976 | |
| OCC(O)C1CN1,0.2953 | |
| C1CC=CNC(=O)C1,0.216 | |
| COC(=O)N1CC1C=O,0.212 | |
| Cc1c(coc1N)NC,0.2224 | |
| C1C2CC=CC3COC123,0.2444 | |
| CC1CC2C(CCO)N12,0.2964 | |
| OC1CC2OC=NC2C1,0.2705 | |
| CCC#CC(C)(C)CC,0.301 | |
| CC1C2CCCOC12C,0.3163 | |
| OCCC12CC1NC2=O,0.2518 | |
| O=C1CC23CC(C2)C3O1,0.2781 | |
| CC1C(O)C1(O)C(C)=O,0.2252 | |
| OC1CC=CCNC1=O,0.2599 | |
| CC1(CC1)N=CNC=O,0.2169 | |
| C1CN(C1)CCC#N,0.2686 | |
| C1C2OC3(C12)C1CCC31,0.302 | |
| O=C1CC2CC2N2CC12,0.2044 | |
| CC#CC12CC1CC2=O,0.2218 | |
| CCC12C3CN1CC23O,0.2883 | |
| CC1=NC(C)(CO1)C=O,0.2131 | |
| ON=C1CCCOC1=N,0.213 | |
| OC1C2C3C1N=CN23,0.2292 | |
| CCCC1COC(=O)C1,0.2781 | |
| CCOC1OCC2OC12,0.3348 | |
| CC(C)(C)C(C#C)C#C,0.2924 | |
| CC1CC2(CC2)C(C)=C1,0.2447 | |
| O=C1CC2CCN=C2N1,0.2465 | |
| C1C=Cc2c1c(no2)O,0.1895 | |
| Cc1cc([nH]c1N)CO,0.2212 | |
| COC1CC2OC3C2C13,0.3059 | |
| CC1(COC1)C#N,0.2909 | |
| CN=C(NC=O)N1CC1,0.2249 | |
| NC(=[NH2+])C1=COC(=N)[N-]1,0.1704 | |
| CCOCC1CCCO1,0.3192 | |
| OC1CN2CC3C1C23,0.2852 | |
| CC12CN1C=CC2=NO,0.1784 | |
| CCC1(C)CN1CCO,0.308 | |
| C1N2CC=CC3OCC123,0.2421 | |
| CC12OC(=N)C3CC1C23,0.2692 | |
| C1NC11CN2CC12,0.295 | |
| OC12CC(CC1=O)C=C2,0.2073 | |
| CC12CCC1(CC2)C#C,0.2802 | |
| C1CC1C12CC3C(C1)C23,0.3325 | |
| c1c2c([nH]n1)CCCN2,0.2206 | |
| O=CNC12CC(C1)C2=O,0.2561 | |
| N=C1NN=CN1C=O,0.181 | |
| c1coc2c1nc([nH]2)N,0.2146 | |
| OCCC1OCC1C=O,0.2163 | |
| CC1C2C1C(C)OC2C,0.3223 | |
| O=CC1CC2N1CC2=O,0.1932 | |
| COc1c(c(n[nH]1)O)O,0.2395 | |
| COC(=O)C(C)CO,0.2808 | |
| c1c(cn2c1OCC2)O,0.2266 | |
| c1cnc([nH]1)N2CC2,0.2473 | |
| C1C2C=CC3=C2N1N=N3,0.174 | |
| C(C(=O)N)OC(=O)C#N,0.2088 | |
| CC#CC12CC(N1)C2O,0.2683 | |
| C1C(=CNC(=O)O1)C#N,0.1954 | |
| c1c(c(on1)C(=N)N)N,0.1747 | |
| C1CC12CN=COC2=O,0.2478 | |
| CC1CC(N1)(C=O)C#N,0.2046 | |
| C1CC12C(=CC(=O)N2)N,0.2162 | |
| C1CC=CC=CC1,0.1902 | |
| CCC(C)(C)NC(=O)N,0.3001 | |
| CCN=COCC#C,0.2672 | |
| N#CC12OC3CCC1C23,0.2479 | |
| OC1CC1CC#C,0.3143 | |
| CN1C2C1C1C3CN1C23,0.2977 | |
| OCC12CC3CC1(O)C23,0.3005 | |
| CCC(C)CC(N)C#N,0.2966 | |
| NC(=O)C1N=CNC1=O,0.2178 | |
| CC1C(C)C1C(O)C#N,0.2953 | |
| Cc1coc(c1O)CO,0.2284 | |
| OCC1(CC2NC12)C#N,0.2844 | |
| N=C1OC2C3CCC12O3,0.2582 | |
| c1c2c(no1)CN=C2N,0.2035 | |
| c1c(nno1)C=O,0.2017 | |
| c1conc1C(=O)CO,0.1997 | |
| C1C2CC1CCCCC2,0.3412 | |
| CC(O)C1OC(C)C1=O,0.2158 | |
| c1cc(c(cc1O)N)F,0.2038 | |
| C#CC#CC#CCC=O,0.1801 | |
| CC1(OC=N)C2CCC12,0.2782 | |
| CCC1COC(C1)C#N,0.297 | |
| CC(C)Oc1cnno1,0.2187 | |
| N=C1NC(=O)CC11CN1,0.2386 | |
| CC1(CO)OCC2CC12,0.3233 | |
| CN1CC(C)(C)C1C#N,0.2513 | |
| O=C1C=CCC1CC#N,0.1918 | |
| Cn1cnc(c1N)C#N,0.2181 | |
| COC1CC11CC=CC1,0.2584 | |
| CCC1C2CC=CC1O2,0.2372 | |
| NC(=O)CC1CCC1O,0.2784 | |
| C#CC1OC1C#N,0.2651 | |
| CC(C)C1COCC=C1,0.264 | |
| c1c(c(n[nH]1)O)NC=O,0.2168 | |
| OC1CC2COC2C1,0.324 | |
| CC(O)C1C2C3CC1N23,0.3013 | |
| CC(C)C(=O)CC#C,0.2294 | |
| Cn1c(ccn1)N2CC2,0.2414 | |
| OC12CCN3C1CC23,0.2969 | |
| C#CCC#CC(F)(F)F,0.2818 | |
| OCC1OC(=O)N2CC12,0.2825 | |
| CC1(O)CC1CCC=O,0.2265 | |
| OC1CN=CNC(=O)C1,0.2194 | |
| CCC12OC3C1C(O)C23,0.298 | |
| CC(O)CC1OC1C,0.316 | |
| C#CC(COC=O)C#C,0.2795 | |
| CC1(C)C2C3C4C3N1C24,0.2947 | |
| CCCC1CCC1O,0.3274 | |
| CN1C2C=CCC(=O)C12,0.2091 | |
| OC12C=CC34CN(C13)C24,0.2193 | |
| CC1=COC=NC1=N,0.2072 | |
| CC1(N)C2NCC12C#N,0.2372 | |
| CCC1C(OC)C1OC,0.2975 | |
| OC1CC11CC(=O)O1,0.2826 | |
| CC1=CCOC1CC=O,0.2173 | |
| C1CC1(COCC#N)O,0.2643 | |
| C1OC2C3CC(C3)C12,0.3303 | |
| CC1(C)OC2C3CC2C13,0.3236 | |
| C#CC12COC3C(O1)C23,0.2351 | |
| CC(=O)N(C)C(=N)C=O,0.1963 | |
| O=C1C2C3CC1CC2O3,0.2162 | |
| COC12CC1C(C)(C)C2,0.3285 | |
| CCC12CC1CC2OC,0.3226 | |
| CC#CC1COC(C)O1,0.2844 | |
| CCCc1[nH]ccn1,0.25 | |
| C1CC12CC(C2)OC=O,0.2852 | |
| CC1C2COC1CCC2,0.3165 | |
| CC#CC(=O)NC(=O)N,0.2136 | |
| CC1COC(=O)C1O,0.2759 | |
| N#CCNC1=CN=NO1,0.1783 | |
| CNC(=O)C1(CC1)OC,0.2695 | |
| C1CCN(C1)C(=O)C#N,0.217 | |
| c1nc(nc(n1)N)C#N,0.1946 | |
| CCC1OCCC1OC,0.3232 | |
| CC1C2CC1C2(O)C=O,0.2188 | |
| CCCC1OCC1=O,0.2246 | |
| C1CCC(=O)OCC1,0.2628 | |
| OC12COCC11CC2C1,0.3099 | |
| CCC1COC1C#C,0.2735 | |
| CC(C#C)C(N)C#N,0.2889 | |
| CCC1CCC2COC12,0.3194 | |
| CC12CC3CC1(O)C2O3,0.2882 | |
| OC12CC(C1)C2C#C,0.2991 | |
| C1C2C=CC3(CCC3)C12,0.2419 | |
| CNC(=O)C1NC1C,0.2644 | |
| COCC1C(O)C2CN12,0.2985 | |
| CCCCC(=O)C(=N)N,0.1973 | |
| OC12CC1OC2C1CN1,0.2901 | |
| CC1(O)CCC1OC=N,0.2776 | |
| OC12CC1N(CC#C)C2,0.257 | |
| OCC1CC(CO1)C#C,0.2975 | |
| C#CC12CC3C(C=C1)N23,0.2162 | |
| CCC12CC3OC1(C)C23,0.2982 | |
| CCC1CCC=CCO1,0.263 | |
| COC1C2C3C(C)N2C13,0.305 | |
| CC#CC1(O)C(O)C1O,0.2477 | |
| CCC1C2CN(C=O)C12,0.2574 | |
| CNc1c([nH]cn1)CO,0.2058 | |
| C1C2OC3COCC2C13,0.321 | |
| CC1=CCCC(C1)C#N,0.2601 | |
| C1CNC(=O)NCC=C1,0.2341 | |
| CC1(O)CCN=COC1,0.255 | |
| CNC(=NC)C(=O)C#N,0.1511 | |
| CC1CC2(CN2)CC1=O,0.2153 | |
| FC1=CNC=CC1=N,0.1882 | |
| OC(C#C)C1(CO1)C#N,0.2729 | |
| CC1OC2(C)C(C)CC12,0.3137 | |
| CC(CCC#N)CC#N,0.3444 | |
| CC1=NC(=NO1)C1CO1,0.2419 | |
| CCc1nnn(n1)C=O,0.2086 | |
| CCOC(C=O)C#N,0.2229 | |
| C#Cc1c(cc([nH]1)N)N,0.1828 | |
| CCCOCC1CN1,0.3229 | |
| COC1C(O)CC11CC1,0.3121 | |
| CC1CC2(C)C(C#C)N12,0.2545 | |
| CN=C1C=CNC(F)=C1,0.1796 | |
| c1c(onn1)OC(=N)N,0.2333 | |
| OCC1=CC2OCC2C1,0.2514 | |
| CC12C3C1C1=CC2C3C1,0.1177 | |
| CC(C)C#CCCO,0.3014 | |
| OC1CC2CC2(C1)C#N,0.3088 | |
| CC12CN1C(CC2)C#C,0.2811 | |
| CC1(CC1C#N)C#N,0.2908 | |
| CC1CC=C(C)CC=C1,0.2493 | |
| O=C1CNC1C#N,0.2197 | |
| COC1=NCC(CO)N1,0.2707 | |
| COCC12CN1CC2=O,0.2238 | |
| C1CC12C(=CCO2)CO,0.231 | |
| CCCC1CN1CC#C,0.2655 | |
| C(CC1COC1)C1CO1,0.3219 | |
| c1ccncocnc1,0.1919 | |
| CC1CC2OC1(C)C2O,0.3106 | |
| CC12CC(OCO1)C=C2,0.2458 | |
| CC#CCC1(CO)CO1,0.2937 | |
| C#Cc1c[nH]nc1C#N,0.2123 | |
| C#CCOC1CC(=O)C1,0.2214 | |
| CC1CC23CC(N12)C3=O,0.233 | |
| CCC12CC3CC3C1O2,0.3316 | |
| C(C(=O)N)N(C=O)C=O,0.2167 | |
| CC1(C#N)N2CC1(N)C2,0.2624 | |
| O=C1CCC(OC1)C#N,0.2133 | |
| COC(C)C1OCCO1,0.3204 | |
| Cc1coc(n1)C(=O)N,0.2073 | |
| CCC1COCCO1,0.3249 | |
| CC1OC2CC2(O1)C#C,0.2658 | |
| CN1CC2(OCC12)C=O,0.1806 | |
| CC1=CCC2C(O)CC12,0.255 | |
| CCC#CCCOC=N,0.2724 | |
| CC#CCCC(C)C#N,0.2837 | |
| C(CO)N=COC=O,0.2383 | |
| C1CC(C1)CC#CC#N,0.2438 | |
| CC(C)(O)C1(CO1)C#C,0.2782 | |
| CC(O)C#CC1CO1,0.2696 | |
| OC12C3CC1C(=O)OC23,0.2633 | |
| CC12OC1CC=CC=C2,0.1995 | |
| CCC1=CCC2C(C)C12,0.2441 | |
| OC1CC23CC(C=C2)C13,0.2173 | |
| OC1C=CC(=O)C1C=O,0.1817 | |
| OC1CC=CC(C1)C#C,0.2631 | |
| CN1C2COCC12CO,0.2973 | |
| OC1C2C=CNC(=O)C12,0.2115 | |
| CCC1(C)C2CC2C1O,0.3151 | |
| OC(C#C)C(O)C1CN1,0.2908 | |
| CC12CCC1(O)C2C#C,0.2638 | |
| CN1C(CO)CC1C#N,0.2548 | |
| CC1OCC=C1C(C)=O,0.1836 | |
| N=C1CC2=C(N1)OC=N2,0.207 | |
| OC1(C=O)C2CC1OC2,0.1937 | |
| OC1CC1CC1CC1O,0.3275 | |
| Cc1c(c(c[nH]1)C#N)N,0.197 | |
| CC1(CC2(CO2)C1)C#C,0.3052 | |
| CC1OCC2C1OC2=O,0.271 | |
| CN1C2C(O)C1C2C#N,0.2585 | |
| COCCC(=O)CC#N,0.2288 | |
| CC(CCO)C#C,0.3151 | |
| CCNc1c(nc[nH]1)O,0.225 | |
| CC1OC11CC2(O)CC12,0.3265 | |
| CCOC1COC1=NC,0.2634 | |
| CCOC1(CC1)C#CC,0.2744 | |
| CCC(O)C(C)(C)CO,0.3263 | |
| CCOC1CC(C1)(C)C,0.3238 | |
| CC1(CN1)C1OC1C#N,0.2567 | |
| CC(O)C1(C)CC(C)O1,0.3293 | |
| OCC1=CC(OC1)C#N,0.2549 | |
| ON=C1CC(O)CC1O,0.2491 | |
| CC1C2CC(C)=CC12C,0.2417 | |
| COC=NCC(=O)C#C,0.1913 | |
| COc1c([nH]nn1)C#C,0.1901 | |
| FC1=NC=CC(=N)N1,0.1888 | |
| O=CC12NC1C1CCC21,0.1988 | |
| C#CCN=COC=O,0.245 | |
| CCCCC(=O)C,0.2344 | |
| O=CC12CC3CC1C23,0.2215 | |
| OC1CC(CC#C)C1O,0.2991 | |
| CC(=O)c1c[nH]c(=O)[nH]1,0.1638 | |
| CCC(=O)C#CC#CC,0.1815 | |
| C#CC12CN=C3CC1N23,0.1927 | |
| CC1CC(C1)OCC#N,0.2863 | |
| CC1OCC(C)=C1C,0.2485 | |
| COC12CN(C1)C2,0.3211 | |
| CN1CCC2C3OC2C13,0.2827 | |
| CC1C(C#C)N1C(C)=O,0.2493 | |
| COCC1OCCC1=O,0.2162 | |
| OCC1CNC(=O)N1,0.3014 | |
| C(C1CN1)C1=CC=NN1,0.2571 | |
| COC1CC2(CC12)C=O,0.2256 | |
| OCC1CCN=CO1,0.2721 | |
| OC1CCOCC(=O)C1,0.2125 | |
| CC(COC1CC1)C=O,0.2262 | |
| OCC(O)CNCC#N,0.274 | |
| CC12CN1CCNC2=O,0.2498 | |
| CCC(=O)NCC=O,0.2193 | |
| C#Cc1cn[nH]c1C#N,0.1912 | |
| CC(C)CCOCCO,0.3378 | |
| CC1=C(CCC1)C,0.2545 | |
| CC1=CCCC(O)C1=O,0.1971 | |
| O=CN1CC2(CO2)C=C1,0.2047 | |
| CC1COC2(CC2)C1,0.309 | |
| OC(C=O)C1CC1C#C,0.2164 | |
| CC(O)C1OC(=N)C1O,0.2751 | |
| CCC1N=COC1CO,0.2638 | |
| CNC(=O)C(C#C)C#C,0.2631 | |
| OCC(O)(C=O)C1CO1,0.2077 | |
| CN1CC1CCNC=O,0.2574 | |
| Cc1c(nc(cn1)N)O,0.1822 | |
| CCC(O)C(C)(N)C#N,0.2868 | |
| CC1C(=O)CN2CC12C,0.2038 | |
| CC12CC(O1)C=C2C#N,0.1971 | |
| Cc1c([nH]c(n1)C#C)O,0.1881 | |
| C(C#N)c1c(n[nH]n1)N,0.2166 | |
| COc1cccnc1,0.2105 | |
| COC1C2C(C)CC12O,0.2988 | |
| OC12CC1(O)CC=CC2,0.2541 | |
| c1c(nno1)N,0.1965 | |
| CC12C3C4OC(C14)C23O,0.3056 | |
| CC(N)C(OC=O)C#N,0.2502 | |
| COCCC(O)C1CN1,0.3172 | |
| CC12CC1C1(C)OCC21,0.3141 | |
| CCC1C2CCC12CC,0.3228 | |
| CC1C2(CO2)CC11CO1,0.3147 | |
| CN=C(C(=O)C#C)N,0.1675 | |
| OCC1CC(O)C1C=O,0.2116 | |
| CC(O)C1(O)CCC=C1,0.2542 | |
| NC(=O)C1NC1CC#C,0.2598 | |
| OCC1CNC(=O)CN1,0.253 | |
| CC12NC1CC21CN1,0.2936 | |
| CCC1C2CCC1CC2,0.3572 | |
| COCC1N=CNC1=N,0.2215 | |
| CC12COC1C1CCN21,0.2643 | |
| N=C1OC2CC=CC1O2,0.2496 | |
| O=COC1OCC2CC12,0.2795 | |
| CC1=CCC2OC=NC12,0.254 | |
| CC1(CO)OCC2NC12,0.311 | |
| CC12CC(O1)C2(O)C#N,0.2896 | |
| OC1C2CN2C2CC1C2,0.2903 | |
| CC1(CC1(C)C=O)C=O,0.2004 | |
| N#CC(C1CN1)C1CO1,0.2757 | |
| CC12CCN(CC1=O)C2,0.2024 | |
| CC1N2CC(=O)C12C#C,0.2103 | |
| CC1C2CC(=O)C(=N)N12,0.1676 | |
| CC1C(C=O)C=CC1=O,0.1834 | |
| ON=C1CC2OCC12O,0.233 | |
| CCC12C3C1C1C3CN21,0.2947 | |
| COC(=N)N1N=NN=N1,0.2232 | |
| C#CCC1COCCO1,0.2926 | |
| OCC12C(O)C1C1CC21,0.2709 | |
| C1CC12CCOCC2=O,0.2117 | |
| C1COCC(=NO)C1=O,0.1815 | |
| CCc1cocc1OC,0.2362 | |
| N=C1NC(=O)CCO1,0.2447 | |
| Cn1cccc1C=O,0.1828 | |
| CC1C2NC(C#N)C12O,0.2489 | |
| OC1CCC2C3CC12O3,0.2978 | |
| C1OC11C2OC1C1NC21,0.3087 | |
| CC1CC2CC1(O2)C#C,0.2688 | |
| CC12COC3COC1C23,0.3234 | |
| CC(C)(C)OC(=O)NC,0.3133 | |
| c1cc(nc(c1)O)C=O,0.1759 | |
| C1NC11C=C2CN3C2C13,0.1698 | |
| C1NC1C1COC=N1,0.2694 | |
| C1OC2CC3CC(C3)C12,0.3241 | |
| C1CC1C(=NO)C2CC2,0.2368 | |
| CCOCc1conn1,0.2292 | |
| CC(=N)OC1=CC=NO1,0.2469 | |
| N#CC1C=C2CC3C1C23,0.177 | |
| CC1(O)CC2OC12,0.325 | |
| c1c(c([nH]c1N)O)C#N,0.2098 | |
| CC(C=O)C(=O)CO,0.2071 | |
| CN=COC(C)CC#N,0.2697 | |
| O=CC1CC11CC2OC12,0.2286 | |
| C1CC12CC(C2)NC=O,0.2801 | |
| C1CC1(C(=O)N2CC2)O,0.2421 | |
| N=COCC1CN=CO1,0.2657 | |
| CC1CC(CC#N)C=C1,0.2627 | |
| Cc1cccccc1=O,0.1557 | |
| OC1C2CC1OC(=N)O2,0.2874 | |
| CC12CC(=O)C1C1CC21,0.2061 | |
| CC1CCC2(C)CC12C,0.3283 | |
| CC1OCC(C)=C1C=O,0.1824 | |
| NC1=C2C(O)CN2C=N1,0.2176 | |
| CCC1COCC2OC12,0.3314 | |
| C1C=CC(=O)C(=O)CN1,0.1561 | |
| CC1=CC(=O)C2(CO2)C1,0.1848 | |
| CC12NC1C(=O)C21CC1,0.216 | |
| c1cc(n2c1C=CC2)N,0.1624 | |
| COCC(C)C#CC=O,0.205 | |
| [O-]C(=O)C1CC1NC=[NH2+],0.2336 | |
| CN=c1cnc(no1)O,0.1518 | |
| OC12CC1C(=O)NCC2,0.2609 | |
| C1CN1C(=O)CCC#N,0.2536 | |
| C1C2CN3C=CN=C3C12,0.2397 | |
| CCOCC(=O)C(C)O,0.2333 | |
| Cc1cc2c(o1)cco2,0.1961 | |
| N#CC1CC1C#N,0.3008 | |
| CNC1C(C)COC1=O,0.2445 | |
| CC1=NNC=C(O)C1=N,0.1745 | |
| NC1=NC(=O)OC(F)=N1,0.2266 | |
| CC1NC1C1CC(C)O1,0.3135 | |
| CCC(O)C(CC)C#C,0.3073 | |
| OC(CCOC=O)C=O,0.2293 | |
| CC1(C#N)C2NC2C1=O,0.2129 | |
| O=CN1C2COC(=O)C12,0.2402 | |
| CC1C2OC=NC12,0.2559 | |
| CC12CC(O1)C2C1CO1,0.3169 | |
| c1c(oc(n1)C#N)N,0.18 | |
| CC1OCC1(C)C=O,0.2234 | |
| COc1c(ocn1)CO,0.2116 | |
| CC#CC12CC(C1)CC2,0.2912 | |
| CC1CNCC(=O)C1O,0.1883 | |
| N=CN1C=CCOC1=N,0.2134 | |
| OCC1CC2C1N2C=O,0.2441 | |
| CC1OCC2OC12,0.3436 | |
| C1C(=NO)C(=NO)CN1,0.1839 | |
| CC1=COC(=N)N=C1O,0.1789 | |
| COC12CC1OC2(C)C,0.3025 | |
| CC1(C)CC=CC2OC12,0.2401 | |
| CCCC(O)C(C)C=O,0.229 | |
| CC1CC1COCC#C,0.2877 | |
| CCc1cc(on1)NC,0.226 | |
| N=COCCC#CC#C,0.2302 | |
| CCCC(N)(CN)C#N,0.2691 | |
| OC1C(O)C11C2CC1O2,0.2656 | |
| OC1C2NC(=O)C1C2=O,0.2102 | |
| c1c[nH]c(c1OC=O)O,0.2006 | |
| C1C(=O)NC=N1,0.2318 | |
| CC1N2CC3OC1(C)C23,0.2796 | |
| CC1CCCC1O,0.3287 | |
| N#CC12COC(CO1)C2,0.2749 | |
| CC1=CC2CC2C1=O,0.1907 | |
| CC1(CN1)C1NC1C=O,0.2182 | |
| CC(C)C(C)(C)CC=O,0.2231 | |
| CC1CCC2(CC2)C=C1,0.249 | |
| CC1C2N1CCC2(C)O,0.2854 | |
| CC12CN1C(C)(C)C2O,0.2903 | |
| CCCC1OC(C)C=C1,0.2476 | |
| CCOCCCNC=O,0.2838 | |
| C1CC2COC3C1C23,0.3132 | |
| CC1CN=C(N1)C=O,0.1646 | |
| CCc1c(cn[nH]1)OC,0.2271 | |
| CC(C)CC(O)C(N)=O,0.2785 | |
| CCCC12NC1CC2=O,0.2203 | |
| OC1C(=N)NC11COC1,0.2661 | |
| CCOCC(=O)CC#N,0.2364 | |
| [NH3+]CC(O)(C#C)C([O-])=O,0.2542 | |
| OC1C2CC1C2,0.3278 | |
| CCC1COC1C(C)C,0.3181 | |
| C1C2OC3=NON=C3C12,0.2225 | |
| CC1C2OC2C11CC1O,0.3203 | |
| CNC1=CN=NOC1=N,0.1686 | |
| CC1(CC(OC1)(C)C)C,0.3141 | |
| CC1C2CC1C(C)C2,0.3731 | |
| OC1COC2(CC12)C#C,0.26 | |
| C#Cc1c(oc(=O)[nH]1)N,0.1882 | |
| OCC1=CC2OC2C1O,0.2371 | |
| O=CC12CC(C1)CC2=O,0.2113 | |
| CC1(O)CC11COC1=O,0.2532 | |
| CC1(CC=O)CC2CN12,0.2165 | |
| OCC12CC1CC2C#N,0.2973 | |
| Cn1c(ccc1O)C#C,0.1921 | |
| C1CC=C2CCC=C2C1,0.1961 | |
| CN=C1CCC(=O)CO1,0.2155 | |
| COC1CC1(O)CO,0.3008 | |
| NC12C(CO)C1NC2=O,0.2306 | |
| CC1CC(O)C1CCO,0.319 | |
| OCC1(CC1)C(O)C=O,0.211 | |
| CC12OCC1C2CC=O,0.2179 | |
| c1c(ncn1CCO)O,0.228 | |
| CC1(C)CCC(O)C1=O,0.2199 | |
| CC(C)C(C=O)C(N)=O,0.208 | |
| CC1NC11COC11CC1,0.2923 | |
| OCC1(O)C2C3CN3C12,0.2787 | |
| c1cc(cnc1)C#N,0.2123 | |
| CC(CC(C)(C)O)C#N,0.3235 | |
| C#CCC1OCC2NC12,0.3001 | |
| CCC(=N)OC(C)CO,0.2922 | |
| CC1=NN2C3CC3C2=C1,0.2325 | |
| CC(=O)OC(=NC)C=O,0.1743 | |
| CC1(CC1)c2cn[nH]n2,0.2375 | |
| CC1=NCC(=O)N1C,0.2317 | |
| NC(=O)C([NH3+])C([O-])=O,0.2605 | |
| c1c(nc2n1CC=C2)N,0.1548 | |
| CC1C2C3CC1(C)N23,0.3187 | |
| c1cc(=O)[nH]c(=O)nc1,0.1652 | |
| C#CC1OCC=C1C#C,0.2086 | |
| CN=C1NC(C#N)C1O,0.2521 | |
| O=CC(=O)C(=O)C1CN1,0.1332 | |
| CC12CC3CN1C23CO,0.311 | |
| OC1C2C3NC2C(=O)C13,0.2138 | |
| OC1(CC1)C1CC2CC12,0.3197 | |
| N=C1C2OCC22CCN12,0.2295 | |
| CC1C=CC2CC1(C)O2,0.2379 | |
| C1C=CC(O1)(C#N)C#N,0.2573 | |
| CN=C1NC=NC=N1,0.1679 | |
| C#Cc1c(c(no1)N)N,0.1848 | |
| OCCCC1NC1C#C,0.2826 | |
| CC(C=O)C1=CNC=C1,0.201 | |
| C1C2C3C4CCCC24N13,0.3003 | |
| CCc1cc(on1)C#N,0.2156 | |
| C1CN(C(=N1)C=O)C=O,0.1884 | |
| CC12CC(=O)C(O1)C2O,0.2117 | |
| CC(=NC)NC(=N)C#N,0.1884 | |
| C1C23COC12C1NC1C3,0.2724 | |
| CC1(NC1C=O)C=O,0.2061 | |
| CC1(CC(=O)CO1)C=O,0.2079 | |
| CC1C2CC1(CO)O2,0.3159 | |
| C#CC1(CC1)OC=O,0.2613 | |
| CC12C(O)C3C1CCN23,0.3056 | |
| CC1CC1OC(=O)C#N,0.2232 | |
| CC1(CCC1CO)C#C,0.3027 | |
| CC1(CN1)C1CN1,0.3037 | |
| CC(O)C1(CO1)C1CC1,0.3202 | |
| CC(=O)COC=N,0.221 | |
| CC12CN3C1CCC23,0.309 | |
| CCC12CC1C1CCC21,0.3087 | |
| C1C2CC3=C(C=CO3)N12,0.219 | |
| C1NC11CC=CC11CN1,0.2455 | |
| CCC1OC2CC12C#C,0.2641 | |
| COc1c(c(n[nH]1)N)N,0.2259 | |
| CC#CC1OC1(C)C,0.2728 | |
| CC12COC1C=CCC2,0.2523 | |
| CC1C(C)C2=CN=NN12,0.2602 | |
| COCC1CNC(=O)C1,0.2748 | |
| CC12CC(COC1=N)O2,0.2674 | |
| CC(=O)COC1CC1,0.2151 | |
| CN1CCC(C1)C#N,0.2571 | |
| CC12CC1CC1COC21,0.3143 | |
| CCCC1CC(C)O1,0.3321 | |
| C1NC2C1N1N=CN=C21,0.2482 | |
| C1C2CC1C21CCCO1,0.3226 | |
| C1C(CN1C(=O)N)C=O,0.2078 | |
| CCCC1OCC2CC12,0.3356 | |
| C1CC1(C(F)(F)F)O,0.3521 | |
| CC1OCC2NC1C2O,0.3161 | |
| OC1CC2CC(=O)C2C1,0.2197 | |
| c1[nH]c(c(n1)CO)C=O,0.1901 | |
| CCOCC#CC(=O)N,0.2365 | |
| CC1(O)CC2OCOC12,0.3148 | |
| N#CC1OCCC11CN1,0.2747 | |
| OCC1CC2CC1(O)C2,0.3298 | |
| CC1(C)C(O)C(O)C1=O,0.2168 | |
| CCC(C)N(CC)C=O,0.2671 | |
| O=CC1CC2CC12C#C,0.2069 | |
| OC12COC1C1CC21,0.2963 | |
| O=COC1C2CC2C1=O,0.2194 | |
| COCC1(C)CC1C=O,0.2264 | |
| CN1CC1C#C,0.2631 | |
| OCC1OCC11CCC1,0.3038 | |
| Cn1c2c(nn1)non2,0.1839 | |
| CN=C1OCOC1C#C,0.2659 | |
| CC1C2CC1C1(CC1)C2,0.3505 | |
| OC12CC3C(C13)C(=O)C2,0.2205 | |
| CC(O)C(=O)C1CC1,0.2374 | |
| [O-]C(=O)C1C2C3[NH2+]C1C23,0.2567 | |
| OCC1CC2CC12C#N,0.2862 | |
| CN1C(CNC1=O)C#C,0.2715 | |
| Cn1cc(nc1)NC=N,0.2145 | |
| OC1CC2=CNN=C2C1,0.2508 | |
| OCCOC(C=O)C#C,0.2066 | |
| c1c(c(cnc1N)N)O,0.1837 | |
| Cc1c(oc(n1)N)N,0.232 | |
| C#Cc1cc(ncn1)F,0.2069 | |
| CC1C2C3OC3CN12,0.2836 | |
| OC12C3C1C1(O)C3OC21,0.3035 | |
| CC1=C(C)C2CC1O2,0.2324 | |
| CC#CCc1cn[nH]n1,0.2443 | |
| CC12C3N=CN1C=NC23,0.203 | |
| CC1OCOCC=C1C,0.2575 | |
| CC1(O)CC(O)C2CC12,0.3176 | |
| CN=C1OC(=O)C(N)=C1,0.168 | |
| C#CCC(=O)C#CCO,0.2059 | |
| OCCC(C#N)C1CC1,0.3067 | |
| CC1NC1C#CC=O,0.2014 | |
| c1cnn(c1)C=O,0.2191 | |
| CC1CC2CC3C2CC13,0.3439 | |
| O=C1C2CC3CC3C1O2,0.2301 | |
| Cc1nc(c(o1)OC)N,0.2042 | |
| CC(C)(C)C1CCC=C1,0.2614 | |
| CC(C)C1(CN1)C1CN1,0.3005 | |
| O=CCCC1(CN1)C=O,0.218 | |
| [NH3+]CCC1=NOC([O-])=N1,0.2481 | |
| CCOCC1OC1CC,0.338 | |
| OCC12CCC1C2C#C,0.2901 | |
| CC1(C)C2OCCC12C,0.3095 | |
| CC12CC(C1O)C21CO1,0.3078 | |
| N=COC12CC1C1NC21,0.2427 | |
| CC1C2CC1(C)C21CN1,0.3192 | |
| OCC1NC=NC1C#N,0.2472 | |
| CC1OC2=CNC=C2O1,0.2354 | |
| c1c(c[nH]c1O)OC=O,0.211 | |
| CC12C3C(O)C1(O)CN23,0.2868 | |
| CC12C3CN1CC(=O)C23,0.2049 | |
| CC1CCC1(C)C1CO1,0.3437 | |
| Cc1conc1CC=O,0.2177 | |
| CCOC(C)C(C)CO,0.324 | |
| CCC1(C=O)C2CC1O2,0.2061 | |
| C#CC(=O)NC(=O)N,0.2114 | |
| OC1=C(OC=N)N=CN1,0.2183 | |
| CC#CCCCOC,0.3044 | |
| CC1=CC2CC1C2C#C,0.228 | |
| CCC(=NO)C1CO1,0.2465 | |
| CC1C2OC(=NC12)C#N,0.2049 | |
| OCC1=CNC=NC1=N,0.1938 | |
| CC(=O)C1C2C3CC3N12,0.2103 | |
| c1c(nnn1C=O)C=O,0.1791 | |
| [O-]C(=O)C12C3CC1[NH2+]C23,0.2488 | |
| NCC(C#N)C#CC#N,0.213 | |
| CC(O)CC(O)C(C)C,0.3073 | |
| CC1CC(C=O)C1C,0.2224 | |
| CN1C2CC2(O)CC1=O,0.2528 | |
| CC1NC2COC12C#N,0.243 | |
| CC(C)(C)C1=NCCO1,0.272 | |
| OC1C2C3C(CN23)C1=O,0.2139 | |
| CC1(NC1C#C)C1CC1,0.2777 | |
| C#CC1(CC1)C#C,0.2667 | |
| O=C1C(NC1C#N)C#C,0.207 | |
| CC12C3OC1C(C)(O)C23,0.2974 | |
| CC(C=O)C(=O)C(N)=N,0.1846 | |
| COC1C2OCC12C=O,0.2171 | |
| CC1=NC=C(O)C(=N)N1,0.1768 | |
| N=C1OC2CNC12C#C,0.241 | |
| CC(NC(C)C#N)C=O,0.2119 | |
| CC1(O)C(O)C1OC=O,0.241 | |
| N=C1NC(=O)CN1C=O,0.2342 | |
| CC#CC1OC2CC12O,0.2515 | |
| COCC1CN=C(C)O1,0.2717 | |
| CC1C2C1C1COCC21,0.3172 | |
| FC1=C(F)C=NC(=N)O1,0.1623 | |
| OC(C=O)C1=NON=C1,0.224 | |
| C1C2C1N1C3C=CC1C23,0.2163 | |
| CC(=NO)C1CCC1O,0.2431 | |
| C1CC23CC(CC12)O3,0.3211 | |
| CCn1c(coc1=O)N,0.2396 | |
| CC12OC1CC21CCC1,0.3213 | |
| CC(C)C1OCC11CO1,0.3206 | |
| c1cnn(c1)CCC=O,0.2126 | |
| CC1(O)C(O)C1(C)C#N,0.2949 | |
| O=CC12CC1CCC=C2,0.2248 | |
| CCOC(C)C(C)=NO,0.2569 | |
| CCC12C3C4C1C4(C)N23,0.2816 | |
| C1C(=NCCO)OCO1,0.258 | |
| CC1OCCC1(O)C#C,0.2731 | |
| CC(=O)Cc1ccoc1,0.2127 | |
| CCN=C1C=CCCO1,0.207 | |
| CC(=O)C1(C)CC2OC12,0.2243 | |
| CNC1C(O)CC1C#N,0.2446 | |
| CC1(C)C2OC1C1OC21,0.3056 | |
| CC12C(O)C3(O)C1OC23,0.3003 | |
| O=COC1CCCC1=O,0.2115 | |
| N#CC1CC2C3C1CN23,0.2694 | |
| CC1CC2(COC2)CO1,0.3067 | |
| CC1CC1C#CCC#C,0.2689 | |
| N#CC1CC=CC1C#N,0.2634 | |
| CC(O)C(C)C(C)(C)C,0.3262 | |
| CC1(OC1C#N)C1CC1,0.289 | |
| C1CCC(C1)C2COC2,0.3135 | |
| CC12OC3C4C1C4C23O,0.293 | |
| CC1(CC1)C1NC1C#N,0.2782 | |
| CC1C(O)C(C)N1C=O,0.2602 | |
| CC1COC2(CC2)C1C,0.302 | |
| CC1OC1C12CC1CO2,0.2957 | |
| CC(CNC(C)=O)C=O,0.2196 | |
| OCCCC1C2CC1C2,0.3428 | |
| O=C1CC2CC2C1C#C,0.2169 | |
| CC(=O)C1(C)CC2CN12,0.2195 | |
| OC1COC1C1CCO1,0.3103 | |
| CC12CC1OC2C1CC1,0.2994 | |
| C(C#N)C(CC#N)C#N,0.3248 | |
| OC1C2OC2C(=O)C1=O,0.1503 | |
| C1COC(=N1)C#CC#N,0.1834 | |
| CCc1ncnn1C=O,0.2183 | |
| COC12CC3(O)CC1C23,0.3123 | |
| C1C2C3CC1C1OC1C23,0.3373 | |
| O=C1CC2C(CN12)C#N,0.2371 | |
| CCN(C(=N)C)C(=O)N,0.2455 | |
| C1CN2C3C2C2OC3C12,0.2887 | |
| C#CC12CC=CC1CO2,0.2598 | |
| O=CCC1CC2CC1C2,0.2279 | |
| CC1N2CC2CC1(C)O,0.2944 | |
| OCC1CCOC(=N)C1,0.2777 | |
| C1C2C=CCC3OC3C12,0.2373 | |
| O=CNCC1CC2NC12,0.2635 | |
| CC1=CN=C(F)C(=N)N1,0.1619 | |
| CN=COc1ccoc1,0.2305 | |
| C1CC12CC=CNC2=O,0.2127 | |
| CC12CC1(C)C(N2)C#N,0.2488 | |
| CCC12OC3CC1OC23,0.3111 | |
| OC1CCC(CC1)C=O,0.2264 | |
| CCC1CCOC(=N)O1,0.289 | |
| CC1=C(C)C2OC1C2O,0.2381 | |
| C1CC2C1C21COC=N1,0.2491 | |
| O=CC1CC2CN2C1=O,0.2145 | |
| C1OC2C1C1=CCOC21,0.2208 | |
| CC(=NO)CC#CC#N,0.2211 | |
| OCC1C2C3C2C2C3N12,0.2999 | |
| OC(C1CO1)C1CO1,0.3366 | |
| OC(C#C)C1(CO1)C=O,0.2081 | |
| C1OCC11C2CCCC12,0.3071 | |
| CN(CC=O)C1CC1O,0.1873 | |
| CCc1coc(c1N)C,0.2193 | |
| N=C(C#N)N1CCC1,0.2071 | |
| CC1CC(C=O)=C(C)N1,0.1779 | |
| CCC(O)C1CCC1O,0.3011 | |
| CC(OC(=O)C#C)C#N,0.2378 | |
| CC12CCC1OCC=C2,0.2596 | |
| C1CC1(C(=O)NC=O)O,0.2155 | |
| CCC(=O)C1(CC1)CO,0.2323 | |
| CCCC1CCCCC1,0.3704 | |
| CC12CC(OCC1)C2O,0.3201 | |
| OCCC1C=CC2NC12,0.2434 | |
| C1OC2C3CCCC12O3,0.2738 | |
| OCC1CCOC2CC12,0.3129 | |
| COC1=NNC(=N)N1,0.2434 | |
| CCCCCN=COC,0.2694 | |
| COC1(C)CC(C)CO1,0.3405 | |
| O=C1CC2(OC12)C1CC1,0.2149 | |
| Cc1nc(=O)cnn1C,0.1847 | |
| C(C(=O)C=O)OC(=O)N,0.1544 | |
| CC1=COC(=N)C(F)=N1,0.1664 | |
| CCN(C)C(=O)C(C)C,0.2634 | |
| C1COCCC12CO2,0.331 | |
| CCC1CCC(OC)=N1,0.2792 | |
| CC(=N)NC(=O)C,0.2331 | |
| CC1CCCC1CCO,0.3355 | |
| CC1C(C)(N)C1(O)C#N,0.271 | |
| C#Cc1ccnn1C=O,0.1878 | |
| CC1COC(C)C1(C)C,0.3088 | |
| O=CCC12CN3C1CC23,0.2083 | |
| CC(=O)C12CC3OC1C23,0.2231 | |
| NC1(CC1(O)CO)C#N,0.2645 | |
| C1OC1C12OC1C1NC21,0.2749 | |
| CN1C(=N)C(O)CC1=O,0.2484 | |
| CCNC(=O)CCC#N,0.2775 | |
| C1N2C3C=C4CCC13C24,0.1456 | |
| C(CNC(=O)CO)CO,0.2717 | |
| Cc1c(c(c[nH]1)CO)N,0.2305 | |
| CCN1C(C)C1C#C,0.2568 | |
| CC1=CC(=O)CC1(C)O,0.1924 | |
| N#CC1CC(N1)C1CN1,0.2562 | |
| CC(CO)(C#C)C(N)=O,0.2581 | |
| CCCCCC(=NO)C,0.2559 | |
| CC1=CC(OC=N)=CN1,0.2296 | |
| CC(C)CNC(=O)OC,0.3081 | |
| CC1C2CC2(O)C1=O,0.2276 | |
| CN1CC=CC(=O)C=C1,0.1647 | |
| CC1(C)CN=C2OCC12,0.2654 | |
| OCC1OC=NC1C=O,0.2122 | |
| OC1CC1C1COCO1,0.3118 | |
| C#CCOC1CCCC1,0.2859 | |
| NC(C#C)C1=NC=CN1,0.2432 | |
| CCc1c(c[nH]n1)N,0.2259 | |
| CCC1CC2C(OC)C12,0.3167 | |
| CC1(CO)CC11CCO1,0.2992 | |
| CC(=NC)OCC#C,0.2774 | |
| O=CC1=CC2COC2C1,0.1909 | |
| CCc1c(c[nH]n1)O,0.2357 | |
| CN1C=CCCCC1=O,0.2168 | |
| O=CC1CC=C2COC12,0.2213 | |
| C1OC11C=C2CN3C2C13,0.1692 | |
| CC1=CCOC(C1)(C)C,0.2621 | |
| CCN=c1cncno1,0.1597 | |
| CC1CC2CC3CC12C3,0.3456 | |
| C1CN1C12CC3CC1C23,0.3106 | |
| CCC1C2C(N2C)C1=O,0.2052 | |
| c1c(cnc(n1)F)C#N,0.2126 | |
| CC1C2NC2C(O)C1O,0.3047 | |
| ON=C1CC(=O)C2CC12,0.2174 | |
| OC12C=CC3C4C1C2N34,0.2329 | |
| c1c(cn[nH]1)CCC=O,0.2156 | |
| CC12CC1OCC21CO1,0.3096 | |
| CC1OCC1OC(N)=O,0.2973 | |
| CC1CC1C1=CNN=C1,0.248 | |
| CC1NC1CC(=O)C=O,0.1509 | |
| CC12OC1C(C=C2)=NO,0.1886 | |
| COC1CCNC(=O)C1,0.2667 | |
| CN1N=NC=C(C)C1=O,0.1832 | |
| C1CC2(O1)C1C3C2CN13,0.317 | |
| O=CNCC1OCC1=O,0.2128 | |
| CC12CC1(O)C(=O)O2,0.2618 | |
| CN=C1NN=CNC1=N,0.1883 | |
| COCC(=O)C#CC#N,0.1782 | |
| CC1(O)CC(CO)C1,0.3245 | |
| N=CN1C2CCC2C1=O,0.2248 | |
| CC(=N)N1C=NCC1=N,0.2203 | |
| CC12CC1CCC2(C)O,0.3243 | |
| c1c[nH]cc1N,0.2299 | |
| CC12CC3OC(=NC1)C23,0.218 | |
| OC1CC2C1NC2=O,0.2697 | |
| CCOC12CC3OC1C23,0.2951 | |
| CC1(C)C2OC(C#N)C12,0.2553 | |
| C(CC(C=O)C=O)CO,0.2036 | |
| CC1(C)OC2(C)COC12,0.3055 | |
| CC(=NC)OC(=O)N,0.2605 | |
| c1c(nn[nH]1)N2CCC2,0.2037 | |
| O=COC1CC2CC1C2,0.2861 | |
| COC1(COC1)CO,0.3117 | |
| CC12CC(C1)C2CCO,0.3417 | |
| CC1C2CC3OC1C23O,0.3044 | |
| COC1C2C=CC1C=C2,0.2216 | |
| CC1=CC(=O)C(=O)C1,0.1423 | |
| CCNC(=O)C(=O)NC,0.2129 | |
| CC1CC2CC2(C)C1C,0.3251 | |
| CC(=O)C(CCO)C#C,0.2234 | |
| CC1(CCN(C1)C=O)C,0.2664 | |
| CC1C2CC(CO2)C1O,0.3072 | |
| c1cc(oc1)NC=N,0.2366 | |
| CC1(CO)C2C3CC2N13,0.3105 | |
| O=C1C2C3N1CC23C#N,0.2311 | |
| CC1C=C2CC3C2C13O,0.1826 | |
| Cc1cc2n(n1)CCN2,0.2402 | |
| CC12C3C(CCN13)C2O,0.3048 | |
| O=CC12CC3C4C3C1C24,0.2099 | |
| COC(=O)C#CC=O,0.2031 | |
| O=C1NC2=CCC3C2N13,0.1889 | |
| C#CC1(OCCO1)CO,0.2971 | |
| C1CN=C(C(=O)OC1)N,0.1985 | |
| OCC1CC2OC12C#N,0.2731 | |
| CCC1OC2CCCC12,0.3219 | |
| Cc1cnc(o1)N=CN,0.1805 | |
| c1c[nH]cc1OC(=O)N,0.2429 | |
| N=C1OC2C(OC=O)C12,0.269 | |
| CN=C1OC=COC1=N,0.1886 | |
| O=C1CC2(CN2)C=C1,0.1914 | |
| Cc1c(=O)cc[nH]c1O,0.2029 | |
| O=C1COC(C=C1)C#C,0.1775 | |
| O=CCC1NC1C=O,0.207 | |
| O=CC1NC(=O)C1C=O,0.2082 | |
| OCC1OCC(=C1)C#N,0.1999 | |
| CCC1=C(COC1)C#C,0.2031 | |
| CC1CC1C(=O)C#C,0.2032 | |
| C#CCC1COC=NC1,0.2709 | |
| CC1C=CC(O)C1=O,0.223 | |
| CC(CC#C)C1CCO1,0.3041 | |
| CC1C2C3C1OC23CO,0.298 | |
| CCOCC1(COC1)C,0.3209 | |
| CC12CC3(CN3)C1C2O,0.3132 | |
| CN1C(=O)CCNC1=O,0.2482 | |
| C#CC#CC1CCO1,0.2168 | |
| CCN1CC1C1CN1,0.2986 | |
| CC1C=CC2CC1C2,0.2521 | |
| CC1=NC2C3C2C(=O)N13,0.2103 | |
| C(c1nnon1)N,0.1949 | |
| N=COCC1COC=N1,0.2614 | |
| O=CC12CN1C1CC2C1,0.2052 | |
| Cc1nc(nn1C)OC,0.2393 | |
| CCOC(C#C)C#N,0.2756 | |
| C1NC11C2OC2C11CN1,0.2897 | |
| CCC1CC(=O)NC1=N,0.2492 | |
| CC1CC(O)C1,0.3318 | |
| C1COC1(C#N)C#N,0.2618 | |
| CC1=CC2(CC2)C2CC12,0.2348 | |
| COC(C=O)C1CO1,0.2152 | |
| OCCC1C(O)C1C#N,0.2863 | |
| Cn1c(nc(n1)O)OC,0.2515 | |
| c1c2c([nH]n1)nc[nH]2,0.2184 | |
| CCOC1CC(C)C1=O,0.2002 | |
| O=CCC12CC1C(=O)N2,0.2187 | |
| CN1C(CC1C#N)C#C,0.2442 | |
| CC1(O)C(O)CC11CC1,0.322 | |
| CC1OC=NC(C)C1C,0.2689 | |
| CCC12CCC1N1CC21,0.2927 | |
| CCC(C=O)C1CO1,0.225 | |
| CC1=Cc2c(ocn2)C1,0.191 | |
| OC1C2CC1CCCC2,0.3277 | |
| COC1(C)CC1C#CC,0.2808 | |
| N=C1ON=NC(=O)N=C1,0.1846 | |
| C1C2C1N1C3CC1C23,0.3216 | |
| CN=C1OC2COC12,0.2575 | |
| NC1=NC2CC2(O)C1O,0.2295 | |
| CC1CCC=C1C1CN1,0.2438 | |
| C1C2CC3OC4C2N1C34,0.2756 | |
| CCC1(C)CCN1C=O,0.2663 | |
| C1C(CO1)NC(=O)C=O,0.1744 | |
| OC1C2OC=NC1C2=O,0.1878 | |
| COC(C)CC(C)C,0.3279 | |
| C#CC1C=CCOC=N1,0.2288 | |
| N=C1NN=NC(C=O)=C1,0.1531 | |
| C1CC1C1OC2CC2O1,0.3351 | |
| CC12CC3C1C2C3C#C,0.2984 | |
| CC(C)c1ncnn1C,0.2637 | |
| CCC(=O)C1CC1C,0.2312 | |
| CC1CC(=O)N1C(N)=N,0.2312 | |
| CN(C=N)c1c[nH]nn1,0.2014 | |
| NC1=C(F)C=COC1=N,0.1611 | |
| CCC(OC)C(O)CO,0.308 | |
| O=C1C2CCC22CCN12,0.2359 | |
| CC1(O)C2COCC12,0.3206 | |
| CCC(C#C)C(O)CO,0.2984 | |
| Cc1c([nH]nn1)C#N,0.2186 | |
| CC1C2CC3OC1C2O3,0.3339 | |
| CC1(CC(O)C#C)CC1,0.2883 | |
| CCC1C2C3C2C(=O)C13,0.2428 | |
| C#Cc1c(cc[nH]1)C#N,0.187 | |
| CCN=COCC1CC1,0.2742 | |
| Cc1conc1N2CC2,0.2379 | |
| CCC1(C)CC1(O)C#C,0.2737 | |
| CC1C=CCC(O)C1=O,0.2102 | |
| C#CC1(CCC1)CC#N,0.2939 | |
| CCC1C2OCCC12O,0.3015 | |
| OCC1(OC1C#C)C#C,0.2556 | |
| OC12CC1CC=C2C#N,0.2081 | |
| OC12C3NC1C=CC23,0.2274 | |
| CC12CC1(O)C1CCN21,0.2771 | |
| CC12OC1CNC2=O,0.2543 | |
| C1C2CCC11CCOC21,0.3278 | |
| OC1CC1CC(F)(F)F,0.3397 | |
| CCC(CC)C(=O)CO,0.2376 | |
| CC1C2NC(C)(C#N)C12,0.2568 | |
| OC1C=CC2=CCCC12,0.1933 | |
| OC1CCC=CCC1=O,0.218 | |
| CNc1ccoc(=O)c1,0.1862 | |
| O=C1CC2CC3CN2C13,0.2149 | |
| CC1(C)COC(=N)CO1,0.2691 | |
| ON=C1CC2CC1CO2,0.2515 | |
| ON=C1C2CC1(O)C=C2,0.2388 | |
| C1N2C3CCCC=C1C23,0.2224 | |
| CC(C=O)C(=O)CC#N,0.2198 | |
| CCC1CC2CC12CO,0.3175 | |
| C1CC2=CCOC3C1C23,0.2318 | |
| N=C1OCC2CCC2O1,0.2935 | |
| CC1CC2COC(C1)O2,0.3233 | |
| CC(=O)CC1COC1=O,0.2285 | |
| CC1CC2(O)C=CCC12,0.2616 | |
| CCC1CC(C)C1OC,0.3161 | |
| CC1(CO)NC=CC1=O,0.1902 | |
| CCC1=NCC2(O1)CC2,0.2588 | |
| C1CC2(C1)CC2,0.3562 | |
| Cc1cnc(o1)CNC,0.2278 | |
| NC(=[NH2+])C1OC1C([O-])=O,0.2518 | |
| c1cc(n(c1)C(=O)N)O,0.1802 | |
| O=C1NC2=NCCC2O1,0.2574 | |
| OCC1CCOC(=O)C1,0.2712 | |
| COC1CC2CC2(O)C1,0.3109 | |
| COC(CO)C1(C)CN1,0.3053 | |
| CC(C)C1C2OC2C1C,0.3261 | |
| CCNc1ccn(n1)C,0.2206 | |
| CCC12CC3C1C3(C)C2,0.3201 | |
| CC1C(CC2CN12)C=O,0.2129 | |
| CC1C2OC2C2OCC12,0.3002 | |
| COC(CO)C(C)C=O,0.2168 | |
| CC#CC1=CC(=N)OC1,0.1824 | |
| Cn1c(cnn1)N(=O)=O,0.1864 | |
| Cc1cnc(nn1)F,0.1672 | |
| O=CCOC12CC1OC2,0.2086 | |
| CC1(C)OC(=N)C=C1N,0.2134 | |
| c1c2n(cn1)CCO2,0.236 | |
| C1CC11CC2CC1O2,0.335 | |
| CC12CN3CC(=CC1)C23,0.2037 | |
| CC1(CCC=C1)C#N,0.2612 | |
| NC1=C2CCN2C(=O)O1,0.2167 | |
| CCC1CNC(=O)C1=O,0.1703 | |
| Cc1cc(c(cn1)C)O,0.236 | |
| C1COC(O1)C#N,0.3066 | |
| O=CN1CC2CC2N=C1,0.2113 | |
| CCC1(CN=CO1)CC,0.2725 | |
| CC1CC2(O)CC1C2=O,0.2255 | |
| CC1(O)CC1(C)C#N,0.312 | |
| Cc1c(c(c([nH]1)O)N)N,0.2206 | |
| CN(C)C12COC1C2O,0.2678 | |
| CCC#CCC#CC,0.2876 | |
| OC(COC=O)C1CO1,0.2781 | |
| CCc1c(nno1)NC,0.1824 | |
| [NH3+]C1(CC([O-])=O)COC1,0.2715 | |
| c1[nH]c2c(n1)C(=O)OC2,0.2344 | |
| COCCCC1(C)CO1,0.3379 | |
| OCC12OC3C(C13)C2=O,0.2231 | |
| NC1(COCC=C1)C#N,0.2442 | |
| CC1CC1C1CNC1=O,0.2771 | |
| Cc1c(cco1)C#N,0.2178 | |
| CCc1ncnc(n1)N,0.2216 | |
| Cc1cnc(cn1)F,0.2066 | |
| c1c[nH]c2c1CN=CO2,0.2035 | |
| CN(C=N)C(=N)C=O,0.1545 | |
| CC1C2N(C)CC12C#N,0.2409 | |
| CC1OC(=O)C(C)C1O,0.278 | |
| CN1C=CC(=N)NC1=O,0.1965 | |
| c1ncnc(n1)CO,0.2167 | |
| CCC12C3CC3C1N2C,0.2748 | |
| COC(C)CC(C)C=O,0.2267 | |
| c1cc2cn[nH]c2nc1,0.1945 | |
| OC1CCC2NC12C=O,0.2141 | |
| CC1(CC1)C2CCC2,0.3394 | |
| CCC1(C)CC(C)(C)O1,0.3126 | |
| OC1CC2CC3(O)C2C13,0.3067 | |
| COCC(O)(C=O)C#N,0.2202 | |
| COC(C)C(C)(O)C#N,0.2882 | |
| CC1NC(C)(C#C)C1=O,0.2102 | |
| CC1C(C)=CC2OC12C,0.2406 | |
| C(C(=N)NC(=N)C#N)O,0.1913 | |
| COC1CC1(C)C#CC,0.2759 | |
| O=CC12CC3COC1C23,0.209 | |
| Cc1ccc(o1)C(C)C,0.2292 | |
| CC1(CN1)C1OC2CC12,0.3016 | |
| CC1OCC2C1N2C=O,0.2494 | |
| C1C2C1C1CC2C11CC1,0.3425 | |
| CC(C)C1(C)CC(C)C1,0.3489 | |
| CC1OC1C(N)C#N,0.2859 | |
| OCC(=O)C(O)CC=O,0.2046 | |
| CC1C(CO)C2CN12,0.2956 | |
| CC12CC(C=C1)N1CC21,0.2328 | |
| c1c(c(c[nH]c1=O)O)F,0.1704 | |
| CN1C2C3C1C2C3(C)O,0.2809 | |
| NCC(N)(C#C)C#N,0.2624 | |
| CC#CC12CN1C(=O)C2,0.2287 | |
| CC1CN2CC12C(N)=O,0.2591 | |
| CC1=C(C=NO1)C1CO1,0.2339 | |
| CC(C#N)N1CC2CC12,0.2594 | |
| C#Cc1cc[nH]c1C#N,0.1887 | |
| CCNC(C)C(F)(F)F,0.3097 | |
| CN1CC1C12CC(C1)O2,0.3068 | |
| CC12CC3(CO)C(O1)C23,0.2913 | |
| O=C1OC2C1CC21CC1,0.2786 | |
| c1c[nH]c(=O)[nH]c1=O,0.2103 | |
| OCCC12CC3C(O1)C23,0.305 | |
| C1CNC(=O)C(=O)NC1,0.2194 | |
| CCC1=CCCC1=O,0.1969 | |
| CC1C2(O)C3NC2C13O,0.2822 | |
| C1CC1COC2COC2,0.3182 | |
| C#CC1=CCCC11CN1,0.1995 | |
| C1CC1C12CC3C1N3C2,0.3111 | |
| C(CO)C(=NO)CCO,0.2536 | |
| CCC1(CO1)C#CC=O,0.2016 | |
| C1C2OCC3=CCN1C23,0.2163 | |
| CC12C3C4OCC1C4N23,0.323 | |
| c1c[nH]c2c1C=CCC2,0.1875 | |
| CC1CC2OCC1C=C2,0.2477 | |
| c1c[nH]c2c1nc([nH]2)O,0.2262 | |
| CC1CCC(=O)C11CC1,0.2231 | |
| CC12CC3C1C2(C)C3O,0.3195 | |
| COc1c[nH]c(n1)O,0.2379 | |
| CC12CC3C(C13)C2=O,0.2432 | |
| c1nc(on1)NC=N,0.2215 | |
| CC1CC1C1(CO)CN1,0.3121 | |
| CC1N2CC(CO)C12C,0.2904 | |
| c1c2cn[nH]c2ncn1,0.2003 | |
| CC12C3N(CC13O)C2=O,0.2412 | |
| OC1C=CC2=C1OC=N2,0.18 | |
| CC12CC(C=C1)C2O,0.2379 | |
| CN1C2CC3C(O)C3C12,0.2657 | |
| CC1C(C)(O)C11COC1,0.2975 | |
| CCCC1(O)CN2CC12,0.2925 | |
| CC#CCC1CC1C#C,0.2808 | |
| C1CC23C1C1C2CCN31,0.3009 | |
| CC1C2OC(C)C12,0.3213 | |
| N=C1OC2COC2C=C1,0.2079 | |
| c1c(ncnn1)CCO,0.1652 | |
| CC12C3OC1(C)C(=O)C23,0.2249 | |
| CC1CC(=O)C1(O)C=O,0.2043 | |
| CC1C(C2CC2)N1C=O,0.2555 | |
| CN=C1NCC2(C)OC12,0.2436 | |
| COCC(O)CCO,0.3275 | |
| C1OC2C3C4C3C2C4O1,0.347 | |
| OCC1=NC2(CC2)CN1,0.2392 | |
| OC1C2C(=N)NC12C#N,0.2421 | |
| OC12COC3CC1CC23,0.3017 | |
| CCC1=NC(=N)N=CN1,0.1977 | |
| C1C=CC=CC=CCO1,0.1565 | |
| CC1NC11C2OC1C2O,0.2979 | |
| [NH3+]CCC1=NC=C([O-])O1,0.1746 | |
| CC1C2CC(O)C12C#N,0.2812 | |
| CN(CC1CO1)C(N)=O,0.2931 | |
| NC1C(=N)OC11CC1O,0.2671 | |
| OC1CC11CC=CC1O,0.2621 | |
| Cc1c(oc(n1)C#C)N,0.174 | |
| CC1(CC1)CC2COC2,0.3161 | |
| O=CC1CC1C1CCC1,0.2285 | |
| O=C1CC2OCC2CO1,0.2699 | |
| CC1C2OCC2C=C1C,0.256 | |
| CCC1(CC1)C#C,0.2959 | |
| OCC#CC12CC(C1)C2,0.2673 | |
| CC12CC3C(CC=C1)C23,0.2571 | |
| CN1C2C(O)C(=O)C12C,0.1974 | |
| C1C=CC=CCO1,0.1898 | |
| CCc1cn(cc1N)C,0.2253 | |
| CC1CC1C#CC1CO1,0.2627 | |
| c1nnnn1C(=O)C=O,0.164 | |
| CCOC12CC1C1CC21,0.295 | |
| CC1CC(C)(CC#C)O1,0.2904 | |
| CC1C(OCC1=O)C#C,0.2155 | |
| OCC1=CC(=N)N=NO1,0.1622 | |
| COC(=O)C(=N)NC=N,0.2006 | |
| Cn1c(c(cn1)O)OC,0.2311 | |
| CC1OC1C1(C)CC1,0.342 | |
| CC1C(CO)N(C)C1=O,0.2756 | |
| CN(C)C(=O)C#C,0.221 | |
| CC12OC1C(=N)N1CC21,0.2329 | |
| CCC12CC(=O)C1N2,0.2213 | |
| CC1=CCC(=O)NC1=O,0.2092 | |
| CC1CC2=C(NN=N2)O1,0.227 | |
| c1coc(c(c1=O)N)O,0.1684 | |
| CC12CC3C(CN13)C2O,0.295 | |
| O=CCC12COC1CO2,0.2197 | |
| CCOCc1ncno1,0.2429 | |
| CC1(O)CC=CC1CO,0.2615 | |
| N=C1NCCCC(=O)N1,0.2203 | |
| CN=C1CC(O1)C#N,0.2591 | |
| CC1OC11C=CCC1O,0.2448 | |
| CNc1c(nno1)C=O,0.1828 | |
| CC1CCN2C(C#C)C12,0.2567 | |
| CC(C)C1C2C3CC2N13,0.3107 | |
| CC1(O)CCOC1C#C,0.2737 | |
| CC1C2C3C(C2C#C)N13,0.2843 | |
| OC1CC11CCCC1=O,0.2227 | |
| CCC1C(O)C2CN12,0.2921 | |
| N=C1ON=CN=C1C=O,0.1359 | |
| OC1COCOCC=C1,0.2471 | |
| CCCC1(CCO)CO1,0.3312 | |
| CC1=CCCOCC1=O,0.1869 | |
| COC1CC1(C)CC=O,0.2161 | |
| c1[nH]c2nncn2n1,0.2228 | |
| CC1C=CC2CN2C1=O,0.2333 | |
| COC12CC1OC2=O,0.2577 | |
| CCC(C)(C=O)C=O,0.2125 | |
| CC1OC11CCCOC1,0.322 | |
| Cc1cc(no1)N2CC2,0.2344 | |
| OC(C#C)C1=NC=CN1,0.238 | |
| CC1CC2CC1C2=NO,0.2617 | |
| CC12CC3C(CO1)C23,0.3289 | |
| CC1C2N3C1CC23C#N,0.2687 | |
| N#CC1C2NC3C2NC13,0.2695 | |
| NC(=N)C(=O)C(O)C#C,0.1871 | |
| CCN1CC(N=C1)C#N,0.2337 | |
| CC(=O)n1cc(nn1)N,0.1674 | |
| c1cnc(cc1F)F,0.2383 | |
| CCC1C2C(=O)CC12O,0.229 | |
| CC1CC(C)C1C#C,0.3031 | |
| CC(N)C1(CN1)C#N,0.2902 | |
| N#CC1C2C3CC=C1C23,0.1754 | |
| O=C1C2NC3CC1OC23,0.1973 | |
| OCC12CN1C(C2)C#C,0.2731 | |
| C#CC1CC2=CN=CN12,0.2301 | |
| CC12CC3CC1(O)CC23,0.3225 | |
| Cc1c2c(c[nH]1)NCC2,0.2163 | |
| CCC1(C)CN1C(N)=O,0.2849 | |
| OC1C=CN(C=O)C1=N,0.2052 | |
| OC1COC2=CNN=C12,0.2207 | |
| Cc1c[nH]c2c1cno2,0.2145 | |
| CC1NC(C)(C)C1=O,0.216 | |
| CC1(CN1C=O)C1CN1,0.25 | |
| c1c(nnnn1)C(=O)N,0.157 | |
| OC1=C(F)C=NC(=N)N1,0.1576 | |
| CC1OCC1OC=O,0.2605 | |
| CC(C)CC1NCC1=O,0.2186 | |
| CC1NCC(=O)NC1=O,0.2213 | |
| OC1CC1C(=O)C1CO1,0.2083 | |
| CC(C)Oc1cnco1,0.2341 | |
| OC1C2C3CC1C23C=O,0.2263 | |
| CCC1OC2(CO)CC12,0.302 | |
| CNc1[nH]nc(n1)NC,0.2396 | |
| CCC1CC=CCO1,0.2675 | |
| OCC#CC1CCCO1,0.2767 | |
| Cc1nc(no1)C(=N)N,0.201 | |
| CCC1(CC1C=O)C#C,0.2164 | |
| Cc1nc(n(n1)C)OC,0.2586 | |
| CC1C2CC1C2(C)C#C,0.3002 | |
| N#CC1NC11CCC=C1,0.2371 | |
| CC1(C)OC1CC=O,0.2243 | |
| CC1OCCOC1C,0.3178 | |
| CC1C2OC1C2C=O,0.2041 | |
| Cc1c(cno1)OC=O,0.2303 | |
| CC12C3CC(C1O)C23C,0.3146 | |
| CCCC1OC2CC1C2,0.3296 | |
| CCC12CC(C1)OC2C,0.3088 | |
| C1C=CC(=CCO1)CO,0.206 | |
| COCC1CC2NC12C,0.2995 | |
| C#CCC12CC3C1CN23,0.2835 | |
| NC1=NOC(=N)O1,0.2581 | |
| CC12CC(C=C1)C=CC2,0.2354 | |
| C#CCn1ccc(n1)N,0.2274 | |
| C1CC12C=CNC(=O)N2,0.2123 | |
| N=C1OC2C3C=CC2C13,0.2175 | |
| Cc1c[nH]c2c1[nH]nn2,0.2059 | |
| CC1NC11C2CC1O2,0.312 | |
| CC(O)CC(=O)C(N)=O,0.1774 | |
| Cc1ncc2n1C=CC2,0.1952 | |
| CC1CCC(O)C11CO1,0.3068 | |
| CCC1=C(C)OC(=N)O1,0.2351 | |
| CC12CC1CCCCO2,0.318 | |
| C#CC1=CC(CC1)C#N,0.2098 | |
| N=CN1CC=CCC1=O,0.2344 | |
| CCC1=C(COC1=O)N,0.2153 | |
| CCC12CC3CC1C23,0.3318 | |
| CC1OC2(CCC2)C=C1,0.2425 | |
| CC1C(C#C)N1C1CC1,0.2594 | |
| N=C1CCCC=CCO1,0.2472 | |
| CN1C2COC(=O)C12,0.2446 | |
| CCc1ccc(=O)on1,0.1829 | |
| CCC(O)C(C)(O)C#C,0.287 | |
| OCC1OC11C2CC1N2,0.3115 | |
| O=C1CC2(C1)C1CC2O1,0.2141 | |
| CCC1OC(=O)C1OC,0.2518 | |
| O=CC(C1CC1)N1CC1,0.2215 | |
| OC1C2CC(CC1=O)O2,0.2239 | |
| O=C1C=CCC11CO1,0.1828 | |
| CCC1=CC(=O)C(=N)N1,0.1542 | |
| c1c(c(n[nH]1)O)OC=O,0.2335 | |
| C1COc2n1nc(n2)O,0.2485 | |
| N=C1NC(=NO1)C#N,0.1768 | |
| CCC12NC(=O)C1C2O,0.2531 | |
| CN=COC1CCC=C1,0.2466 | |
| CC1=CC2C3N2CC13O,0.2248 | |
| c1nc2n(n1)CC(=O)O2,0.2214 | |
| CC1OCC1(C=O)C#C,0.2135 | |
| OCC1CN(C=N)C1=O,0.2274 | |
| CC(C)OC=NCC#C,0.2705 | |
| CCCC(C=O)C=O,0.2032 | |
| c1cc([nH]c(=O)c1)C=O,0.1409 | |
| NC1C(O)C1C#N,0.2619 | |
| CC(C)C12CC1C(=N)O2,0.2795 | |
| c1c(nncn1)N=CN,0.1614 | |
| C1NC1C12NC3C1NC23,0.286 | |
| CC12C3CC1CC2(O)C3,0.317 | |
| N#CC12CC3(CO3)C1O2,0.2654 | |
| CCCOC(=O)C#C,0.2379 | |
| CC1(O)CC2CCC12O,0.2922 | |
| CCC1OCC1CO,0.3099 | |
| CCc1ccn(n1)C=O,0.2206 | |
| CC12C3C=CC1(O)CN23,0.2223 | |
| CCCC1CC1(N)C#N,0.2799 | |
| O=C1NC2CC3OCC123,0.2652 | |
| O=C1C2CC1CCC2,0.222 | |
| C1CC12C=CCO2,0.2267 | |
| CC#CCOCC(C)O,0.2827 | |
| N=C1OC2=C(O1)C=CO2,0.2114 | |
| CC(=O)C(=N)N(C)C=N,0.1778 | |
| CC1=CCCN1C=O,0.2095 | |
| O=C1NC2CC2CCO1,0.2718 | |
| CN1C2C1C1(O)CC21O,0.2651 | |
| CCCCc1cc[nH]n1,0.2665 | |
| C1CC(C1)COCCO,0.3409 | |
| CCN=C1C(=CCO1)C,0.2102 | |
| N=C(C#N)N1CCCC1,0.2057 | |
| C1CC1NC(=O)C=O,0.1714 | |
| C1C2OC3(CC=CC3)C12,0.2581 | |
| CCOC1=COC(=N)O1,0.2437 | |
| CC(C)OC=NC1CC1,0.2523 | |
| C1CC23CC4(OCC24)C13,0.1264 | |
| Cc1c(c(=O)cc[nH]1)O,0.1849 | |
| C#CC1CC23CC(O2)C13,0.2732 | |
| CCc1ncc(o1)C#C,0.1985 | |
| CC(O)CC1(O)CCC1,0.2978 | |
| COC(CO)C#N,0.2974 | |
| CCN=C(C=O)NC,0.1545 | |
| CC#CC#CC1(C)CO1,0.2146 | |
| C1CC2C=CC3NC23C1,0.2371 | |
| COC1OCC=CC1C,0.2665 | |
| OCCCC(=O)C1CO1,0.2246 | |
| CN1C2CC1C(C=O)=C2,0.1584 | |
| Cc1c[nH]c(n1)CC#C,0.2468 | |
| ON=C1COC1C1CO1,0.2465 | |
| C1CC(C1)OC2CCC2,0.3171 | |
| CC(NCC(C)=O)C=O,0.2089 | |
| CC1(C)N2CC11OCC21,0.2516 | |
| CC(=O)NC(=N)CCO,0.23 | |
| OC12C=CC3C1NC23,0.2228 | |
| CC1CC2CC2C(C)C1,0.3374 | |
| CCCC#CC#N,0.2467 | |
| C1C=CC(=O)NC=N1,0.2054 | |
| c1c(c(no1)O)CC#N,0.2537 | |
| CC1(NC1C1CN1)C#C,0.2666 | |
| CC1NC(=O)C1(O)C=O,0.2111 | |
| C1CC(C1)OC(=O)CO,0.2733 | |
| c1c(nno1)CCCO,0.2318 | |
| N=C1NC=CC(=O)C1=O,0.1321 | |
| [NH3+]C12CC(C1)(C2)C([O-])=O,0.2393 | |
| O=C1CC2(CO2)C=C1,0.1881 | |
| CC1C2C3(CC3)CC12O,0.317 | |
| Cn1c(=O)c(ccn1)F,0.1786 | |
| O=C1C2CN2C1CC#C,0.2172 | |
| COc1nc(on1)CO,0.2458 | |
| CC(C)(C)C#CC#N,0.2474 | |
| CCC(=O)C1OC1C=O,0.1996 | |
| CC1N2CCC2C11CO1,0.2872 | |
| CC1=CC(=N)OC=N1,0.1828 | |
| CC(C)C(C)CCC=O,0.2291 | |
| CC1C(O)C2C3CN3C12,0.2705 | |
| COC1CC2NC2CO1,0.3135 | |
| C1C(CO1)NC2COC2,0.2909 | |
| OCC1=CC(O)CCC1,0.2522 | |
| CCCCC(CC)C#C,0.3129 | |
| C1C(CNC(=O)N1)O,0.2916 | |
| Cc1n[nH]c2n1ccn2,0.2124 | |
| Cc1c(coc1C#C)N,0.1839 | |
| CCCc1ccncn1,0.212 | |
| OC1C(=O)C=CC11CC1,0.1914 | |
| CC12CCCC1C=CC2,0.2665 | |
| OCC1(CC1)C(O)C#N,0.3011 | |
| CCC1C2CCC1C2C,0.3671 | |
| CC1CC(CCC#N)O1,0.2992 | |
| CN=C1OC(C)CC1O,0.2669 | |
| C1CC11CC2CC=CC12,0.2608 | |
| O=CC(CC#C)C#C,0.2182 | |
| CC1(O)C2NC2C1C#C,0.281 | |
| c1c(oc(c1O)N)C=O,0.1578 | |
| COC=NC1C2CCC12,0.2475 | |
| CNC(COC=O)C#N,0.2473 | |
| N#CC12CC1CN1CC21,0.261 | |
| CCC(=O)N1CCC=C1,0.2078 | |
| OCC1=NC=CC(=N)O1,0.1828 | |
| CC1(CC2OC12)N1CC1,0.3166 | |
| CC1=CC2CC11CCC21,0.2283 | |
| CC12CC1OC1CCC21,0.305 | |
| CC(CO)C(F)(F)F,0.3455 | |
| CC1(CO)OC2COC12,0.3032 | |
| c1c(=O)[nH]nc(n1)CO,0.1671 | |
| OC12CC1C1C2OC1=O,0.2596 | |
| Cc1cnc(nc1)F,0.2132 | |
| CC(C#C)C1=NON=N1,0.2101 | |
| CNC1CC1(N)C#N,0.2656 | |
| OC1C=CCCOC1=N,0.2461 | |
| CC1CC2=NNN=C2C1,0.2428 | |
| CCOCC(OC)C#C,0.2898 | |
| CC1CCC1C(=O)CO,0.2337 | |
| CC1CC2CCC(=O)C12,0.2144 | |
| CC(C)CCCN1CC1,0.3144 | |
| c1nc(on1)NC(=N)N,0.2327 | |
| CC12NC1C1C2OC1=N,0.2655 | |
| O=CCOC1OCC=C1,0.2285 | |
| Cn1cc(cn1)C#C,0.225 | |
| CC1=CC(=O)NCC1O,0.2075 | |
| C1C2CC34CC(C3)C1C24,0.312 | |
| CC1CC(O)COC=N1,0.2575 | |
| ON=C1CC(C1)C#N,0.2473 | |
| COC1CCOC1(C)C,0.3202 | |
| CC1OC2COC2C=C1,0.2511 | |
| C1OC2C3C4OC13C24,0.2964 | |
| CC(OCCC=O)C#C,0.2278 | |
| ON=C1COC(=N)C1O,0.2416 | |
| CC1OCCC=CC1O,0.2529 | |
| CC1CCC2CC1(C)C2,0.3481 | |
| CC1(C)C2CC(O)C12,0.3197 | |
| CC1=NC(F)=CNC1=N,0.1496 | |
| NC(=O)C1(N)C2CC1O2,0.2577 | |
| C#CCc1ccno1,0.2446 | |
| CC1(C)CC1C(=O)CO,0.2372 | |
| CCC1OC(=O)CC1=O,0.2105 | |
| CC1(O)C(O)C1C#C,0.275 | |
| CN=C1OCC11CCO1,0.2576 | |
| CC(=NCCO)OC=O,0.2359 | |
| O=CC1CNC1CC#N,0.2105 | |
| CC1CCC2(OC12)C=O,0.2213 | |
| CC1(CC1)OC1CC1O,0.3169 | |
| COC1C(C)C1(C)OC,0.3102 | |
| CN1C2CC=C(CO)C12,0.237 | |
| CCCC1(C)CN2CC12,0.3082 | |
| NC(=NCC[NH3+])C([O-])=O,0.1964 | |
| CC(C)c1cnc(o1)N,0.2319 | |
| OC1(C=O)C2CCCC12,0.2172 | |
| COC(=O)n1cnnn1,0.2347 | |
| CC1=C2C(O)CC2CC1,0.2366 | |
| N#CC#CC1C2CC1O2,0.2139 | |
| CC12C3CC1C=CC2C3,0.2487 | |
| CC(C)(C)CC#CC=O,0.2055 | |
| OC1CCCC1OC=O,0.2765 | |
| CC1CC2(C)OC(=N)C12,0.2819 | |
| CC12OC3(CC1C23)C#C,0.2523 | |
| CC(C=O)C(=NO)C#C,0.193 | |
| COCC1OC1(C)C#C,0.2861 | |
| CCC1(O)CC1OC=N,0.2708 | |
| CCC(COC)C#N,0.3058 | |
| N=C(C=O)N1CCC1,0.1712 | |
| NC1C(C#N)C1N1CC1,0.2692 | |
| OC1C2C1C1C=CCC21,0.2542 | |
| CN1C2C1C1C3OC1C23,0.3075 | |
| CCC1N=C(C)NC1=N,0.2299 | |
| N=C1CCC(=O)CO1,0.2186 | |
| COC1CC2N=COC12,0.2638 | |
| O=CNCC1NC1C#N,0.2692 | |
| CC1C2NC(=O)C(C)C12,0.263 | |
| CN(C=O)C(C#C)C#N,0.2593 | |
| CC(C)C1=CCCC1,0.2597 | |
| CC1C2N3CC2(C#C)C13,0.2734 | |
| c1cn(nc1N)C=O,0.1896 | |
| C1OC2OCCC3C1C23,0.3202 | |
| CC12N=CN3C(C13)C2O,0.2231 | |
| CC(=O)C#CC#CC#N,0.1657 | |
| CC1(O)CC2C3OC3C12,0.3191 | |
| CCOC(=O)COC,0.2806 | |
| O=CC12CC1NC=N2,0.2088 | |
| CC1(OC1(C)C=O)C=O,0.1987 | |
| C1CC1C1C2C3OC2C13,0.3082 | |
| C1C=CN(C1=O)C(=N)N,0.2062 | |
| OCC(C=O)C1CCC1,0.2259 | |
| c1c(cn[nH]1)NCC#N,0.2213 | |
| C1c2c(onn2)OCO1,0.2134 | |
| OC12C3CC(=O)C1NC23,0.2093 | |
| N=COC1OCC2NC12,0.2773 | |
| CC1OC23CN4C2CC134,0.2454 | |
| CN=C1NCC(=O)C1O,0.1896 | |
| OC1CCCOC=NC1,0.2538 | |
| C1OC2C3CC12C=CC3,0.2407 | |
| CC1OC2CC2(O)C1C,0.2884 | |
| CN1C2CCCC1C2=O,0.2267 | |
| CCC1COC(C)(C)C1,0.3176 | |
| c1ncoc(=O)c(=O)n1,0.182 | |
| OC1C2OCOC(=N)C12,0.2526 | |
| OCC12CC(=O)C1C2O,0.2298 | |
| N=C1OC(=O)C2CC1O2,0.2404 | |
| N#CCN1CCC1C#N,0.253 | |
| CC1C2C3CC2C13C#C,0.2909 | |
| CC(C1CC1)C(=O)C=O,0.1523 | |
| CC1NC1(CC#C)C#N,0.2805 | |
| CCC(CNC=O)C#C,0.28 | |
| CC(C)C1OC1C(C)=O,0.2211 | |
| c1c(c(no1)N)OC=O,0.2297 | |
| OCC12CC(C1)CCO2,0.3211 | |
| c1cocc1CC2CC2,0.242 | |
| CC1=C(C(=O)NC1)C#C,0.1983 | |
| OC12CC3CC1C2C=C3,0.2366 | |
| OCC1CC1CO,0.3308 | |
| CC1COC(=N)OC1,0.2868 | |
| CN1C(=N)C=C(N)C1=O,0.1699 | |
| CC1(CCC2NC12)C#N,0.2919 | |
| OCCC#CC(O)CO,0.279 | |
| CC(=O)CC(O)C(N)=O,0.2212 | |
| CC1(CC1)CC#CC=O,0.2054 | |
| CCOCc1cnc[nH]1,0.2484 | |
| CC1OC23CC(C2)CC13,0.3225 | |
| CCC12CN1CC(=O)C2,0.2046 | |
| O=C1C2NC1C(=C2)C#N,0.1963 | |
| COC12CCC1C1OC21,0.313 | |
| COC1C2CC1OCO2,0.3212 | |
| CC(NC=O)C(F)(F)F,0.2822 | |
| CCC12CC(C1)C(=O)N2,0.2593 | |
| C1C2C3OC4C3N2CC14,0.2959 | |
| C#CC1C2CN3CC1C23,0.2478 | |
| CC12CC(CO)(C1)C2,0.3379 | |
| CC(=O)c1c(cco1)N,0.1722 | |
| N=C1CC(O1)C1CCC1,0.2888 | |
| CC12CC3CC1C3O2,0.3313 | |
| CC1OC11C=CNC1=O,0.1934 | |
| COC1(C)OCC2OC12,0.3392 | |
| C#CC1=CCOCC1=O,0.1752 | |
| CC12CC3CC1C23C#N,0.2718 | |
| CC1OC1(C)C(O)CO,0.3306 | |
| C1COc2c1onn2,0.1841 | |
| OC1C2CC1O2,0.3019 | |
| CCCC1CCCC1C,0.3672 | |
| CC(C)(O)C(C)(O)C#C,0.2965 | |
| COC1(C)CC1(O)C#C,0.2686 | |
| OC1C2N=CNC12C#C,0.2324 | |
| CC1OC1C1CC(O)C1,0.3289 | |
| CC1=CC(=NO)C2NC12,0.187 | |
| CC1C2(C)NC2C11CO1,0.2975 | |
| COC12CC(C1O)C2O,0.314 | |
| OC12CC=CC11CC2N1,0.2298 | |
| CC1C2OC2CC1(C)O,0.3302 | |
| CN(C)C(=O)C(=O)C#C,0.1664 | |
| O=CCCC1OCC=C1,0.2226 | |
| CC1CC2(C1)NC2CO,0.3166 | |
| c1c2n(nn1)C3(C2)CC3,0.2591 | |
| c1c(n[nH]n1)NCCO,0.2132 | |
| CN1N=CC=C1C1CO1,0.2406 | |
| CCCN=c1[nH]nn[nH]1,0.1957 | |
| O=C1C2CC1C(=O)C=C2,0.1843 | |
| CCC1N=C(C)OC1=O,0.2469 | |
| OC1CC2OC2(C1)C#C,0.2763 | |
| c1cnc(c(n1)C=O)F,0.1687 | |
| OC12C3C4C3C1N1C4C21,0.2821 | |
| O=C1C2CC3OC2OC13,0.2222 | |
| OCC12CC(C#C)C1N2,0.2912 | |
| CC1(O)C2C3OC1C23,0.2989 | |
| CNC1=NC(C)(C)CO1,0.2743 | |
| CC12OC3=NCC1C23N,0.1535 | |
| CCc1nc(cn1C)C,0.2403 | |
| COC=Nc1nnon1,0.2037 | |
| CC12C3C4N3C1C24CO,0.2739 | |
| CC(=O)Nc1ccco1,0.1995 | |
| CCC1OC(=N)C1NC,0.2503 | |
| C#CC12CC(C1)N1CC21,0.2726 | |
| c1nc(c2n1CCC2)O,0.2244 | |
| C(CO)C(=O)OCCO,0.2811 | |
| c1cc2c(cco2)nc1,0.1988 | |
| CC(O)C(N)C(F)(F)F,0.3273 | |
| C1NC11C2CCCC1O2,0.313 | |
| O=CN1C2CC(=O)C12,0.2177 | |
| CC12CC3C1C(O)C23,0.3133 | |
| C1CC12CC=CC(=O)N2,0.2004 | |
| CCOCC1CC(=N)O1,0.2781 | |
| CC1CC23OC(C12)C3=O,0.2459 | |
| CN1C2C1C(C)(O)C2=O,0.1988 | |
| NC(=O)C12CC(C1)OC2,0.2663 | |
| CCC1COCC1C#N,0.3023 | |
| CC1OC2CC2C11CO1,0.3163 | |
| CC12CN3C1CC(=O)C23,0.2167 | |
| CC12C(O)C1CC2C#C,0.2853 | |
| N=C(C#N)N1CC1,0.217 | |
| c1c[nH]nc1OCCO,0.2477 | |
| c1c(onn1)N=CN,0.1832 | |
| c1c(c(n[nH]1)C(=O)N)N,0.1867 | |
| CCC1(CC1)CCC#N,0.3194 | |
| C1CN(C(=O)CN1)C=O,0.1955 | |
| CCC(C#N)C(O)C#N,0.3045 | |
| CC1C2NC2(C)C1(C)O,0.2962 | |
| C1C2CCC3=C2N1C=C3,0.1937 | |
| Cc1ccc(nc1F)N,0.1988 | |
| Cc1cnnnn1,0.1686 | |
| CC1OC(=O)COC1=N,0.262 | |
| N=C1OCOCC1=O,0.1858 | |
| CCc1cnc(nn1)O,0.1638 | |
| CCC1(C)CC1(C)C,0.33 | |
| OCC1C(O)C2COC12,0.2926 | |
| CCC#CC1C(O)C1O,0.2665 | |
| O=C1C2C3N2CC13C#N,0.2228 | |
| NC12C3NC(=O)C1OC23,0.2317 | |
| CC1OCCC2OCC12,0.313 | |
| O=CC12C3CC1CCN23,0.2187 | |
| COC(C#C)C1CC1C,0.2985 | |
| CCCc1ncno1,0.2622 | |
| CC1C2COCC12,0.327 | |
| OC12CC1C1(CC21)C=O,0.2015 | |
| OC12CC1C(=N)OC2=O,0.2435 | |
| CC12CCC(C)(O)C1O2,0.3207 | |
| N=C1ON=C(C=C1)C#N,0.1569 | |
| CCCC1=CCC2NC12,0.2464 | |
| CC1CC=CC(CO)C1,0.2649 | |
| CC1C2OC=NC(C)C12,0.2704 | |
| CCC1=CCC2OC12C,0.2425 | |
| C1OC23CC4OC2C4C13,0.2969 | |
| C1C2CC11OCOCC21,0.3444 | |
| CC1C2C(O)C1C2(C)C,0.328 | |
| CC1C=C(C)C2CC12,0.2458 | |
| Cc1c(c(oc1N)O)C,0.2254 | |
| CC1(C)C2C1C1(C)CN21,0.2831 | |
| C1OC2C3CCC12N3,0.2701 | |
| OC1C2NC1(C#C)C2=O,0.2237 | |
| CC(=O)C1CC(N1)C#N,0.2186 | |
| OC1(CC1(O)C=O)C=O,0.1972 | |
| CC1C2CC(C2)C1=O,0.2258 | |
| N#CC1CC11CN2CC12,0.2686 | |
| O=C1O[C-]2CC[NH2+]C2=C1,0.1558 | |
| COCCC(C)CCO,0.3289 | |
| O=C1CC2NC2C11CN1,0.2164 | |
| CCC1C2CC1(C)O2,0.3143 | |
| CC1(CO1)C1COC=N1,0.2699 | |
| OC1C2OC3CC3C12,0.3115 | |
| c1c2c(c([nH]1)O)NCC2,0.2256 | |
| CC(=O)C(O)CC#N,0.2377 | |
| CC1C2C3CC1(O)CC23,0.3249 | |
| CC1NC11CCC2NC12,0.3059 | |
| CCC1N=COC1C,0.2681 | |
| CC1(C)OC1CCC=O,0.2287 | |
| c1c(c(=O)[nH]c(=O)[nH]1)N,0.1741 | |
| CC(N)=[NH+]C1=CC=N[N-]1,0.1608 | |
| N=C1OC2C3CN(C3)C12,0.2554 | |
| CC1(C=O)C2NC1C2=O,0.2081 | |
| CNC(C=O)C(C)C#N,0.1988 | |
| CC1(C)C2NCC12C#N,0.2508 | |
| CC1C2OC2C11CC1,0.3402 | |
| CC1OC11CNC1C=O,0.2111 | |
| CC1C2CC1C(C2)=NO,0.2573 | |
| CC1CC2=C(C1)C=CN2,0.238 | |
| CCN=COC,0.2729 | |
| CC#CC1C(O)CC1O,0.2894 | |
| CC(C)(CCC#N)C#N,0.3408 | |
| CC(C)C1(O)CC=CC1,0.2661 | |
| COC12C3CC1(O)CC23,0.2941 | |
| Cc1cc(nc(n1)F)O,0.2311 | |
| CCCC1COC(C)O1,0.3432 | |
| O=CC1C2CC2C1C#N,0.2143 | |
| OC1C2C3C4N=C1N2C34,0.1881 | |
| Cc1c(=O)c(con1)N,0.162 | |
| CC1CC1C1CC(=O)C1,0.2216 | |
| O=C1OC2CCC3C2N13,0.2784 | |
| OCC1C2C3CC2C13O,0.3062 | |
| O=C1CN2CC3CC3C12,0.2019 | |
| c1c(c(=O)[nH]cn1)C#N,0.1769 | |
| OC(CN1CC1)C1CO1,0.3154 | |
| c1c(noc1N)CC=O,0.2073 | |
| CNc1c(oc(n1)N)O,0.2114 | |
| OC1C2(O)CCC12O,0.2926 | |
| OCC12CC(O)(C1)C2,0.3286 | |
| N=C1ON=CN1CC#N,0.2265 | |
| OCC#CCC1CO1,0.2839 | |
| CC1=C(CCC1)CC=O,0.2047 | |
| NC(=O)CC1CN1C=O,0.2537 | |
| NC(C#N)C1=NC=CO1,0.2394 | |
| NC(=O)C(O)C1CC1O,0.2757 | |
| OC1=CN=C(N1)C1CN1,0.2265 | |
| c1nc(nn1C2CC2)N,0.2269 | |
| C1CC(=O)C(=C1)CO,0.1997 | |
| OCC1=CC2C3CC2C13,0.225 | |
| [NH3+]C1CC2(CC12)C([O-])=O,0.1161 | |
| CNc1c(n[nH]n1)CO,0.2081 | |
| CC1C2CC1N2CC#C,0.2687 | |
| OC1CC2CC=CC2=C1,0.1942 | |
| Cn1c(c(oc1=O)N)N,0.2354 | |
| Cc1cc(=O)ccn1C,0.2015 | |
| CCOC1C2CCC1O2,0.3232 | |
| CCC1(O)CC2NC12,0.2953 | |
| CC1CC2(CC2)OC=N1,0.2665 | |
| COC1C2CCC1C2=O,0.2202 | |
| CC1C=CC2=CC=CN12,0.1747 | |
| NC1=[NH+]C(=N)C=N[N-]1,0.1772 | |
| COC12CC1N(C)C2,0.2952 | |
| CCC(=O)C(C)(O)CO,0.228 | |
| C#CCC1(CC1)OC=O,0.2711 | |
| C1C2CC1C1NC1C=C2,0.2426 | |
| Cc1cc(oc1C)C=O,0.1783 | |
| CC1CC2OC(C1)C2O,0.2992 | |
| CC1C2N3C1C(O)C23C,0.3059 | |
| CC12CCC11OC2C=C1,0.2204 | |
| CC1(C)CCCC1C#C,0.3078 | |
| CC1CCC2(CC12)C#C,0.2872 | |
| CCN1CC(O)C1C#N,0.2562 | |
| CC12CC(=O)C(=O)C1O2,0.1486 | |
| C1C2CCCC3OC3C12,0.3356 | |
| CC(C)CC(C)CO,0.34 | |
| N=C1CC2(CCC=C2)O1,0.2542 | |
| CC12OCC=CC1C2O,0.2207 | |
| [NH3+]C(C(O)CO)C([O-])=O,0.2621 | |
| CC1N=CN(C=O)C1=O,0.2187 | |
| C1OC2C3OC4CC12C34,0.2946 | |
| CCOC(C)(C)C(C)C,0.321 | |
| NC1C2C(O)C2OC1=O,0.2486 | |
| CCC(O)(C=O)C1CO1,0.2222 | |
| CC1C2CC(C)C1C2O,0.334 | |
| c1(c(n[nH]n1)O)O,0.2219 | |
| OC1CC2C1=CNC2=O,0.1996 | |
| OCC1C2CC3NC3C12,0.3017 | |
| CC12OC3CC1(O)CC23,0.3036 | |
| OC1C2NC1C(=O)C2=O,0.1417 | |
| COC(=O)c1c[nH]cn1,0.2259 | |
| CC(O)C1CN1C=O,0.261 | |
| CC12COC1C(O)C2O,0.2844 | |
| CCN(C)C(C=O)C#N,0.202 | |
| Cc1ccc(nc1O)O,0.2033 | |
| COCC1CC2(C1)CC2,0.341 | |
| Cc1c(n(c(=O)o1)C)N,0.2332 | |
| O=C1CC2CCOC2O1,0.2767 | |
| O=CCC1C2C=CCN12,0.1932 | |
| C1C2C3CC22C=CCC132,0.25 | |
| C1CC12CC(C2)O,0.3356 | |
| CC1CCCOCC1,0.3243 | |
| OC12CC1NC(=O)C2,0.2657 | |
| N#CC1(C#N)C2CC1C2,0.3029 | |
| CC1C(O)C11NCC1=O,0.2056 | |
| C1C2N3CC22C3CCN12,0.1887 | |
| ON=C1CNCC1C#N,0.2337 | |
| CC1=CC(OC1=O)(C)C,0.2296 | |
| CCC(=O)OC=NC,0.2444 | |
| C1Cc2c([nH]nn2)NC1,0.2235 | |
| CC12C3OC(C1O)C23O,0.293 | |
| N#CC12C3CN1CCC23,0.2571 | |
| CC(O)C(=O)C1CC1C,0.2338 | |
| N=C1N=NN2CCC2=N1,0.1784 | |
| CN(C)C(=O)C1CO1,0.252 | |
| O=CC1(C#N)C2COC12,0.2162 | |
| CC1C2CN2CC1(C)O,0.3045 | |
| CCC1(C)CN1C,0.3001 | |
| CC12CC1OC(=O)CO2,0.245 | |
| O=C1C2C3C4OC2C1C34,0.2316 | |
| COCC#CCC#C,0.2804 | |
| CN=COCC=O,0.2204 | |
| CC12CC3C(O1)C23,0.3119 | |
| NC(C#N)C1(N)CCC1,0.279 | |
| N#CC12CCC(CC1)O2,0.2916 | |
| OC1(CC1)C12CC1CO2,0.2968 | |
| C#CC(CCCO)C#C,0.2952 | |
| OC(C#N)C1CC(O)C1,0.2888 | |
| C1OC11COC11CCC1,0.3119 | |
| COCC1CC=CC1=O,0.1908 | |
| C#CC1CC=CC2NC12,0.2405 | |
| CCC1CC(C#N)C1O,0.2981 | |
| C1CC2CCCCC2O1,0.3259 | |
| CC12NCC(=O)C1C2O,0.2002 | |
| C1C2CC34CC(O3)C14O2,0.2961 | |
| C1CC2C3OC3C=C2C1,0.2369 | |
| c1c(oc(=O)c(n1)O)N,0.152 | |
| CC1[NH2+]CC(=C1)C([O-])=O,0.151 | |
| COC1C2C3CN3C12,0.2831 | |
| CCCOC1=NCCN1,0.2766 | |
| CC12CC1CC2C1CC1,0.3293 | |
| CC#CC(NC=O)C=O,0.2122 | |
| CC1(NC1C(N)=O)C#N,0.249 | |
| CC1CCC=C(C)C1=O,0.1898 | |
| CC1(O)CC2CCC12C,0.3168 | |
| OC1CC2NC12C=O,0.2098 | |
| Cc1c[nH]c(c1C)C#C,0.1996 | |
| CC12C3C1C1=CC2N3C1,0.1054 | |
| CC1(CO)NC1CC=O,0.2191 | |
| COC1CC=C(C)CO1,0.2621 | |
| CN(C)C12C3CC1OC23,0.2964 | |
| COC1C2CC(O)C12C,0.3169 | |
| CCC#CC1CC1C,0.2781 | |
| O=C1CC2CC2O1,0.2799 | |
| C[NH+]1CC2(CC12)C([O-])=O,0.1695 | |
| OCC1CCC(C=O)=C1,0.1936 | |
| CC1C2C(O)C(=N)N12,0.2405 | |
| N#CC12CC3C4C1C2N34,0.2678 | |
| CNc1c(nco1)N,0.2126 | |
| O=C1C2CC3CCC2C13,0.2314 | |
| CN1C2C3C2C2(CO2)C13,0.3004 | |
| OCCC1CC(O1)C=O,0.2127 | |
| CCOCC1CC=CC1,0.2646 | |
| CC(C)C1C2C3C1CN23,0.3125 | |
| CC1COCOCCO1,0.3329 | |
| CC12COC1C(N2)C#C,0.2658 | |
| CCn1ncc(n1)OC,0.2285 | |
| O=C(C#C)C1CC1C#C,0.1906 | |
| CC(C)C1OC1C1CN1,0.3305 | |
| NC(=O)C1OCCC1=O,0.2011 | |
| CC(=O)CC(O)CCO,0.2296 | |
| C#CC(=O)OCC1CC1,0.2371 | |
| CC1N=COC1C#N,0.269 | |
| CC(CC#N)N1CCC1,0.2583 | |
| O=C1OC2COC1C2,0.2533 | |
| NC(=N)C(=O)COC=N,0.1724 | |
| C1CC2=CC=CC=CC12,0.1686 | |
| O=C1C2CC1C=CC2,0.2174 | |
| OCC12CCOC1C2O,0.3148 | |
| CC12CC(=O)C=CC1O2,0.1819 | |
| CCC1CC2(CN2)C1=O,0.2045 | |
| CC1CNC(=O)C=C1N,0.2088 | |
| COCC1CC1(C)C=O,0.2271 | |
| C1C=CCc2c1non2,0.2228 | |
| CCC1C2OC2C1OC,0.3166 | |
| CC(=O)C1OC11CCC1,0.2209 | |
| CN1CC1C12CC1OC2,0.2929 | |
| OCC1CNCC(=O)C1,0.1968 | |
| C1CN1C12C3C4C1N4C23,0.2666 | |
| CC#CC1(C)OCC=C1,0.2503 | |
| CC(C)OCCC=O,0.2272 | |
| CC12CC(O)(C1)CC2O,0.32 | |
| CCC1C(C)C1C(N)=O,0.2701 | |
| c1c(nc([nH]1)CO)CO,0.2432 | |
| CC12CC(O1)C2(O)C=O,0.2079 | |
| NC1C=CCOC1C#N,0.2392 | |
| C1CN1C(=O)NCC=O,0.2191 | |
| C#CC1CCC(=C1)C#N,0.2187 | |
| Cc1[nH]cc(c(=O)n1)N,0.1867 | |
| CC1OCC=C1CO,0.2509 | |
| CC#CCCCCOC,0.3031 | |
| c1c(c(c(cn1)F)N)O,0.2141 | |
| COC1CN=C(N)C1=O,0.1665 | |
| CC12COCC1C2CO,0.317 | |
| C1CCC=C(CC1)C#N,0.2166 | |
| OC1C2CN(C2)C1C#N,0.2587 | |
| c1c(c(n[nH]1)C=O)CO,0.1992 | |
| CCCC1(C)C2CCC12,0.3305 | |
| CC1(C)CC1(C)OC=O,0.2715 | |
| O=CN1CC1C1CCO1,0.2521 | |
| C1CC1Nc2nnon2,0.1921 | |
| OC1C2CCC1C2C#N,0.3095 | |
| COC1C2OC(N)=NC12,0.2628 | |
| CC1=CC(=O)NC2CC12,0.2074 | |
| Cc1cc(no1)CC#C,0.2453 | |
| C1C(=O)NC(=N1)C=O,0.1685 | |
| Cn1c(=O)[nH]c(n1)O,0.2529 | |
| C1CC1CCOC=O,0.2864 | |
| C#Cc1nc2n(n1)CC2,0.2221 | |
| CC1(C)CC(CO)O1,0.3191 | |
| CN1CC1C1CC1O,0.2992 | |
| CC1=CC2OC2C1,0.2422 | |
| Cn1ccnc1CCO,0.2443 | |
| COC(C)C(C)C(C)O,0.3156 | |
| CC1C2NC2C1C#N,0.2779 | |
| NC(C#N)C(O)C1CN1,0.2688 | |
| Cn1cnn2c1nnn2,0.2354 | |
| CC12CCC1CC21CO1,0.327 | |
| CC1CC(C)(C1)C(C)=O,0.2296 | |
| CC(=O)C1(C)CN1C=O,0.2154 | |
| O=C1C2OC3C4C3C1C24,0.196 | |
| CC1OC(CO)C1(C)C,0.311 | |
| CC12CCOC1C2C=O,0.2167 | |
| C1CC(C1)(C#N)C(=O)N,0.2668 | |
| C1COCC=CC=C1,0.2048 | |
| C(=N)Nc1nc([nH]n1)N,0.2225 | |
| CC12CN3C(COC1)C23,0.3096 | |
| OC1CC(=O)C1(O)C#N,0.1991 | |
| CC1(CC(C1)C=O)C,0.2241 | |
| CC1NC11CNCC1=O,0.1924 | |
| C#CC1C2CCCN12,0.2577 | |
| C(CO)C(=O)C(=O)CO,0.1578 | |
| O=C1OC2(CC12)C#C,0.247 | |
| CC(C)C(C#C)C#N,0.2982 | |
| CCCC1CCOC1=O,0.273 | |
| c1c(c(c(o1)C=O)N)N,0.1769 | |
| Cc1cc(cnc1O)N,0.1819 | |
| CC12CC(=O)N1C=CC2,0.2175 | |
| N#CC1NC2C3CC2C13,0.2732 | |
| CN=C1NC(=O)CC=C1,0.2053 | |
| N=C1C=CC=COC1=O,0.1615 | |
| CC([NH3+])C1=NOC(=N)[N-]1,0.2258 | |
| NC1(CC1(O)C#N)C#C,0.2454 | |
| CNc1cn(nn1)C=O,0.1579 | |
| C#CC#CCC=O,0.2075 | |
| CC(C)C#CC(C)CO,0.2996 | |
| C1OC1C1=CN=NO1,0.2241 | |
| CC1(NC1C#N)C=O,0.2222 | |
| COC1(C)CCC(C)O1,0.3328 | |
| C1CC1(CNC=O)C#N,0.2774 | |
| CC1=CC2CC1(O2)C=O,0.1973 | |
| c1c(c(ncn1)C#N)N,0.168 | |
| CC1(CC(N)=O)CO1,0.2696 | |
| CC1(C)NC11COC1=N,0.2632 | |
| OC1COCC=CC1O,0.2376 | |
| c1nc(c(c(n1)F)N)F,0.2077 | |
| CC1=C2CCC2C2NC12,0.2343 | |
| CC(CC#N)C(C)C#N,0.3387 | |
| OCC12CN1C(=N)OC2,0.2843 | |
| CC12CC1C(=O)CC2=O,0.2141 | |
| c1c(nncn1)C=O,0.1492 | |
| Cn1c2nncn2cn1,0.2046 | |
| C1OCC23OC2C=CC13,0.2388 | |
| CC12NC(CC=C1)C2=O,0.2203 | |
| Cc1c(ncnc1O)O,0.2298 | |
| O=COC1=NC2CC2C1,0.2311 | |
| OC1COC2COCC12,0.2981 | |
| FC1=COC(=N)N=C1F,0.1685 | |
| OCCC(O)C#CC#C,0.2239 | |
| CCC1CC(O)CC=C1,0.2645 | |
| CC(=O)n1ncnn1,0.2129 | |
| CC(=O)C1(CN1)C#C,0.2225 | |
| CC1CC2CC2C(O)C1,0.3284 | |
| CC1(O)C2CC1C(=O)O2,0.2673 | |
| CC(NC=O)C#CC#N,0.2206 | |
| C(CC(=O)C#N)C#N,0.2117 | |
| CC1(CN1)C1(O)CC1,0.307 | |
| N=C1OCC2CCOC12,0.2692 | |
| C(=O)C(=O)C(=O)C(=N)N,0.1453 | |
| OC12CC(C=CC1)C2=O,0.2144 | |
| NC1(CC2CCC12)C#N,0.2908 | |
| COC(C)CC(C)C#C,0.3075 | |
| N=C1CC(N1)(C=O)C#N,0.1909 | |
| Cn1cc2c(n1)CCC2,0.2417 | |
| CN=C1CN=CN1C=O,0.2154 | |
| c1ncnc(n1)C(=O)N,0.1774 | |
| OCC1CC2NC1C2=O,0.231 | |
| CN1CC2OC(=N)C12,0.2431 | |
| CCC(OC)C1NC1C,0.3161 | |
| COC1(CC(O)C1)C#N,0.2887 | |
| O=C1CC=CCC2OC12,0.2195 | |
| Cc1c(oc(n1)O)NC,0.2408 | |
| NC1=NOC=NC1=N,0.1923 | |
| CC1OCC1(C=O)C=O,0.1997 | |
| CCc1ccncc1C,0.2283 | |
| NC(=O)C#CCOC=N,0.2298 | |
| O=C1COC2CN3C2C13,0.2058 | |
| COCCOCCC#N,0.2953 | |
| CNC(CO)(C=O)C=O,0.1958 | |
| CC1OC2C(NC=O)C12,0.2631 | |
| CC1(CO1)C1(CC1)C=O,0.2259 | |
| OC1C2OC2C2CC12O,0.3116 | |
| CCC(CC)(C(=O)N)O,0.2657 | |
| O=C1C2OC2C2OC12,0.1909 | |
| CC1C2CCC3CC2C13,0.3384 | |
| [NH3+]C1(CC1)C([O-])=O,0.2701 | |
| CC(C)C1=CCC2CC12,0.2468 | |
| OC1C(O)C11C2CC1C2,0.2756 | |
| CC12C(O)C1CN1CC21,0.2805 | |
| CC1C2N(C)C(=O)C12O,0.2397 | |
| CC(C=O)C1OC1C#C,0.2216 | |
| CC1C2C=C(CN12)C#C,0.1865 | |
| c1c(n[nH]c1N)C(=O)N,0.2113 | |
| CC1C(OCC1=O)C=O,0.2051 | |
| CC12NC3C=CC1OC23,0.2229 | |
| C1CNc2c1nc(o2)O,0.2186 | |
| CC12C(O)C1CC2=NO,0.2432 | |
| CC1CN2CC2C11CO1,0.3005 | |
| CCCOC(CC)C#N,0.3034 | |
| COc1cnc([nH]1)OC,0.2475 | |
| CC1NC1C#CC1CC1,0.2714 | |
| c1c(non1)CNC=O,0.2283 | |
| CC(=O)C(C#N)C1CN1,0.2218 | |
| N=C1CC(CO1)NC=O,0.2713 | |
| OC12CC3(O)C1CC23O,0.3003 | |
| CC12CN1C1COC21,0.2843 | |
| C1C2OC2C2=CNC=C12,0.2442 | |
| CCN1CC1CC(N)=O,0.2682 | |
| CC1=NOC(=N)C=N1,0.1657 | |
| CN1C2C3OC2(C)C13C,0.2935 | |
| OCC1(CCC1O)C=O,0.2178 | |
| CC12CN1CC2(C)O,0.2911 | |
| COc1nc(co1)C#N,0.2117 | |
| CN1C2C1C(=O)NC2=O,0.2167 | |
| OCC1CCN1CC#N,0.2643 | |
| CN=C1CC2CC2(C)O1,0.265 | |
| CC1CNC2=C1N=CO2,0.2082 | |
| O=C1CCOCC2NC12,0.2182 | |
| CC1C(O)CC1CC#C,0.313 | |
| C1CC(OC1)(C#N)C#N,0.2747 | |
| Cc1c(c[nH]c1C#C)N,0.1862 | |
| OC1CCC2(CC2)C1,0.3334 | |
| CC(CN)(C#N)N1CC1,0.2716 | |
| CC(=NO)C1(C)CCO1,0.2536 | |
| OC(CNC=O)C#N,0.261 | |
| CN1CCC11CC1C#N,0.2429 | |
| CC1=CCC2(CC12)C#C,0.2441 | |
| CC1C(C[NH+]1C)C([O-])=O,0.1817 | |
| CC1=CNCC(O)C1=O,0.1786 | |
| CC1=NC(=N)C=NO1,0.1958 | |
| OC(C#C)C1(O)CC1O,0.2451 | |
| NC1C2NC2CC1C#N,0.2788 | |
| NC(=O)C12C3CN1CC23,0.2605 | |
| NC1=NC2CC2(CO)O1,0.2694 | |
| c1cc(ncc1O)N,0.1798 | |
| CCC(C)C=O,0.227 | |
| OC12CC1OC2C#N,0.2528 | |
| CC(=O)N1CC2(C1)CO2,0.2655 | |
| OC12C3NC1C3C2C=O,0.2075 | |
| OC12CC3OC(C13)C2=O,0.2065 | |
| OC(CC#C)(C=O)C#N,0.2034 | |
| C(C=O)n1c(=O)[nH]nn1,0.2112 | |
| CCC1=CCOC1C#N,0.2529 | |
| CC12OC1C1OC(=O)C21,0.2678 | |
| CC12C=CC3C=CC1N23,0.2089 | |
| OC12CC1N1N=NC=C21,0.2252 | |
| C#Cc1nc(no1)C=O,0.1875 | |
| Cc1ccncc1N,0.2013 | |
| Cc1c(c(ccn1)F)F,0.2339 | |
| CC12NC3C(=O)C1C23C,0.2278 | |
| CC#CC1CC2C(C)N12,0.2613 | |
| CC#CC1(O)CC2NC12,0.2709 | |
| CC12CC1C(=O)NC2,0.2666 | |
| Cc1cc[nH]c(=O)c1N,0.1682 | |
| C(C(=O)N)(C(=O)N)N,0.2334 | |
| CC12C(C#C)C1N1CC21,0.2573 | |
| CC(C)C1CC(=O)N1C,0.2765 | |
| C#CC1CCC(=C1)C#C,0.2095 | |
| O=C(C#N)C1C2CN1C2,0.1625 | |
| OC(COCC#N)C#N,0.2972 | |
| CC1C2OC1C(=O)C2C,0.2118 | |
| OCC1(CO1)C1CN1,0.32 | |
| CC1C2(O)CC1(C2)C=O,0.222 | |
| Cc1cc(c(o1)O)NC,0.2074 | |
| OCC12CC(C1)(C2)C#C,0.2996 | |
| CCC12CC3CCC1C23,0.3313 | |
| CC(O)CC(=O)CO,0.2381 | |
| O=CC1=CNCC11CO1,0.1809 | |
| CCC(=O)C1(O)CC1C,0.2232 | |
| C1C2OCC11COCC21,0.3193 | |
| CCC12C3C4C(CC14)N23,0.3016 | |
| CCC#CC1(CN1)C#N,0.2524 | |
| OC1CC(=O)CC=C1,0.2267 | |
| CC12NC1C1(C)CC2C1,0.3024 | |
| CCC1(CN1)C(N)=O,0.2646 | |
| CCN(C=O)C1CC1C,0.2637 | |
| CCCC1(CC1)CO,0.3328 | |
| OC1CC(C=O)C11CN1,0.2022 | |
| NC1=C(CN2CC12)C=O,0.1781 | |
| Cc1cc[nH]n1,0.2689 | |
| CNc1c(cn[nH]1)CO,0.2307 | |
| COC1CC1C,0.3346 | |
| O=C1CN2C3COC3C12,0.2034 | |
| Cc1conc1NC,0.2299 | |
| CC(C=O)C1(O)CC1C,0.2179 | |
| O=C1C2C3CN1C23C#C,0.2411 | |
| CC12CC1CC(O)C2=O,0.2118 | |
| C1CC(=NO)C=C1C#N,0.1636 | |
| CC1NC2COC1OC2,0.2889 | |
| CCc1c[nH]nc1O,0.2456 | |
| N=COC1(CNC1)C#N,0.2479 | |
| CCCC(O)CC#N,0.315 | |
| OC1CC11OC2CC1C2,0.3068 | |
| CC1(C)N2CC11CCC21,0.2569 | |
| CN(C)c1[nH]cc(n1)O,0.2263 | |
| C[NH2+]C(C)C#CC([O-])=O,0.2013 | |
| O=CCC12CC3C1CC23,0.2262 | |
| N=C1N=CNC=CC1=O,0.1767 | |
| OCCC(O)C#N,0.2894 | |
| CC1(O)C2OC2C1CO,0.3111 | |
| CCc1cnc(nc1)N,0.1927 | |
| CC1(O)C2CCCC1O2,0.3077 | |
| CC12CC3(O)C(O1)C3O2,0.2938 | |
| c1cc2n(c1)CCCN2,0.222 | |
| OC1C2C3C4C2CC1N34,0.3188 | |
| O=C1CN=C2NCC2O1,0.2451 | |
| C1OC2C=CC3NC3C12,0.2389 | |
| CCC1NC1C(=O)OC,0.26 | |
| C1C2OC2C2=C1NN=N2,0.238 | |
| OC1(CCC=C1)C1CN1,0.2412 | |
| c1cc2c(nc1)onn2,0.1947 | |
| CC#CC1(CN1)C#N,0.2529 | |
| CC1C2CC(C)C12C,0.3226 | |
| CC(N=C(N)C=O)C#N,0.189 | |
| N=C1OCC2NC12C#C,0.2491 | |
| Cc1c2c(no1)ocn2,0.2026 | |
| CC1(C)CN=C(N1)C#N,0.1996 | |
| COC12C(C)C3C1CC23,0.3333 | |
| CCOC12CC1C(C)C2,0.3309 | |
| N=C1NC2COCOC12,0.2612 | |
| CCc1cccn1C,0.2386 | |
| CCC12CC1OC(C)O2,0.3283 | |
| Cc1c([nH]nc1O)C=O,0.1703 | |
| CNc1c[nH]cc1C#N,0.1935 | |
| CC(N=COC=O)C#N,0.2448 | |
| CN1C2CCC1C(=O)C2,0.2108 | |
| c1c(=O)cnon1,0.1674 | |
| CC12COC(COC1)O2,0.3254 | |
| C1C2CC1N=COC2,0.2687 | |
| c1cn[nH]c1CC=O,0.207 | |
| CNC1=CC(=O)OC1,0.2184 | |
| OC1C2CC1(O)C(=N)O2,0.2787 | |
| CC12CCC1C(CO)O2,0.3081 | |
| CN1C2C3(C)CC2(O)C13,0.2785 | |
| C1C2CC1O2,0.3346 | |
| NC(C#N)C1=COC=C1,0.2388 | |
| C1CC2C=CC=CCC12,0.1961 | |
| OC1C2C1N1CC(O)C21,0.2671 | |
| CC12C(O)CC11CN2C1,0.2469 | |
| CC(=N)OCC(=O)C#N,0.1866 | |
| CC1OC(=O)N(C)C=C1,0.2196 | |
| CC1C=CC2NC12CO,0.2447 | |
| CC1CCC2(O)CC2C1,0.3255 | |
| OC1C2NC1(C#N)C2O,0.2705 | |
| N=C1COCC(O1)C=O,0.2145 | |
| CC1OC1C(C)(O)C#N,0.2958 | |
| CC12CC3=CCC1C23,0.177 | |
| COC(=O)C1CCN1C,0.2301 | |
| OC1C=C(C=O)C2NC12,0.181 | |
| CC(O)C(O)C(C)C#C,0.2943 | |
| Cc1cccc(c1)F,0.2314 | |
| OC1C2C3C4COC13C24,0.2992 | |
| c1c[nH]c2c1NCCC2,0.2233 | |
| OCCC1(CC1)OC=N,0.2821 | |
| CC1C2C3CC1CCC23,0.3336 | |
| CC(=O)NC12CC(C1)C2,0.2723 | |
| CC1(O)CC(=O)C=C1,0.1912 | |
| OCC1(CO)C2CC1C2,0.328 | |
| O=CNC(CC#N)C=O,0.2091 | |
| Cc1cc(ccc1N)O,0.1906 | |
| CCC1CC2(NC12)C#C,0.2536 | |
| CC1CC2(C1)OC1CC21,0.3024 | |
| CCC1CCC1COC,0.3317 | |
| O=CC(C#C)C#CC#N,0.204 | |
| N=C1OCC11CO1,0.2721 | |
| OC(CC#C)C1CN1,0.2783 | |
| O=C1NC=CC1C1CO1,0.2129 | |
| COC1C2C3CC1N23,0.3144 | |
| COCC1OC2COC12,0.3021 | |
| OCC1COC1CC#N,0.2906 | |
| COc1nc(=O)[nH]nn1,0.1739 | |
| CC1(C)C2NC2C1CO,0.2995 | |
| CC(=N)Nc1ccno1,0.2109 | |
| CC1NC1(C)CN1CC1,0.3187 | |
| C1OC23C4OC2C4C3=C1,0.2532 | |
| COC(C#N)C#CC#C,0.2187 | |
| CC1OCCCC1C#N,0.2981 | |
| CC(=O)N1CC1CC=O,0.2217 | |
| CC(=O)C1C2CC2C1=O,0.2151 | |
| CC1CCCC(C1)C#C,0.313 | |
| CCC1COC11CC1O,0.2894 | |
| CCC12CC3C1N3C2=O,0.2474 | |
| CC12CC1(NC2)C#N,0.238 | |
| CC1=C(C)C(=N)NN=C1,0.1595 | |
| C1CC2OC3CC1C2O3,0.3278 | |
| C1CC11COCC2CN12,0.2985 | |
| OCC1C2CC3CC1N23,0.2851 | |
| OCC1COC(=N)CO1,0.2742 | |
| CC1CC2(C1)NC2C=O,0.2201 | |
| CCC(C)OC1CC1C,0.3191 | |
| CC1CC(C1)OCC#C,0.2847 | |
| CC1C2OC(C)CC12O,0.3122 | |
| Cc1c(c([nH]n1)O)C#C,0.2298 | |
| COC1(CC1C#C)C#N,0.2661 | |
| CCCC(=O)C#CCC,0.2091 | |
| CC12CCC1C(=O)O2,0.2777 | |
| CC1(CO)COC2CC12,0.2967 | |
| CC1C2CC1(O)CC2=O,0.2292 | |
| CCC1OC2CC2C1O,0.3 | |
| C(=O)Oc1nc(no1)N,0.2083 | |
| CC12CC3C1C3(O)CC2,0.3206 | |
| CC1=C2C=CC3C2N3C1,0.1712 | |
| COC1C2CC1(O)CC2,0.3359 | |
| CCC(C)(C[NH3+])C([O-])=O,0.2754 | |
| CC1CC11CC2COC12,0.3066 | |
| c1c(cnc(n1)CO)F,0.1959 | |
| c1c(nc([nH]1)C#N)CO,0.2038 | |
| C#Cc1c([nH]c(n1)O)O,0.208 | |
| CC1=CCOC2C(O)C12,0.2349 | |
| CC1C2N3C1CC23C,0.3274 | |
| CC(C#C)C#CC(N)=O,0.2335 | |
| COC(C)CC(C)(C)O,0.311 | |
| CNC(CC1CO1)C#N,0.2668 | |
| CC1(C)C2CC3OC3C12,0.3261 | |
| CCC12CC3CC1C2O3,0.3183 | |
| C#Cc1ccccc1O,0.1901 | |
| C1CC(O1)C1=NNN=C1,0.2441 | |
| O=CC1OCOCC=C1,0.2176 | |
| O=C1C2CN2CC2NC12,0.2075 | |
| CC(=O)NCCC#N,0.2747 | |
| N#CC#CC12CC(C1)C2,0.2373 | |
| CN(C)C1CC1(O)C#N,0.2666 | |
| c1cn(c(=O)[nH]1)CC=O,0.1696 | |
| C1C=CC2OCCC=C12,0.2506 | |
| C1CNC(=C1C=O)C=O,0.1305 | |
| CCC1=C(COC1)C,0.2465 | |
| CC(C)C1OC11COC1,0.3194 | |
| Cc1cnc(c(n1)C)N,0.1839 | |
| O=CN1C2C3CC3C12,0.2349 | |
| c1c(c(=O)nco1)C=O,0.1706 | |
| CC1CC(O1)C(C)(C)C,0.3165 | |
| NC1=CC(O)=NNC1=N,0.1664 | |
| COC1(C)C2COC12,0.2984 | |
| CCCN1CC2OCC12,0.2873 | |
| Cc1ccc(c(c1)O)C,0.2185 | |
| COCC1(CO1)C(C)C,0.3255 | |
| C1C=CC(=NO)CC1=O,0.1862 | |
| C#CC1OC2CCOC12,0.2655 | |
| O=C1N2CC3C2C13C#N,0.2426 | |
| O=C1CCC23CCC12N3,0.2176 | |
| O=CC1C2C3C4C3N2C14,0.2002 | |
| CC1CN1C(=O)C1CC1,0.2526 | |
| CC1(C)CC=CC1(C)O,0.2575 | |
| O=C1CN2C(C#N)C12,0.2207 | |
| CC1CC=C(C)C(=O)N1,0.2132 | |
| CN=C1OC(C)C(N)=C1,0.2076 | |
| N=C1C2OC3C4C3N1C24,0.2149 | |
| c1c-2ncnc2nn[nH]1,0.1892 | |
| CCCC(=O)OCC#C,0.2815 | |
| CCC(C)C#CC1CN1,0.2691 | |
| OCC12CN=C3CC1N23,0.1918 | |
| CC1C(N)=CC(=O)C1=O,0.1524 | |
| C#CCN(C=O)C1CC1,0.2541 | |
| CN=C1NCC(=O)N1,0.226 | |
| CC1=C(OC(=N)O1)C=O,0.1705 | |
| CCC1(C)COCC=C1,0.2653 | |
| CCOCC1CC1CO,0.325 | |
| OC1CC1N1CC1C#N,0.2465 | |
| OC1CC11COC1=N,0.2799 | |
| CC1OC1C1=NOC=C1,0.2441 | |
| CC12OC1C=CC21CN1,0.2366 | |
| CCC1NC1(C)C(N)=O,0.2654 | |
| CN1CCCCC1=O,0.2654 | |
| OC(CC#C)C1CCC1,0.3045 | |
| CC(=O)NCCC=O,0.2224 | |
| CC(C)CN1CC(=O)C1,0.2065 | |
| c1cc([nH]c1CCO)N,0.232 | |
| OC1CC2(C1)CCCO2,0.3115 | |
| OC1CC(C2CC2)C1=O,0.2178 | |
| CCC1(OCC1C)C#C,0.275 | |
| O=CC1CC=CC1C#N,0.2215 | |
| CC1C2C3N2C1(C)C3=O,0.2319 | |
| CC1N(CC=C1C)C=O,0.2455 | |
| CCCOc1conn1,0.2016 | |
| OC1CC11COC1=O,0.2752 | |
| CC1CC11CCO1,0.3021 | |
| N=C1CCCN1C=O,0.2252 | |
| CN(C=O)C(=N)C#N,0.1969 | |
| N#CC(C1CO1)C1CO1,0.3059 | |
| OC1C2CNC12CC#N,0.2589 | |
| CNC(=O)C1(CC1)C=O,0.2129 | |
| N#CC12CC(C1)C1NC21,0.2741 | |
| COCC1NC1C#N,0.2785 | |
| O=CN1C2CC1C2C#C,0.2508 | |
| COCC1(C)CC(C)O1,0.3207 | |
| CC1COC2CC2C1,0.302 | |
| CC#CCC1CCCC1,0.3009 | |
| COC1CCC1(O)C#C,0.2695 | |
| CC1(CC#N)C2CC1C2,0.342 | |
| OC1CCN2N=NC=C12,0.2525 | |
| O=C1OC2CC=CC2=C1,0.189 | |
| CC1=CC(=O)NCCN1,0.2029 | |
| CC#CC(=O)COC=N,0.1921 | |
| O=C1CC2CN2C1=O,0.1551 | |
| CCCCC1CC1C=O,0.2286 | |
| CC(O)C(O)C1CCC1,0.3059 | |
| CC1CC(=O)COC=N1,0.2171 | |
| CC(CC(N)=O)OC=N,0.2711 | |
| CC1OC2CC1C2C#C,0.2819 | |
| c1c(c[nH]c1CCO)O,0.2284 | |
| CCn1cc(cc1N)O,0.2254 | |
| OC12C3CC1C(C3)C2=O,0.2281 | |
| C1CC(O1)C1=CCCC1,0.247 | |
| O=C1C2NC1C1NC21,0.2366 | |
| CCc1c(nc[nH]1)NC,0.2083 | |
| C1CC(=NO)C(=C1)C=O,0.1663 | |
| N=C1CC(O1)C=O,0.2222 | |
| OC1CC1C1COC1,0.3126 | |
| CC1OC(=N)N(C)C1=O,0.2506 | |
| CCC1(C)OC1(C)C=O,0.2148 | |
| CC(C)C(=O)C#CC#C,0.1827 | |
| CNC(=O)CCOC,0.2778 | |
| CCC1=CN=NOC1=N,0.1662 | |
| CC1NC1(C=O)C(C)=O,0.2168 | |
| COC12CC1(CC2)C#N,0.2586 | |
| CN1CC(C1)(C#N)C#N,0.2399 | |
| c1c(cnc(c1O)O)N,0.1839 | |
| CCc1cc(oc1)OC,0.2303 | |
| COCC1=CC2OC2C1,0.2413 | |
| CN(C=O)C(C#N)C#N,0.2553 | |
| CC1C(OC11CC1)C#N,0.255 | |
| CC(=O)C1C(O)CC1=O,0.2004 | |
| c1c[nH]c(c(c1=O)N)F,0.1804 | |
| CC(=Nc1cnno1)N,0.1821 | |
| C#CC1(CC2CO2)CC1,0.2945 | |
| Cc1cc(=O)cn[nH]1,0.187 | |
| O=C1COCC2OC12,0.2062 | |
| OC1C2C1C(=O)C2C#C,0.2194 | |
| OCC1CN1C1COC1,0.2835 | |
| c1nnno1,0.2667 | |
| CC12CCC1(O2)C1CC1,0.3177 | |
| CC12CCOC1C2O,0.3131 | |
| OC12CCC1COC2=O,0.2625 | |
| CCC1=CCC2CC1C2,0.2482 | |
| O=CC1C=CCC2NC12,0.2038 | |
| N=C1CCC2OC2CO1,0.274 | |
| CCCC(C)CC,0.383 | |
| COC1CNC11COC1,0.292 | |
| C1C2CC11CCCCC21,0.3554 | |
| C1C23COC12CCCC3,0.2971 | |
| CC1C(O)C1(C)N1CC1,0.2943 | |
| C(=O)c1c(non1)C#N,0.1836 | |
| COC1CCCC(C)C1,0.3268 | |
| CC12CN1CCC1OC21,0.2974 | |
| CC1C(=O)C2OC12C#N,0.2086 | |
| CCCC1(C)CC(C)C1,0.3534 | |
| C1C2CC34CC1C23CO4,0.2876 | |
| CCCC1CCC1,0.373 | |
| CC1(CO)C(O)C2CN12,0.3008 | |
| C1CC2C3OC2C2C1C32,0.3185 | |
| N=C1C=NNC(=N1)C#C,0.1686 | |
| OC1CC2(C1)C1CN2C1,0.3055 | |
| CC1CNC2=CNC=C12,0.2211 | |
| c1c(=O)c(c[nH]c1F)O,0.198 | |
| C#CC12CC1COC=N2,0.2404 | |
| CCC12CC1(C)CCO2,0.3046 | |
| OCCNC1COC1=N,0.2552 | |
| O=C1CN2C1C21COC1,0.2176 | |
| Cn1ccc2c1[nH]nc2,0.2231 | |
| CCC1=CC2(C)NC2C1,0.2431 | |
| CC12C3N1CC2C3=NO,0.2418 | |
| COC1CC2(O)CCC12,0.3106 | |
| CCC1(C)OC2C(C)C12,0.3111 | |
| CCC12C(C)C1C1CC21,0.2778 | |
| CC([NH3+])C1OC1C([O-])=O,0.2607 | |
| N1C2C3C1C21N=COC31,0.2361 | |
| CC1(CCC([O-])=O)C[NH2+]1,0.2734 | |
| OC1C2CCC(C=O)C12,0.2298 | |
| CC12COC(O1)C1OC21,0.338 | |
| OCC1CC11CCC=C1,0.2469 | |
| CC1C2NC2CNC1=O,0.2742 | |
| CC1CN1C1CC1,0.3135 | |
| NC1=NNC(O)=NC1=N,0.1909 | |
| CC#CC(O)CNC=O,0.2702 | |
| Cc1cc(c(o1)C)N,0.2136 | |
| CC1N=COC2CC12,0.2704 | |
| CC12OC1C(=O)C2(C)O,0.2072 | |
| CC12CC1(CC#N)OC2,0.2722 | |
| c1nc(on1)NC2CC2,0.241 | |
| CC1OCCC(O)C1=O,0.2118 | |
| CC12OC3=NCC1C23,0.163 | |
| C1OC2CC1C1OC21,0.3322 | |
| CN=C1CC(=O)CCO1,0.2191 | |
| CC1C(C)C1(O)C1CN1,0.2822 | |
| O=COC1CCC1C=O,0.2255 | |
| N#CC1=CCC2CC2C1,0.2233 | |
| c1c(nco1)OC=O,0.2323 | |
| CCC(OC)C1CCO1,0.3171 | |
| O=C1CC2C(C3CN3)N12,0.2333 | |
| CC1C2C3N2C1C3=NO,0.2382 | |
| CCC(=O)OC1COC1,0.2623 | |
| CC1=CON=C1OC=N,0.2408 | |
| Cc1cc(cc(c1)C)C,0.2378 | |
| CCC(O)C1=CON=C1,0.2447 | |
| NC1=CNN=CC1=N,0.163 | |
| CC1CC2(CN2)C1=O,0.2058 | |
| CC1(O)CC2(CO)NC12,0.2781 | |
| OC12CC3C4C(C14)C23,0.3033 | |
| O=C1CC2(CN2)C(=O)N1,0.2345 | |
| CC1NC(C=C1C)C#N,0.2387 | |
| COC(C)C1=CN=CO1,0.2419 | |
| CC1NC11CCC11CO1,0.2978 | |
| NC(=[NH2+])C1=C(O)N=N[N-]1,0.18 | |
| CC12CC=CC(N1)C2=O,0.2142 | |
| CC1=CC(O)C2OC12C,0.2394 | |
| CC1=COC(=N)C=C1N,0.1677 | |
| CC12CC=CCC1CO2,0.2592 | |
| CNC(=O)C(=O)C=O,0.1268 | |
| CC12CCC3CC(O1)C23,0.3131 | |
| CC1(C)C(O)C1CCO,0.2934 | |
| C1CC2COCCC1O2,0.3162 | |
| CC12OCOC1C2C=O,0.2173 | |
| c1nc2c(o1)C=CC2=O,0.1318 | |
| CC(CC#C)NCC#N,0.2722 | |
| C1C2OC22C=CCCC12,0.2274 | |
| c1c[nH]c2c1c(c[nH]2)N,0.2177 | |
| ON=C1C2C3C=CC1C23,0.2212 | |
| CC1OC1C1OC1C#N,0.2732 | |
| NC12C(O)C1OC2=N,0.2572 | |
| Cc1ccccn1,0.2276 | |
| C#CCN=C(C#N)N,0.223 | |
| OCC1OC1CNC=O,0.2821 | |
| OC12C3CC1CC2C3,0.3049 | |
| CC1OC1CN1CC1C,0.3026 | |
| CC1(O)CCCC1=O,0.2179 | |
| OCC1OC1COC=N,0.283 | |
| O=CCC12CC(C1)CO2,0.2194 | |
| CCC1C2N3CC3C12C,0.2837 | |
| CC1C2CC(=O)CN12,0.2019 | |
| OCC1=CC(O)CC1=O,0.1928 | |
| NC(=O)C1COCC1=O,0.2123 | |
| CCC1C2OCCC12C,0.318 | |
| CC#CC(=O)C#CCO,0.1898 | |
| OC12CC(C=C1)C1CC21,0.2529 | |
| CCCNC(=O)C,0.2781 | |
| c1[nH]nc(n1)OCC#N,0.2531 | |
| CC1C=C(C#C)C2OC12,0.1996 | |
| CC12CC1C1(CC1)C2=O,0.2284 | |
| C1CNC(=O)C(=O)CN1,0.1763 | |
| O=CC1C2CC2C2CN12,0.206 | |
| OCC1COC1CO,0.3081 | |
| C1OC2CC3CC12CO3,0.3195 | |
| C#CC1NC1C1CCC1,0.2808 | |
| NCC1(OC2CC12)C#N,0.2604 | |
| CC(O)C1OC1C1CC1,0.3253 | |
| CCC(C)C(F)(F)F,0.4177 | |
| CC(N)C(=O)OCC#N,0.2473 | |
| CN=C1NC=NCCO1,0.226 | |
| CCC#CC1(CCC1)O,0.2809 | |
| Cc1c([nH]nc1O)C,0.2441 | |
| OCCOC1CC1C#C,0.2859 | |
| OC1CN(C1)C1COC1,0.2966 | |
| N=C1OCCOC1C#C,0.2688 | |
| CC(=N)OC(=O)CC=O,0.2267 | |
| CC1C2OC1(C=C2)C#C,0.2359 | |
| CC(=O)N1CC(C1)OC,0.267 | |
| COC12C3CC1COC23,0.3019 | |
| C1C2CC3=C(ON=N3)C12,0.2041 | |
| CC1CC1C1=CN=CN1,0.2436 | |
| O=CC(=O)C12CC1CO2,0.1495 | |
| Cc1cccc(=O)cc1,0.1562 | |
| CC1CC2(C)C1NC2=O,0.272 | |
| CC1=C(O)N=NOC1=O,0.1697 | |
| O=C1CC2C(CC#N)N12,0.2335 | |
| C1CC2=CCCCOC12,0.2457 | |
| C1C2OC11COCC21,0.3109 | |
| C1C2CC3(CCO3)C12,0.3161 | |
| O=C1C2C3NC1(C#C)C23,0.2235 | |
| CCN1CC12CC(=O)C2,0.2111 | |
| CCC(C)CC1CO1,0.3442 | |
| CC(C)CC1CC1(C)O,0.3232 | |
| CC1=NC(C)=NC(=N)N1,0.182 | |
| Cn1cc(nn1)N2CC2,0.2398 | |
| CC12OC3C1OC23CO,0.2903 | |
| CCC(=O)OCCC#N,0.2861 | |
| NC1=CC(=NO1)C1CO1,0.2248 | |
| COCCC(C)OC=O,0.2656 | |
| O=CC1CN2C1CC2=O,0.2023 | |
| CCC(=O)COC(C)=N,0.2353 | |
| CCC12OC3C1C2C3O,0.2965 | |
| CC1NC(C2CN2)C1=O,0.2009 | |
| OCC1(NC2CC12)C#N,0.2615 | |
| C1C2(N1)COC2,0.3037 | |
| OC1(COC=NC1)C#C,0.2669 | |
| O=C1CC(CCO1)C#C,0.2665 | |
| OC1CC(O)(C1)C#N,0.2777 | |
| NC12CNC1C2C#N,0.2671 | |
| COC1(C)COC2CC12,0.3149 | |
| CCCC1OC2C(C)C12,0.3088 | |
| OC12CC3(NC1C23)C#N,0.2394 | |
| CNC(=N)NC(=O)OC,0.2348 | |
| C1C2CC3=C(NN=N3)N12,0.2303 | |
| CC1(C)C(O)CC1C=O,0.2192 | |
| CC(C)C1CCC1=O,0.2191 | |
| CC(=O)C(=O)COC=O,0.1557 | |
| C1CC2CN=COC2O1,0.2724 | |
| CC(C)C(C(C)C)OC,0.3201 | |
| O=CC1OC2C3OC1C23,0.2054 | |
| C1C2OCCN=COC12,0.2461 | |
| NC1COC1=NCC#C,0.2582 | |
| CC(O)COCC#N,0.2752 | |
| CNC(C#N)C1(C)CN1,0.2729 | |
| CC(C)(CC1CC1)O,0.3228 | |
| CNC(=O)C(OC)C#C,0.2495 | |
| CCC1(C)CCOC1=N,0.2872 | |
| NC(=O)C(OC=N)C=O,0.2104 | |
| CC1CC2=C(N1)ON=C2,0.2145 | |
| CC12CC1CCC=C2,0.252 | |
| CC12CC3OCC1CC23,0.3213 | |
| CC1C2CC2C1(O)C#C,0.282 | |
| CC1CC11C2NC2C1C,0.3046 | |
| CC1C2OC3C2(C)C13O,0.2803 | |
| OC12CC(CC1)C21CO1,0.3179 | |
| OC1C2C(O)C1(O)C2O,0.3019 | |
| CC1OCC(CC#C)O1,0.3085 | |
| CCC12COC(O1)C=C2,0.2449 | |
| c1c(onn1)C2COC2,0.2177 | |
| CC1(CCO1)C(O)C#N,0.2688 | |
| CC1(C)C2C3C(N13)C2=O,0.2287 | |
| CCCC(C)CCCO,0.3427 | |
| OC1C(CC#N)NC1=O,0.2685 | |
| c1c2c(n[nH]1)CN=CN2,0.2121 | |
| CC12CC1CCCO2,0.3036 | |
| CC1NC11C(O)CC1=O,0.2109 | |
| CCC12CC1C1C(O)C21,0.2738 | |
| O=CC1CC1(C=O)C#C,0.1929 | |
| N=C1OC2C3CCC3C12,0.2819 | |
| O=CC1CCC(=O)N1,0.2077 | |
| Cc1c([nH]cc1CO)C,0.2415 | |
| CC1OCC2=NNC=C12,0.2451 | |
| COC1C(C=O)C1(C)C,0.2213 | |
| CC#CC1OCC1=NO,0.2465 | |
| CC12C3C4C(CC14O)N23,0.2869 | |
| O=C(C#N)C1CC1C#C,0.1805 | |
| CC1CC(=O)N1C(C)=O,0.2292 | |
| CN1CC2OC(CO)C12,0.2779 | |
| CC1(CN1)C1(C)CO1,0.316 | |
| O=C1CC23CC2(CO3)O1,0.2479 | |
| CNc1c(ocn1)CO,0.1958 | |
| Cc1c(nc([nH]1)O)C#C,0.2067 | |
| CC(OC=O)C1CC1,0.2844 | |
| COC1(C)OC(C)C=C1,0.261 | |
| CC#CC#CC(C)C#N,0.2229 | |
| CCCC(=O)N,0.2789 | |
| CC(=O)CC(O)C1CC1,0.2297 | |
| CCC1(O)C(O)C1C=O,0.2197 | |
| FC1=NOC(=N)C=N1,0.159 | |
| C#CCN1CC2OCC12,0.2591 | |
| CCC1(CCCC1)CC,0.3634 | |
| C1C=CC=CC=C1C=O,0.1554 | |
| CC12CN3CC1(C#C)C23,0.2558 | |
| CN=CN(CC#C)C=O,0.2266 | |
| CCC(C#N)C1CC1C,0.3203 | |
| FC1=CC=NC(=N)N1,0.1687 | |
| CC1(CCC1)C,0.3649 | |
| CCC(=O)C12CC1CC2,0.2264 | |
| CC12OC1C1(NC21)C#C,0.2356 | |
| CC1(CC(O)C#N)CO1,0.288 | |
| C#CC12NC1C1CC21,0.2329 | |
| COC(=O)C1CC(O)C1,0.2447 | |
| CC1CC2C(C1O)N2C,0.2804 | |
| CC(=N)OC(=O)C1CC1,0.2414 | |
| O=C1NC=CC2NC12,0.2067 | |
| CCOCCC(O)C#C,0.2819 | |
| CN1N=NC=C1C1CO1,0.2392 | |
| CC1CCCC2CC12O,0.3217 | |
| C1NC11C2C3OC2C13,0.3068 | |
| CCC1CC2OC2CO1,0.3382 | |
| O=CC1CN2C3CC1C23,0.2153 | |
| COC1C(=O)NC=C1C,0.2014 | |
| COC12C3C1N1C3C21C,0.2636 | |
| CC12CN3C4C3C1OC24,0.3027 | |
| CCOC1=NC2CC2N1,0.2706 | |
| CC(C=O)C1CCOC1,0.225 | |
| COC(C)(CO)C(N)=O,0.2639 | |
| CC1CC11COC2CC12,0.311 | |
| O=CC12OC1CNC2=O,0.196 | |
| COC1COC2CC1C2,0.3219 | |
| CCOC1OCC=C1C,0.2611 | |
| c1ncnc(n1)N=CN,0.1981 | |
| CC1CC(C=O)=CC1C,0.1933 | |
| COC1CCC1=O,0.2009 | |
| CC1CC2CC2OC1=O,0.2702 | |
| C1COCCC=C1,0.2529 | |
| CC([NH2+]CCO)C([O-])=O,0.2634 | |
| CCOc1cnn(c1)C,0.2284 | |
| CC1C2C(O)C2C1C#N,0.2942 | |
| CC1(C)OC(=O)NC1=N,0.2688 | |
| CC(CO)C1OCC1C,0.3086 | |
| O=C1CC2CC1C=C2,0.2052 | |
| C1C(=NO)CN1CC=O,0.2058 | |
| C1Cc2c(nnn2C1)O,0.2251 | |
| CC1C2C3CC(O3)C12O,0.315 | |
| CCC(C)C(=O)N1CC1,0.2484 | |
| CCC(C)COC(N)=O,0.323 | |
| OC1C2OCOC(=O)C12,0.2515 | |
| N#CCC1CC2COC12,0.2976 | |
| CC(=O)C12CCC1CO2,0.2115 | |
| C#Cc1nc(on1)C#N,0.1971 | |
| CC1CC2C3OC3C12O,0.3118 | |
| CC1OC1(C#N)C1CN1,0.2578 | |
| O=C1CC2C(C#C)C12,0.2277 | |
| COC1C(C)CC11CC1,0.3164 | |
| CNC12CC1(OC2)C#N,0.2314 | |
| N=COC12CC(C1)C=C2,0.2374 | |
| CCN1C2C=CC1C2=O,0.2376 | |
| CN(C)C(=O)NCC#C,0.2706 | |
| CC1CCC(=N)NC1=O,0.2447 | |
| CC1CC(=O)COC1=N,0.2193 | |
| C1C2C1C13CCC21CO3,0.2823 | |
| OCC1=CCOC(=N)C1,0.257 | |
| CC(N)C(=O)OCCO,0.2558 | |
| NC1=CC(=N)NC(F)=N1,0.1867 | |
| Cc1c(cncn1)CO,0.2139 | |
| CC(N)C(=O)NC(N)=O,0.2297 | |
| CC1CC=CC1=NO,0.1933 | |
| CCC1C(C)C1CC#C,0.3123 | |
| CC1C2CN1C2C(N)=O,0.2437 | |
| CC12CC1CC1CCC21,0.3296 | |
| OC(C#N)C1OCCO1,0.2898 | |
| CC12C3OC1COC23,0.2882 | |
| OC12COC3CC1C2O3,0.2914 | |
| O=C1CC2C3OCC1C23,0.2169 | |
| CNC(=[NH2+])[C-](C#C)C#N,0.1889 | |
| C#CC1CC2CC3C2C13,0.3048 | |
| CC1C2CC3(CC3)CN12,0.3036 | |
| c1c(cncn1)N(=O)=O,0.1724 | |
| Cn1ccc(c1CO)O,0.2206 | |
| OC1CCC(NC1)C#N,0.2637 | |
| C#CC#Cc1ccno1,0.1735 | |
| O=C1C=CC2OC12C#N,0.1748 | |
| C1CC23NC2CC2C3N12,0.311 | |
| CC(=O)N1C=COC1=N,0.1961 | |
| CC1CC1C1(O)CC1,0.3141 | |
| N=C1C=CC=NOC1=O,0.1756 | |
| CCC12CC1OC2C=O,0.2097 | |
| CCCCOC1(CC1)C,0.3318 | |
| OCC12CC1N1CC21,0.2862 | |
| CC1C=CCOCC1=O,0.217 | |
| CC(O)COC=O,0.2851 | |
| CC12OC3CC(C1O)C23,0.3103 | |
| OC1C2OC2C1CC=O,0.2248 | |
| CC1=CNC(=N1)C1CN1,0.2327 | |
| C#CC1(OCCO1)C#C,0.267 | |
| CC(C)C1CN1C(N)=O,0.2862 | |
| Cc1c(nc(=O)on1)N,0.1862 | |
| OCC1NC11CNC1=O,0.2712 | |
| OC(C#N)C(O)C1CC1,0.3133 | |
| CC(CO)C(O)C1CC1,0.3312 | |
| CC(C)C1(CO1)C=O,0.2202 | |
| O=CC12CC1CC21CC1,0.2194 | |
| CC12CCC(O)(CC1)C2,0.3235 | |
| C1C2CCC3CCOC123,0.3095 | |
| OCC1C2CC1OCC2,0.3051 | |
| CCC(O)C#N,0.3145 | |
| C#Cc1cc(c(o1)O)N,0.1707 | |
| Cc1cc(n(n1)C=O)C,0.2112 | |
| c1cnc(=O)[nH]c1C=O,0.1415 | |
| O=C1NCC1N1CC1,0.2475 | |
| CC1(O)C2CC1C(=O)N2,0.2554 | |
| CN1C=CC(=O)C12CC2,0.1788 | |
| c1cnc(=O)ncc1N,0.166 | |
| OC(CCC=O)C#N,0.2292 | |
| COC(=N)C(CO)C#N,0.2854 | |
| N#CCCC12CC1CO2,0.2847 | |
| c1cncc2c1onn2,0.1988 | |
| C1COCC(CO1)C=O,0.2122 | |
| CNc1c([nH]cn1)O,0.2386 | |
| OC1CC=C2C3NC3C12,0.2359 | |
| O=C1CN2C1CCC2=O,0.2148 | |
| CCC1(C#N)C(C)C1C,0.3104 | |
| CC(C#CC=O)N(C)C,0.1605 | |
| Cc1nccn1C(C)C,0.247 | |
| CN1C2C3NC3C12C#C,0.2301 | |
| C#CCCCC#N,0.2953 | |
| CC1CCC(=O)C(=N)N1,0.1725 | |
| c1c(nc(o1)C=O)CO,0.1817 | |
| CC1CCOC(C)O1,0.3484 | |
| CC12CN=C3NC1C23O,0.1614 | |
| CC12C3CC(C13)C2CO,0.3032 | |
| CC1OCC1(O)C1CO1,0.3085 | |
| CC(C)C1CCC=CC1,0.2682 | |
| C1C2NC3=C(NC=C3)C12,0.2113 | |
| CC1(O)CN2N=CC=C12,0.263 | |
| C1N2CCC12C1CCO1,0.3128 | |
| CC1=C(N)N=NNC1=O,0.1694 | |
| OCCC(NC=O)C#N,0.2751 | |
| CC1C2C3C4COC13C24,0.3141 | |
| CC(C#N)C1=NCCO1,0.2625 | |
| CCC1CN=C(CC)O1,0.2693 | |
| CC12CC(C1)C21CC1,0.3563 | |
| CCC1CC(C)NC1=O,0.2706 | |
| OCC12CC3N1C2C3=O,0.234 | |
| OC1C2N=COCC12O,0.2404 | |
| CC1(CC=CC1=O)C,0.1906 | |
| c1c(oc(n1)O)CCO,0.2418 | |
| [NH3+]C1CN2N=CC([O-])=C12,0.231 | |
| C(C(=O)C#CC#N)O,0.1859 | |
| CC12CCC1=CCCC2,0.2567 | |
| C#CC#CCOC1CC1,0.2221 | |
| OC1CC11C2C3C1CN23,0.3055 | |
| CC1CCOC(=N)OC1,0.2811 | |
| CCN(C)C(C=O)C#C,0.1943 | |
| c1cn(nn1)C2CCC2,0.2566 | |
| OCCC12CC1CC=C2,0.2478 | |
| CN1N=NC(F)=CC1=O,0.1832 | |
| OC(C=O)C(=O)C1CC1,0.2006 | |
| CCC1(O)CC2C(C)C12,0.316 | |
| N#CC12CC3C1N3CC2,0.2827 | |
| CC1CCC1(O)C1CC1,0.3174 | |
| CC1(C)C(C=O)C2CN12,0.2086 | |
| CN=C1OC2(CC2)C1C,0.2699 | |
| CC1CNC2=C1C=NN2,0.2309 | |
| CC1NC11C(C)CC1O,0.3054 | |
| CC1OC2C3NC3C2O1,0.3063 | |
| OC12C3CC(OC1=O)C23,0.2572 | |
| OC1C2C3CCC1C23,0.3171 | |
| CC1=NCCN1C(=O)N,0.2407 | |
| N#CC1CC2NC2C1,0.2924 | |
| OCC1COC1=N,0.282 | |
| N=C1OCC2(CC12)C#N,0.265 | |
| C#CC1COCC11CC1,0.2942 | |
| CC1OC(CC1O)C#C,0.2824 | |
| O=C1CCC2C3CC1N23,0.2144 | |
| CC#CC1(CC1)CC=O,0.213 | |
| CC1CC2CNC(=O)C12,0.2657 | |
| Cc1cc(oc1N)CO,0.2104 | |
| CC1OC(=O)C(N)C=C1,0.2379 | |
| CC12C3C4COC1C4N23,0.3233 | |
| CC1=CC(=O)OCCN1,0.2107 | |
| NC12CC3C1OC23C#N,0.2368 | |
| N#CC1NC2COC12,0.2653 | |
| CN1C2C3CC3(C)C12,0.3184 | |
| CC1CC2(CO)CCC12,0.3285 | |
| CNC(=O)CC(O)CO,0.2716 | |
| O=C(C#N)C1OC1C#N,0.1987 | |
| COC1C(C)C1CO,0.3156 | |
| CN1C(=N)CCC1=O,0.2506 | |
| C1C=CCC1=NO,0.2457 | |
| CCC(O)C(O)CO,0.3207 | |
| OC1(CN2CC12)C1CO1,0.2895 | |
| c1(=O)c(noc(n1)O)F,0.1988 | |
| CNc1cnc(o1)N,0.2307 | |
| NC1=NNC(=C1)C1CO1,0.2193 | |
| CC12CC1C1C(O)C21O,0.2728 | |
| CN(C)c1cc(no1)O,0.2288 | |
| CC(C#N)C(N)CC#N,0.2768 | |
| CCC#CC1(CC1)C,0.2838 | |
| c1cc(n(c1)C=O)O,0.1775 | |
| OCC1OC2C1CC2=O,0.1999 | |
| COCC(=N)OC(C)C,0.276 | |
| CC#CCC1(C)CO1,0.2991 | |
| CCOC12CCC1CC2,0.319 | |
| NC1CC(=N)OC1=O,0.2406 | |
| OC12C3CCCC1OC23,0.2891 | |
| OC12CC3OC(=N)C1C23,0.2735 | |
| CC1(C)OC2CC1(O)C2,0.3029 | |
| CCc1cc(n[nH]1)N,0.2315 | |
| Cc1nc(no1)O,0.2448 | |
| OCCC12OC3C1NC23,0.2961 | |
| OCC12OC1CC=C2,0.2485 | |
| CC1C2CC(C2O)C1=O,0.2224 | |
| COC1COC1=O,0.252 | |
| CCC(=O)C1OCC=C1,0.2054 | |
| COc1c(c(on1)N)N,0.2377 | |
| O=C(C#C)C1(CN1)C#N,0.1963 | |
| C1CC23CC=CC2(C1)O3,0.2431 | |
| c1c(nc(o1)NC=O)O,0.1908 | |
| CC1OC1C1C2CCN12,0.3105 | |
| CC1CC2=C(ON=C2)O1,0.2256 | |
| CC1=CC2C(O)CN2C1,0.239 | |
| COCCC1(CO1)C#C,0.2751 | |
| OCC(CO)C(O)C#N,0.2798 | |
| O=CC1CC2=CCCC12,0.2045 | |
| CCOC(C#N)C(N)=O,0.2723 | |
| CC12C3CN1CC2C3=O,0.2031 | |
| CC(C#C)C1(C)CCO1,0.2913 | |
| c1c(c([nH]c1O)CO)O,0.2243 | |
| CC12C3C4C3N1C2C4O,0.3002 | |
| CCC(OCC#N)C#N,0.304 | |
| CC1COC2C3CC1C23,0.305 | |
| CN1CC1(CO)CC#N,0.2669 | |
| O=C1OC2(CC2)C2CN12,0.2764 | |
| Cc1cc(=O)[nH]cc1C,0.1774 | |
| CC1C(CO)CC1C=O,0.222 | |
| CCNC1(COC1)C#N,0.2674 | |
| CC12CC(C)(O1)C21CN1,0.3029 | |
| COC1(CC1)C2(CC2)O,0.306 | |
| N#CCC1(CCN1)C#N,0.26 | |
| COC1C(O)C2CC12O,0.3193 | |
| CC1(NCC1C#N)C=O,0.2014 | |
| NC1=NCC(O1)C#C,0.2486 | |
| CC(O)C1CC1NC=O,0.2762 | |
| c1c(oc(=O)n1C=O)N,0.1851 | |
| CC(=O)C(O)C#C,0.2257 | |
| C(=O)C(=O)NC(=O)N,0.1711 | |
| CC1CC2CCCC1O2,0.3117 | |
| CC1NC1(C#C)C1CC1,0.2829 | |
| CC(=O)Oc1c[nH]cn1,0.2422 | |
| FC1=CC(=N)OC=N1,0.1804 | |
| COC1(CC1C=O)C=O,0.2074 | |
| CCC1(CC)C(C)C1O,0.2967 | |
| CCOC1C2OCC12O,0.2915 | |
| COC(C)(C#C)C(N)=O,0.259 | |
| CC12CCC1N=COC2,0.2627 | |
| CC1(C)CC=CCC1O,0.2676 | |
| CC1(C#C)C(O)C1C=O,0.2135 | |
| NC(=O)C1OC2CCC12,0.2509 | |
| CC12COC1C1(CC1)O2,0.2913 | |
| CC1CNC2=NC=NN12,0.2467 | |
| O=CC1COCC2OC12,0.2203 | |
| O=C1NCC2(CO2)C1=O,0.1613 | |
| CCCNC(=O)NC=N,0.2404 | |
| N=COC12CC(C1)C2=O,0.2438 | |
| c1c2c([nH]n1)CCN2,0.2124 | |
| CC(C)(C)CC(C)(C)O,0.3194 | |
| CC12CC(CC1=O)C2O,0.2281 | |
| Cc1c[nH]nc1C(=O)C,0.2047 | |
| OCC1(COC=N1)C#N,0.2613 | |
| COCCN1C2CCC12,0.3219 | |
| Cc1cc(n(c1C)C)O,0.235 | |
| C(C#CC1CC1)C1CN1,0.2792 | |
| COC(C#N)C1NC1C,0.2809 | |
| N#CC#CC1CO1,0.2274 | |
| CC1(COC1=O)C1CO1,0.2745 | |
| CC(CC(N)=O)C(C)=O,0.2318 | |
| CC1COC1(C)C1CO1,0.3213 | |
| CC(O)C(C)CCC#N,0.3149 | |
| OC12CCC1C2(O)C#N,0.279 | |
| OC1C2C3NC3C12C=O,0.2079 | |
| CC1(C)C2NC2C2CN12,0.2918 | |
| c1c(cn[nH]1)N,0.2257 | |
| Cc1c2c(n[nH]1)ocn2,0.2119 | |
| CC12CC=C3C4C(C13)N24,0.1618 | |
| CC(C#C)N1CC1C#N,0.2697 | |
| CC1CC(O)CCCO1,0.3203 | |
| CC(C)C(CC#C)C=O,0.2247 | |
| C#CC1(CCCCC1)O,0.2959 | |
| COCC1C2OC2C1C,0.331 | |
| COC1CCCC1O,0.3103 | |
| CC1(C#C)C2CC=CC12,0.2304 | |
| CC1OC1(C)CCCO,0.3344 | |
| NC(=O)C1(CC#C)CN1,0.2638 | |
| CC1C=C(C)NC1=O,0.2153 | |
| CC(O)CCOC(C)=N,0.2929 | |
| COCCNCCC#N,0.2746 | |
| CC1CNC(=N)N1C=O,0.2358 | |
| CC(COC=N)OC=N,0.2746 | |
| [O-]C(=O)C1CCNC=[NH+]1,0.2463 | |
| C#CC(=O)CCCCO,0.2083 | |
| c1c(c(no1)C=O)N,0.1552 | |
| CNc1nc(no1)C=O,0.1769 | |
| COC(C)C(C)=NO,0.2567 | |
| C1OCC11C2C3C1CN23,0.316 | |
| COC1(C)CC=C(C)C1,0.2602 | |
| Cc1coc2c1ocn2,0.2007 | |
| CC12NC1C(C#C)C2=O,0.209 | |
| CC12CNC(=O)CC1N2,0.2683 | |
| CCC1C2COC12,0.3111 | |
| C#CCN(C=O)C(=O)N,0.2493 | |
| CC1COC(OC1)C=O,0.2247 | |
| CC12COC3C1N2C3=N,0.242 | |
| CC1OCC11CCOC1,0.3131 | |
| CC1CC2C3CC3OC12,0.3034 | |
| COCC#CC1OC1C,0.2678 | |
| C1COc2c1[nH]nc2N,0.2177 | |
| CC12CCC1(O2)C1CN1,0.3149 | |
| CC1CCOC1(C)C#N,0.2956 | |
| CCc1cc(oc1)C#C,0.1952 | |
| CC#CC12CC(C1)C2=O,0.2399 | |
| CC(=N)OC1CC1C=O,0.2264 | |
| N=CN1CC(=O)NC1=O,0.2378 | |
| OCC1=NC2CCC2O1,0.2675 | |
| O=CC1NC1C1CN1,0.2155 | |
| CCC(O)CC(C)(C)O,0.3085 | |
| CC1(CC1)COC=NC,0.2733 | |
| CC1CC2OC3C2C13,0.3085 | |
| O=C1NC2C3OC12C=C3,0.2125 | |
| CC(=O)C1C2CCC12,0.2206 | |
| O=CC12OC1CN1CC21,0.1899 | |
| Cc1nc(nn1C)CO,0.2523 | |
| CCCC1(CC)CC1O,0.3251 | |
| CCCC1CCC(C)O1,0.3313 | |
| COC(=N)N1CC(=O)C1,0.199 | |
| CC1CC2(C)COC1C2,0.3144 | |
| CCC1(CC1)CC#CC,0.3003 | |
| CC1OCC11CN1,0.31 | |
| C1OC1C1=CN=CC=N1,0.1969 | |
| OC1C2CCC(O)C12,0.3051 | |
| COCC1OCCC1C,0.32 | |
| CC(C([O-])=O)C(C)(C)[NH3+],0.2765 | |
| CC12CC1C1COC1=N2,0.2444 | |
| N=C1OCC2C3CC2C13,0.2768 | |
| N=C1C=CN=CN=C1,0.1632 | |
| Cc1c(n[nH]n1)OC,0.2321 | |
| CC1NC11CC2COC12,0.2962 | |
| N#CC1C2CC1CC2,0.3307 | |
| CC1(C)CC(C)(O1)C#N,0.2869 | |
| C1CNCC(=O)CC1=O,0.196 | |
| O=CC1CC(CN1)C#N,0.2005 | |
| CC1CCCC(O)CC1,0.3346 | |
| c1c(c([nH]n1)C2CC2)N,0.2196 | |
| CC1CC2NC(=O)OC12,0.3072 | |
| CC1(C)C2C3CC1OC23,0.3168 | |
| CC12CN1CC21CO1,0.3131 | |
| CC(OC=O)(C#C)C#N,0.2631 | |
| CC1N(CC1(C)O)C=O,0.2642 | |
| CCC(C=O)C#CC,0.2163 | |
| c1c(c(no1)CO)N,0.2077 | |
| C1CC2C1N1N=NC=C21,0.255 | |
| COC1=NCC(C)N1,0.2774 | |
| COCC(C#N)(C#N)O,0.2761 | |
| CC1(CCC=C1CO)C,0.2597 | |
| CC1CC23CC4N2CC134,0.2538 | |
| CN=C1OCC11CN1,0.2629 | |
| C(C=O)c1c(nno1)N,0.1641 | |
| O=C1C2OC2C1C1CC1,0.2078 | |
| COC1=NOC(=N)C=N1,0.1565 | |
| OC1CC1C1(CC1)C#C,0.2629 | |
| CC(O)C1C2CC1(C)O2,0.2983 | |
| C1C(CO1)C#CC#N,0.224 | |
| CCC1OCC1CC#N,0.287 | |
| C1C2CC3CC3OC12,0.3325 | |
| CC1=C2C3CC3N2C=N1,0.2259 | |
| O=C1CN=CNC1C#C,0.1999 | |
| CC1(CCCC1=NO)C,0.2516 | |
| CC1(CN1)C1(O)COC1,0.3089 | |
| CC(=O)OC1CNC1=O,0.2597 | |
| CC#CC1(CN1)C#CC,0.2499 | |
| N=C1OC(C=O)=NC=C1,0.1475 | |
| CCCC1CCCOC1,0.3277 | |
| CC(=O)c1cnccn1,0.1665 | |
| OC12CC(CC#C)(C1)C2,0.3101 | |
| CCC(=NO)CC1CC1,0.2539 | |
| CC1C2COCOCC12,0.3268 | |
| CCC1CCOCC=C1,0.251 | |
| CC12CC1CC2(O)C#N,0.2848 | |
| CC(CC=O)C#CC=O,0.1969 | |
| CCC#CC(C)C(C)O,0.292 | |
| CC(=O)COC(=N)C#C,0.2191 | |
| CC(O)(C#C)C#N,0.2864 | |
| C1OC2C3C4C1C4C23,0.291 | |
| CC12OC1CC21CCO1,0.3102 | |
| C1COCCC(=C1)C#N,0.2099 | |
| C(=O)(C(=N)NC(=O)N)N,0.2033 | |
| CC(=O)C1CC(C1)=NO,0.2249 | |
| CC1N2CC1(O)C2CO,0.311 | |
| OCCN1C2C3NC3C12,0.2644 | |
| CCc1cn(nn1)CC,0.2486 | |
| Cc1cn(c(n1)C=O)C,0.1771 | |
| NC12CCC1(NC2)C#N,0.2501 | |
| O=C1C2OCC2C11CN1,0.1927 | |
| C1C2OCC12N1CCC1,0.2775 | |
| CC1(C=CCC1O)C#N,0.2601 | |
| C1C2C3OC4C2N1C34,0.2893 | |
| CC12CC3CC4C(C13)N24,0.2999 | |
| COCC1NC1(C)C,0.3185 | |
| C#CC12CC3(CC3)C1N2,0.2719 | |
| OC12COC1C2N1CC1,0.2798 | |
| C#CC1C2CC1C2C#C,0.2907 | |
| OC1CC2CCCC12O,0.2953 | |
| NC1=C(C=O)C2CN2C1,0.1734 | |
| CC(C)c1ccncn1,0.2137 | |
| C#CC(=NO)CCC=O,0.2088 | |
| Cc1cc(oc1NC)N,0.2187 | |
| O=C(C#C)C(C#C)C#N,0.1952 | |
| CC(C#N)C(=O)CC#C,0.2191 | |
| Cc1ccc(o1)N,0.2186 | |
| OC12CC1N=C1OCC21,0.2399 | |
| CC1C(CO)C1CO,0.3164 | |
| OC1=NC(=N)C=NC=N1,0.1626 | |
| C#CC1NC11CN2CC12,0.2563 | |
| OC12CC1(CC=O)OC2,0.2122 | |
| CN1C(=O)CC=C1C#C,0.1774 | |
| CC1(C)CC11C2CC1O2,0.3077 | |
| CC12N3CC1(C3)CC2=O,0.1871 | |
| CCC1C(C)CCC1C,0.3585 | |
| CC1OCOC(C)C1=O,0.2026 | |
| CC(C)(C1CCC1)O,0.3246 | |
| CC1N=C(C)OC1=O,0.2472 | |
| CC1(C)CC2OCC2=C1,0.2423 | |
| CCC(C)(O)C1(C)CC1,0.3237 | |
| CC12CCC(C1)CC=C2,0.2615 | |
| OC12C3CC1C(=O)C23O,0.2344 | |
| CCC(C)(COC)C=O,0.224 | |
| C#CC1=NC2CC2O1,0.2096 | |
| CC1OCC(O)C2CC12,0.3167 | |
| O=C1NC(C=C1)C1CC1,0.2147 | |
| c1c(coc1C#N)C=O,0.1935 | |
| COCC1=NCC(C)O1,0.2617 | |
| C1C(CO1)OCCO,0.3178 | |
| Cc1cnc(nc1)OC,0.2048 | |
| CN=C(C(=O)N(C)C)N,0.2134 | |
| CC1(C=O)C2CCC12O,0.2274 | |
| CC1CCC(O)(CO)C1,0.3188 | |
| CN=C1OC(C)(C)C1N,0.2646 | |
| O=C1CC2CC3C(O2)C13,0.2234 | |
| CC12CNC1C2C#N,0.2669 | |
| CC(O)CCC1CC1,0.3311 | |
| C1CC2=C(C1)C1OC1C2,0.2362 | |
| CC1C2CC(O2)C2CN12,0.2958 | |
| O=C1COC2C3OC2C13,0.2129 | |
| CC12OC(C=C1)C1OC21,0.2428 | |
| O=C1OC2CCC(=O)C12,0.2154 | |
| C(C(CO)(CO)CO)O,0.3095 | |
| C1C2C1C1N=COCC21,0.2613 | |
| C#CC#Cc1ccc[nH]1,0.1688 | |
| OCC12CN1CCC=C2,0.2353 | |
| COCC1C=CNC1=O,0.2144 | |
| CC1CCOC1CO,0.3238 | |
| CC1OCC11OCC=C1,0.2418 | |
| CCc1nc(c(o1)N)N,0.2074 | |
| CC1C2C3C(O)C1CN23,0.3007 | |
| C1OCC23COCC12N3,0.3256 | |
| CC1CC2(C)C3CC3C12,0.3107 | |
| CC1C2C(=O)CCC12O,0.2222 | |
| CCOc1c[nH]cc1C,0.2424 | |
| C1C2CC3C1C21COC31,0.3151 | |
| CC1(C)COCC11CN1,0.3089 | |
| CC12OC(C=C1)C2(C)O,0.2338 | |
| C1C(CO1)OCCC=O,0.2233 | |
| N#CC1CC2(CC2)C=C1,0.2448 | |
| C1CC23COCC2OC13,0.3084 | |
| OCC12CC1C(=N)OC2,0.2772 | |
| O=C1CC2NC11CNC21,0.2205 | |
| CCC12CC(O1)C21CN1,0.3062 | |
| CCC(C)C1NC1CO,0.3181 | |
| c1conc1NC=N,0.2198 | |
| C1C2CC3OCC2C1O3,0.321 | |
| CN1CC(C1)(C=O)OC,0.1805 | |
| OC12CC1C1OC21C#N,0.2444 | |
| Cc1c([nH]nn1)N2CC2,0.2267 | |
| C1C2OC3CCCC3C12,0.3097 | |
| CC1N2CC(C)C12C#N,0.2502 | |
| c1c(coc1N2CC2)N,0.2162 | |
| CC1C2C3COC2C13,0.3336 | |
| N#CC1CCCN=CO1,0.2546 | |
| CC1C=CCC11CC1O,0.2635 | |
| CCC#CC(=O)CO,0.2097 | |
| C[NH2+]CC(=O)[CH-]C=O,0.1928 | |
| CC1(C)C2CNC(=O)N12,0.2825 | |
| CC1OC(N)=NC11CC1,0.2635 | |
| CN1CC1C1COCO1,0.3071 | |
| CC1CC2=C(O1)N=CO2,0.2042 | |
| CCc1ccnc(c1)C,0.2286 | |
| C1C2CC11CCOC1O2,0.3315 | |
| N#CC1C2OC2C11CN1,0.2763 | |
| C1C(=CC(=O)N1)CO,0.2177 | |
| O=CNC12CC1CC2,0.2672 | |
| OC1CC=CC1O,0.2612 | |
| NC1(CC1C#C)C#N,0.2674 | |
| C1COC2OC(C1)C=C2,0.247 | |
| CC1(CCOCC1)C,0.318 | |
| Cn1c(c(nc1N)O)O,0.2156 | |
| CC([NH3+])C(=O)[N-]CC#N,0.2729 | |
| COC12CC1(O)CC2O,0.3016 | |
| c1c(c(cn1C=O)O)N,0.1787 | |
| CC12CC=CC1C(=N)O2,0.257 | |
| CC1=C(OC=N)N=CN1,0.2237 | |
| CCC1OC2CC12OC,0.3073 | |
| COC1C(CO)C1(C)O,0.3048 | |
| CC1C2C3C4NC4C2N13,0.2827 | |
| Cc1conc1NC=O,0.2314 | |
| C#CCC1(CCCC1)O,0.2987 | |
| CCOc1c(c[nH]n1)C,0.244 | |
| C#CC1(CC1)C(=O)CO,0.2319 | |
| CC1CC1C1CC1C#C,0.2866 | |
| CC1CCC2CCC2C1,0.3515 | |
| CC1OC(=O)CC11CC1,0.2775 | |
| CC12C3CC11COC2C31,0.3281 | |
| CCCC1=NC(C)CO1,0.272 | |
| O=C1C2CNC(=O)C1O2,0.2091 | |
| Cn1c(c([nH]c1=O)O)O,0.2144 | |
| CC1=NC23CC2(CC3)O1,0.2344 | |
| Cn1nc(nn1)N=CN,0.2128 | |
| CC(=O)C1C=CC2NC12,0.2262 | |
| C#CCC12CC1CO2,0.2828 | |
| CCn1c(c(nn1)C)C,0.2409 | |
| CC1C2COC3C2C13C,0.3105 | |
| CC(=O)C1=CNC2CC12,0.1736 | |
| CCC1=C(CNC1=O)N,0.2147 | |
| CC12C3CC1C3NC2=O,0.2516 | |
| CCC12OC1(C)CC=C2,0.247 | |
| CC(O)C12CC(O1)C2C,0.3177 | |
| CC(C)C1(CC1)C2CC2,0.3375 | |
| O=C1C=CC2CCC1O2,0.1753 | |
| CCC1C(C)C(O)C1C,0.3056 | |
| CCC1CC11CCC1,0.3444 | |
| C1C2CC3OC2OC13,0.348 | |
| CC(O)(C#N)C(O)C#C,0.2792 | |
| OCCC1OC11COC1,0.322 | |
| COC=NCC(=O)N,0.2506 | |
| C1C2OC2C2=C1OC=C2,0.226 | |
| CCCC(=NO)COC,0.2584 | |
| CC#CC(C)CC(N)=O,0.2664 | |
| CCC1(NC1(C)C)C#C,0.2704 | |
| c1coc2c1OCCO2,0.2157 | |
| OCC12CCC1C1NC21,0.2901 | |
| COCC12CCN1C2C,0.3066 | |
| CCCc1nc(on1)N,0.2509 | |
| CC#CC1NC1C1CO1,0.2744 | |
| CCC(CC#C)OC=O,0.282 | |
| CC1(C=O)C2C3OC3C12,0.2183 | |
| CCC1CC=C(C)C1O,0.2597 | |
| CCC12OC1C1(O)CC21,0.2921 | |
| CCC1=CCOC1CO,0.2462 | |
| CC12CCCC1N1CC21,0.3038 | |
| Cn1cc(c(n1)C#C)N,0.1962 | |
| CC1=CN=CC(=N)N=C1,0.1677 | |
| C1CC1C1(CC1)C1CO1,0.3449 | |
| CCN1C=CCNC1=O,0.2167 | |
| CC1C2C(C)CC12C#N,0.2843 | |
| CC1CCC11OCC1O,0.2962 | |
| O=CNCC1C2CCN12,0.2559 | |
| c1c(c([nH]c1N)N)C=O,0.1726 | |
| CCC1(C)CCC(=O)C1,0.2222 | |
| CCC1C(C)OC11CC1,0.3006 | |
| C1C2CCC=CCOC12,0.2428 | |
| CC1CNC(C)(C1)C#N,0.2745 | |
| CCCC(=O)OCCO,0.2843 | |
| COC1C2NC1C1NC21,0.3005 | |
| Cc1c(c(co1)N)OC,0.2236 | |
| COC(C)C1CC(=O)O1,0.2795 | |
| CC1C2OC3COC2C13,0.3116 | |
| ON=C1CCC2OC12,0.244 | |
| CC1C2C3OC3C(C)N12,0.2834 | |
| CC(=O)C(=O)OC1CC1,0.1817 | |
| CC1C2C3OC4C1C2C34,0.2861 | |
| C1CC=CC(=O)CC=C1,0.2153 | |
| CC(C)C#CC1(CC1)O,0.2703 | |
| CC12CC1C(=O)OC2=N,0.2506 | |
| Cc1c(ocn1)N(C)C,0.2399 | |
| CN=C1OC2C(O)C12O,0.2525 | |
| CC#CC1CC(=O)C1C,0.2183 | |
| C#CC1CC2CC=CC12,0.2575 | |
| C1CC(=O)CCC1C#N,0.2235 | |
| NC(=O)C(=O)C1CC1O,0.1764 | |
| C1OC2C3C4C(O1)C2N34,0.3291 | |
| [O-]C(=O)C[NH+]1CCCC1,0.2644 | |
| CC(C)C1COC=N1,0.2693 | |
| CC1CC(C)C2CC12,0.3465 | |
| O=CC1CC2CCC2O1,0.2155 | |
| OC1CC2CC1(C2)C#C,0.3007 | |
| ON=C1CC(O)C1C#N,0.2436 | |
| NC1=CC(=NO)C2CC12,0.1823 | |
| OCCC1CC=CC1O,0.2622 | |
| C1C2OC11CCCOC21,0.3086 | |
| CC1OCC2CC1(C)C2,0.3258 | |
| C1CC1(CO)C#CC#N,0.2262 | |
| CCC1NC1(C)COC,0.3137 | |
| C1C23CCCOC12CO3,0.2944 | |
| CCOCc1cnon1,0.2318 | |
| CCN(CC(C)O)C=O,0.2695 | |
| NC(=O)C1=CCC2CC12,0.2122 | |
| CC1C2C3N2CCC13C,0.311 | |
| CN1C=NC(C#C)C1=N,0.222 | |
| CC1CC2C(C#N)C12O,0.2943 | |
| CCC1CC1C(O)C=O,0.2273 | |
| C1C=CC(=O)C(=O)C=C1,0.1534 | |
| CN1CC(O)C1C(C)=O,0.2099 | |
| CC(O)C(=O)C(C)=O,0.1589 | |
| CC(C)C12CC1CO2,0.313 | |
| CC1(CC1)C(O)CCO,0.3263 | |
| C#CC12CC3OC3C1N2,0.27 | |
| N#CCC12CN1CCC2,0.2803 | |
| CC1(CCC=CC1)C#N,0.2679 | |
| CC(C)C(C)(C)O,0.3273 | |
| COC(=O)C1CCO1,0.2439 | |
| COC1(CO)CC1C#C,0.2802 | |
| CC1(C)CC1CCO,0.3393 | |
| C1C2CC=C3CCC3C12,0.2526 | |
| CCC1CC(C#C)C1=O,0.2121 | |
| N=C1CC2(CC2O1)C#N,0.275 | |
| CC1CC11CN2CC12,0.3055 | |
| CCC1=CCC(C1)(C)C,0.2585 | |
| CC12CN3C4C(CC14)C23,0.2963 | |
| O=C1C=CC2C=CCC12,0.1904 | |
| Cc1nc(=O)nco1,0.2127 | |
| COC1CC(O)(CO)C1,0.3021 | |
| CC1C2OC3C2OC13,0.3045 | |
| CC#CC1(C)CC1CO,0.2852 | |
| CCCC(O)C(C)C#N,0.3171 | |
| OCC1CCC1OC=N,0.282 | |
| CCC(O)COCC=O,0.2161 | |
| CC12C3C4C3C1=CCC24,0.1618 | |
| C#CCN1CC1,0.2771 | |
| CC1=C(N)OC(=N)N=C1,0.1647 | |
| OC(C#N)C1CCC=C1,0.2551 | |
| CC1CCC(C)(O1)C#C,0.2972 | |
| CC(C=O)C(=O)C1CN1,0.2006 | |
| NC1=CC(=O)C2CC1C2,0.1973 | |
| C#CCCC(=O)NC=O,0.2195 | |
| CC1C2(C)COCC12O,0.3157 | |
| C1C2C3CC=C4C1N2C34,0.188 | |
| CCC(C)C1OCC1O,0.3039 | |
| CN1CC1C#CCO,0.2482 | |
| N#CC1OCC2CC1C2,0.2959 | |
| C#CC1C2C3C4C3N1C24,0.257 | |
| O=CC#CC12CC(C1)C2,0.2017 | |
| CC#CCC1(CN1)C=O,0.2209 | |
| N#CC#CC#CC1CN1,0.1748 | |
| CCN=C1CC=CCO1,0.2526 | |
| CC(C)(O)C(O)C=O,0.2307 | |
| CC12OC3C4C3C1CC24,0.3315 | |
| CCC1(COC=N1)C#N,0.2683 | |
| O=C1CC23CCCC12O3,0.2226 | |
| C1C2OC3=NCCN3C12,0.2614 | |
| CC1C2C3C1C(=O)CN23,0.2175 | |
| OC1CCC=C1C#N,0.2231 | |
| OC12COC1=NC1CC21,0.2363 | |
| OC12CC3C1CC23,0.3347 | |
| NC1=CC=NNC1=N,0.1675 | |
| C1C(CO1)NCCC#N,0.2748 | |
| CCOC(CC=O)C=O,0.2032 | |
| CC1(CC(=O)C1)C,0.2215 | |
| CCC1OC1CC#CC,0.3018 | |
| O=CC12COC1C1CN21,0.2021 | |
| O=CC12C3CC=C1CN23,0.1746 | |
| CC1(C)C2OC2C1(C)O,0.3121 | |
| OCC1CC2CCOC12,0.3191 | |
| CC1N2C3C=CC2C13O,0.2183 | |
| O=CCN1CC1CC#N,0.2239 | |
| C1C2CC11CC3OC2C13,0.2997 | |
| CC1C2C3C1NC23C#N,0.2442 | |
| CCC1NC2C1OC2=O,0.2427 | |
| CCC1CC(O)C(=O)O1,0.2744 | |
| CC1CC11COC(C)C1,0.3349 | |
| O=CCC12CNC1CO2,0.2042 | |
| OCC(O)C1NCC1=O,0.215 | |
| CC(=O)C1(C)CC1C=O,0.2055 | |
| CC12C3CC(O)C1OC23,0.2863 | |
| N=C1C=CNN=NC1=O,0.1568 | |
| OC1CC2N3CC2(O)C13,0.306 | |
| C1C2CN1CCOC=N2,0.2077 | |
| Cc1cc(nc(n1)C)C,0.2097 | |
| CC1COCOC11CC1,0.3334 | |
| O=CC1=CC2NC2C1,0.1892 | |
| CC1C2N1C(=O)CC2=O,0.2068 | |
| CCCCC1CC1C#C,0.2907 | |
| CC(=O)C(=O)C#N,0.1501 | |
| CCCN=C(C#N)NC,0.2026 | |
| O=CN1CC2CCC=C12,0.2074 | |
| CC1(CC#C)CC(=N)O1,0.2855 | |
| CCC1(CC1OC)C#C,0.2802 | |
| C1COC2C3OC2C3C1,0.3085 | |
| OCC12CC(O1)C(=O)C2,0.2145 | |
| CC(O)CC1C2CCC12,0.3083 | |
| CC(C)C(C)C(=O)C#N,0.2058 | |
| COCC1CC2(C)CC12,0.3333 | |
| COC1C=CC2C(C)C12,0.2381 | |
| CC1C2OC3C(O)C2C13,0.2993 | |
| N#CCC1COCC=C1,0.2642 | |
| CC1(O)C2OCC2C1=O,0.2028 | |
| CC1C2C(=O)C(C)C12C,0.2252 | |
| c1coc(=O)nc1F,0.1986 | |
| CC12OCC(C=C1)C2O,0.2302 | |
| CC1CC1C1C(C)N1C,0.2861 | |
| CC1(C2(CC2)CCO1)C,0.3186 | |
| C#CC1CC2N=COC12,0.2609 | |
| COC1(CO)CCC=C1,0.2606 | |
| OC1C(=N)N2CC12C#N,0.2426 | |
| C1CC12CNC(=O)C=C2,0.2065 | |
| CC12CN1C(CO)=NC2,0.25 | |
| Cc1cccc(c1)C,0.2371 | |
| CC1OC2C1C2(O)CO,0.3006 | |
| CCC(=O)OCCO,0.2844 | |
| ON=C1C2CNC1CN2,0.231 | |
| O=C1CC2CCC1C=C2,0.2132 | |
| CN1CC2C(NC=O)C12,0.2297 | |
| O=C1C2CC1(C=C2)C#N,0.2455 | |
| OC12CCC(C1)OC2=O,0.2788 | |
| C(CO)C(CCO)C#N,0.3041 | |
| CC(C)(C)CC(O)C#C,0.2951 | |
| CCOCc1ccno1,0.2444 | |
| CC(C)n1cnnc1,0.2688 | |
| CC1(N=CNC1=O)C#C,0.2232 | |
| CC#CCCNC=O,0.2698 | |
| Cc1c[nH]c(=O)cc1N,0.1837 | |
| COC1CC1C(C)(C)C,0.3247 | |
| CC12CC=CC1=CCO2,0.1951 | |
| C1CC(=O)OCCC=C1,0.2527 | |
| COC1(C)C(C)C1C#C,0.2761 | |
| CC1C2C3C(CN3C)N12,0.268 | |
| CC1(CN(C1)C=O)CO,0.2674 | |
| CCC1(CC1C=O)C=O,0.21 | |
| NC(=O)N1CCC1CO,0.2797 | |
| CC12CC3C(C#C)C1N23,0.284 | |
| CC1(O)COC1(C)C,0.3046 | |
| CNC1(CC2OC12)C#N,0.2567 | |
| CC1C2OC1(C)C2C#N,0.2748 | |
| CC1(C)CC(C)(O)C1O,0.2999 | |
| NC(=O)CC12CC(C1)O2,0.2757 | |
| CC1OC1C#CCO,0.2656 | |
| C[NH2+]C1C(N)C1C([O-])=O,0.2608 | |
| Cc1nc([nH]n1)N,0.2555 | |
| C1C2C3CN3C3(CC3)C12,0.2928 | |
| Cc1nnc2n1cn[nH]2,0.2055 | |
| COC1C2NC(=O)C12,0.2527 | |
| CC#CC1CN1C1CC1,0.2632 | |
| OC1CC11CCC1O,0.323 | |
| COC12CC1C(C)=CC2,0.2475 | |
| OCC1C2OC3C2OC13,0.2997 | |
| CCC1(C)C2CC1O2,0.319 | |
| c1c(ncoc1=O)O,0.1941 | |
| CC1(CC2CC12O)C#C,0.2758 | |
| CCC12CC1(C)C1NC21,0.3182 | |
| CC1CC(C)=C(C1)C#N,0.2158 | |
| OCC12OCC1C1OC21,0.2929 | |
| CC1CCOCO1,0.351 | |
| CC(=O)C1CC1CO,0.2287 | |
| O=CC1(CN2CC12)C#N,0.2013 | |
| C#CCC#CC#CCO,0.2172 | |
| CC1(O)CCCC(=O)C1,0.226 | |
| C1CC1Cc2nnon2,0.2319 | |
| c1cc(n(c1)CC=O)N,0.1781 | |
| OC(C#N)C1=NON=N1,0.2386 | |
| CN1CC1C(CO)C=O,0.2107 | |
| CCc1c(nnn1C)N,0.2144 | |
| CC1=CCOC1(C)C#N,0.2522 | |
| N#CC1CCC11CO1,0.2979 | |
| OC1C2OC(=O)C(=O)C12,0.1757 | |
| CC1(C)NC1C#C,0.2793 | |
| [O-]C(=O)CC1CNC=[NH+]1,0.24 | |
| CC12CN1CC(CO)=C2,0.2316 | |
| C(CN=C(C=O)N)C#N,0.1881 | |
| N#CC1C2C1C1OCC21,0.2884 | |
| CCOCCCC1CO1,0.3403 | |
| N#CC1OC11CCOC1,0.2595 | |
| CN1C2C3OC2C3C1=O,0.2456 | |
| CC1CC2(C)OCC1O2,0.3303 | |
| CCOC1(C)CC=CC1,0.2653 | |
| N#CC12NC1C1CC2N1,0.2637 | |
| C1C(COC(=O)O1)C=O,0.2211 | |
| CC1(C)CC2(CN12)C#C,0.2544 | |
| CC1C2NC2C=C1C=O,0.1876 | |
| CCC(C)(C)C(O)C=O,0.2304 | |
| CC1NC2COC2C1=O,0.1835 | |
| NC(=[NH2+])C[C-](C#N)C#N,0.1365 | |
| C1C(CO1)(CC=O)O,0.2206 | |
| CC(O)CCCO,0.3304 | |
| C1C(CO1)(C(=O)CO)O,0.2281 | |
| O=C1COC2=NCCC12,0.2073 | |
| COCC(O)C#CC=O,0.204 | |
| CC1(CCO)COC1=N,0.2874 | |
| OCC1=NCC(N1)C#N,0.2417 | |
| CCC1CC2(C)CCC12,0.3362 | |
| OC(C=O)(C#C)C1CC1,0.2221 | |
| CCOC12CC(C1)C2O,0.3275 | |
| C1OC2C3OC3COC12,0.3097 | |
| c1c(con1)C(=O)C=O,0.156 | |
| CC1=NOC(=N)C(=N)N1,0.1983 | |
| CCNC(=N)C(=O)C#C,0.143 | |
| OC12CC1N=CNC2=O,0.2143 | |
| CC1(CC#CCO)CO1,0.2828 | |
| OC1CC2C=CCC12O,0.2534 | |
| C1C2NC2C11CC2OC12,0.3103 | |
| c1c2c([nH]n1)CC(=O)N2,0.2081 | |
| CC1C(C)N1CCC#C,0.275 | |
| OC1C2C(=N)OCC12O,0.2642 | |
| CC(=O)CCCC#N,0.2352 | |
| CC1C=CC2CC3C2C13,0.2556 | |
| N#CC1OCC2CCC12,0.2957 | |
| CC(C)(C#C)OC(=O)N,0.3009 | |
| CNC(CO)C#CC#N,0.1972 | |
| CC(C)COC(=O)CN,0.2619 | |
| CC12CCC3C1N3C2=O,0.2352 | |
| O=CC#CC12CC(C1)O2,0.1823 | |
| CC1C(C#C)C1(C)O,0.2791 | |
| CCN1CC=CC(=O)C1,0.1715 | |
| O=C1OC2CNC12C#N,0.2314 | |
| CCCC1CC(O)C1,0.3349 | |
| CC1(CCCC1)OC,0.3244 | |
| CC1C2C3N1C3(C)C2O,0.3024 | |
| CC12C3OC3C1C2C#C,0.2626 | |
| CCC(C)(OC)C1CC1,0.325 | |
| CCC#Cc1ccco1,0.1942 | |
| CCCC(C)(O)C=O,0.2257 | |
| C1C2C3CC4C(O3)C4N12,0.3056 | |
| CC1C2CC3CC1C23C,0.3306 | |
| CCC(C#C)C(C)OC,0.3064 | |
| C#CCN1CC2(C1)CO2,0.2614 | |
| c1nc2c(o1)CN=CO2,0.214 | |
| CC(C=O)(C=O)C#N,0.1967 | |
| FC(F)(F)C(=O)C1CN1,0.2116 | |
| CC1(O)CCOCOC1,0.3251 | |
| CC(=O)C1C2NC2C1O,0.2256 | |
| CC1(CO1)C1CC2CN12,0.3162 | |
| O=C1OC2COC2C1=O,0.1592 | |
| CCNC(=O)COC=O,0.2638 | |
| CC1C2C3NC3CN12,0.2812 | |
| NC(=O)C12CC1C1NC21,0.237 | |
| CC12C3CC1C3C2C#C,0.2996 | |
| CC(=O)C1CC1(O)C#N,0.2142 | |
| OCC12C(O)C1C1OC21,0.2813 | |
| c1cc([nH]c1CO)C#N,0.2025 | |
| NC12C3CC1(OC23)C#N,0.247 | |
| C#CC1OCCC2NC12,0.2815 | |
| ON=C1C2CC1C2C#N,0.2663 | |
| NC(=O)C1CC1NC=O,0.2448 | |
| C1C2C=C3CC4C2C1C34,0.1785 | |
| c1nc(nnn1)CCO,0.1611 | |
| Cc1[nH]c2c(n1)OCO2,0.2012 | |
| c1[nH]c(=O)n(n1)CC#N,0.2373 | |
| OC12C3C4C(C13)N4C2=N,0.2405 | |
| CCC(CO)C(C)C=O,0.2285 | |
| CC12C3C1C1(C)C3CN21,0.3053 | |
| CCC1(O)CCOC1,0.3024 | |
| NC(=O)C1N=CNC1=N,0.2169 | |
| CC(O)C1=CON=N1,0.2312 | |
| CC1CC2CCCC12O,0.3254 | |
| Cc1ccncc1C#C,0.2004 | |
| O=C1NC2C(O1)C2C#N,0.2831 | |
| CC1C=CC(O)C11CO1,0.2481 | |
| C#CC#CCOCC=O,0.2189 | |
| C1CCC(CC1)CC#N,0.3415 | |
| NCC(OC(N)=O)C#N,0.2692 | |
| CC1C(O)CC11COC1,0.3074 | |
| c1ccn(c1)CC=O,0.1758 | |
| C1C2OC3C4OCC12C34,0.2959 | |
| Cn1c(=O)cc(cn1)N,0.1801 | |
| N=C1CC2OC2C(=O)O1,0.2427 | |
| OC1CC=CC2CC1C2,0.2488 | |
| CC1C2C3CCC3C12C,0.3038 | |
| CCOc1cc(co1)C,0.232 | |
| CC(C)CC(C)OC=O,0.2837 | |
| OC1CCC2=COC=C12,0.2308 | |
| COC1CN=C(O1)C#C,0.2229 | |
| N#CCNC12CC(C1)C2,0.2673 | |
| N#CC1CC=CCC=C1,0.2481 | |
| O=CNC1CCC11CO1,0.2737 | |
| CCc1nc(nn1C)O,0.2391 | |
| c1c(c(on1)NC=O)N,0.2064 | |
| c1cc(=O)[nH]c(c1O)O,0.157 | |
| O=CC1CNC(=O)C1,0.2179 | |
| CC1(C)NC2(CC12)C#N,0.2441 | |
| CC12CC3C(O1)C3O2,0.3237 | |
| CC#CC1(CN1)C#C,0.2513 | |
| CC1(O)C2C3OC3C12O,0.2618 | |
| C1CC12CN(C2)C(=O)N,0.2887 | |
| CC(O)C1OC1C=O,0.2237 | |
| OCC1(OCC=C1)C#N,0.2469 | |
| CNC1(CC1N)C#N,0.2566 | |
| CCc1cc(on1)C,0.247 | |
| CCC1C2OCC12CC,0.3028 | |
| O=CCC1C2C3CC3N12,0.199 | |
| OC1C(CC1=O)OC=O,0.2162 | |
| [O-]C(=O)CC1C[NH2+]1,0.2746 | |
| C#CC12CC1(OC2)C#N,0.2288 | |
| CN1CC1C(=O)N1CC1,0.2215 | |
| CN1CC1C(F)(F)F,0.3309 | |
| C1CC1C12OC1C1NC21,0.2778 | |
| CCOC1(C)COC1=O,0.2531 | |
| c1cnoc1N2CC2,0.2256 | |
| COC1CC=CCC=C1,0.2556 | |
| C1CC11C2OC2C11CC1,0.33 | |
| CN1N=CN=C(C)C1=N,0.1596 | |
| OCC1CCC2COC12,0.3241 | |
| CCC12CC1(CO2)OC,0.3032 | |
| CC1OCC=CC(C)=C1,0.1928 | |
| CC12CCC3NC3C1O2,0.3073 | |
| COC1OC(=N)NC1=O,0.2482 | |
| c1c(onn1)C#N,0.212 | |
| CC1(C)OCC2NC12,0.311 | |
| OC12CN3C4CC(C14)C23,0.2833 | |
| COC12CCN3C1CC23,0.3129 | |
| CCC1COC(C)C1=O,0.2138 | |
| OC12C3OC(C13)C21CN1,0.2665 | |
| Cc1c(nc(o1)C#N)N,0.1661 | |
| C#CC1C2COCC12,0.2904 | |
| COc1c(nno1)CN,0.2045 | |
| CCC1N2C3CC=C1C23,0.1743 | |
| COC1CC2(C)NC12C,0.2894 | |
| C1C=C2COC3C1C23,0.2002 | |
| O=CCCC1(CN1)C#N,0.2279 | |
| C(=O)c1c(n[nH]n1)N,0.1827 | |
| O=CC1CC2C3CC1N23,0.2095 | |
| CC(C)C1(C)C2CC1O2,0.3145 | |
| CNc1c(cn(n1)C)N,0.2149 | |
| C#CC1OC1CCC#N,0.2808 | |
| OC1CCC2OCCC12,0.3015 | |
| CC#Cc1c(cc[nH]1)N,0.1876 | |
| c1c(n(nc1O)C=O)N,0.1941 | |
| CN=CN1C=CCC1=O,0.2037 | |
| N=C1CC=CC(=O)CO1,0.1854 | |
| CNC(C#N)C#CC#C,0.2208 | |
| CCOC1CC1OC=O,0.2578 | |
| NC12C3NC3C1C2C#N,0.2559 | |
| CCC(=O)C1=NCCO1,0.1976 | |
| C1C(=O)COC(=N1)CO,0.2078 | |
| C1C2C=CC3N4CC23C14,0.1795 | |
| ON=C1CC2CC1C2,0.2583 | |
| c1cc(=O)c(cnc1)O,0.1501 | |
| NC(=O)C1CC1(O)C=O,0.2123 | |
| OCC(O)C1CC1CO,0.315 | |
| CCC(C#N)C(N)C#N,0.2809 | |
| c1nc([nH]n1)C2COC2,0.2616 | |
| CC1(COC1=N)C=O,0.2228 | |
| C1OC1C12CN3C1CC23,0.3094 | |
| COc1ccnc(n1)O,0.2198 | |
| COc1cc(c(o1)N)N,0.2207 | |
| OC1CN2C(C3CC3)C12,0.2848 | |
| C1CC(O1)C1C2COC12,0.299 | |
| COC12CC1C(O)C2C,0.3043 | |
| CC1OC1CC(C)=NO,0.253 | |
| CC1(O)CC1OC=O,0.2691 | |
| c1c(nncn1)CCO,0.1641 | |
| OCC(CCC#C)C#C,0.2992 | |
| COC1CC=CC11CC1,0.2459 | |
| CC(=O)c1c(con1)N,0.1589 | |
| C#Cc1c([nH]c(=O)o1)N,0.1906 | |
| CCC1CC1CCC#N,0.3199 | |
| CN(C)c1ccccn1,0.187 | |
| OCCC1OC(=N)C1O,0.2764 | |
| CC1CC2(O)C1NC2=O,0.2623 | |
| CCC1(CO)C2CC1O2,0.3042 | |
| Cc1cc(cnc1O)F,0.2003 | |
| CC1C(=O)C2C3CC12C3,0.2167 | |
| OC(C#N)C1CC1C#N,0.3003 | |
| CC1(CC=O)CC2NC12,0.2166 | |
| O=CCCCC1CO1,0.2286 | |
| COC1COC(=N)C1=O,0.17 | |
| CNC1=CC(=N)OC=C1,0.1614 | |
| N=C1OCC(=O)C2CC12,0.2218 | |
| CN1CC(C1)(C=O)O,0.1781 | |
| C1OC2OC3C4NC13C24,0.3 | |
| CCOC1(CC1)CC#C,0.2979 | |
| CC1=CC2COC1C2O,0.2356 | |
| COCC12CC(O)C1N2,0.3159 | |
| CCC1CNC1=O,0.2804 | |
| CCC12COC1C(=O)C2,0.1991 | |
| CC(O)CCC1CN1C,0.2874 | |
| C(CC=O)CNC(=O)N,0.228 | |
| CC12CCC(O1)C(=O)C2,0.2144 | |
| OC1C2C3CN=C1N23,0.2011 | |
| NC1CC2NC12C#N,0.2501 | |
| OCCOC1C2CCC12,0.318 | |
| CNc1ccn(n1)C,0.2205 | |
| CC1C(C=O)N1C(N)=O,0.1969 | |
| CC12CN3C4CN1C2C34,0.2952 | |
| CC1OC2CC=CC2=C1,0.1949 | |
| c1c2c(on1)C=CC2=O,0.1421 | |
| O=CCC(C=O)C1CN1,0.1984 | |
| CC1C=CC(=O)NC=N1,0.1991 | |
| NC1=C(F)OC(=N)C=C1,0.1525 | |
| C#CC12CN1C(C2)C#N,0.2471 | |
| COCC1NCCC1=O,0.2126 | |
| OC1C2COCCOC12,0.3018 | |
| N#CC#CC12CCC1N2,0.2198 | |
| O=C1CCCN2CC2C1,0.2158 | |
| COC1CC(C)C=C1C,0.2584 | |
| N=C1OCC(O1)C#N,0.2655 | |
| CC1(CC1C#N)OC=O,0.275 | |
| C#CC(C1CC1)C1CO1,0.3064 | |
| CC1NC1(C)C#C,0.2753 | |
| COC=NC1CC2OC12,0.2572 | |
| CCC1(CC1)C1CC1O,0.3161 | |
| CCCC(CC)C(C)C,0.369 | |
| CC(CC#CC=O)C#C,0.2049 | |
| c1c(c(co1)N)C#N,0.1931 | |
| CC1C2CC2(C)CC1=O,0.2227 | |
| C#CC1=NC(CN1)C#N,0.2047 | |
| C1C2C1C13CN4C1C2C34,0.3077 | |
| CC1N2CC3C2C13C#N,0.2606 | |
| c1[nH]nc(n1)NC(=O)N,0.2372 | |
| OCCC1C2N1CC2=O,0.219 | |
| OC12CN3C(C=CC1)C23,0.2203 | |
| CCCC1C(C)OC1C,0.3161 | |
| Cc1c(ncnc1C)C,0.2162 | |
| CC1C(C)N1C1CCC1,0.2872 | |
| CC12C3C1C1C3CCC21,0.3248 | |
| OC1C2CC=CC12,0.2346 | |
| CC1=NC(=N)C(N)=NN1,0.1878 | |
| OC1CCC2=C1C=NN2,0.2534 | |
| NC(=O)C12CC1C(=O)O2,0.2449 | |
| OC1(CNCC1=O)C=O,0.1717 | |
| O=C1CC2CCCCN12,0.2726 | |
| CC1OCCC1CC=O,0.2238 | |
| CCn1ccc(c1N)C,0.2397 | |
| c1nc([nH]n1)O,0.2703 | |
| C#CC12COC1C1CC21,0.2726 | |
| CCC(C)(C)C(=O)C,0.2284 | |
| N=COCC(C#C)C#C,0.277 | |
| NC12CC1C(=O)NC2=O,0.2229 | |
| CC(C)(CC#C)CC#N,0.2911 | |
| CN=C1OC(C#N)C1C,0.2584 | |
| c1conc1CN2CC2,0.2358 | |
| NC1COC1(C#C)C#N,0.2361 | |
| CC1(CN2CC12)OC=N,0.2607 | |
| CNc1cnoc1C#C,0.17 | |
| C#CCC1NC11CCC1,0.2975 | |
| CC1(CCO)CO1,0.3372 | |
| COC(C)(C)C1CCO1,0.3158 | |
| OCC1NC1(C#C)C#C,0.2499 | |
| CC1C(O)CC=C1C#C,0.2081 | |
| CCC1OC2C(C)C2O1,0.3336 | |
| C1C2CC1C1=CC=CN21,0.2346 | |
| CCCC#CCCOC,0.3039 | |
| CC1=CNC(=O)C12CC2,0.2019 | |
| CCC(C#N)(C#N)NC,0.256 | |
| O=CNC1C2C3OC1C23,0.2691 | |
| CN1C=NC2(CC12)C#C,0.2383 | |
| O=C1C2C3CC4C(C23)N14,0.2372 | |
| C(C(=O)C(=N)N)NC=O,0.1706 | |
| C1C(CO1)OCC=O,0.2222 | |
| CCC12OC1CCC=C2,0.2478 | |
| NC(CCC#N)C#N,0.2841 | |
| CCOc1c(nno1)N,0.2118 | |
| C1OC2C3CC4CN3C124,0.2529 | |
| CC(O)C(=N)NC(C)=O,0.2284 | |
| O=CC1NCC2OC12,0.2073 | |
| CN=C(C1=NCCO1)N,0.2104 | |
| CC(NCC(N)=O)C#N,0.256 | |
| O=C1C2C=CC1C21CC1,0.2475 | |
| NC1=NCC2(O)CC12O,0.2542 | |
| C1CC(C1)(C#CCO)O,0.2784 | |
| OC12CC1OC1CC21,0.3016 | |
| CCc1c[nH]c(n1)C#N,0.2041 | |
| C1CC2CC1CCOC2,0.3137 | |
| C1OC2C1N1C3CC1C23,0.3095 | |
| CC(O)C1C(O)CN1C,0.2998 | |
| CC1OC(=O)C11CCC1,0.2751 | |
| CCC1=CC(=O)CCN1,0.1885 | |
| N#CC1=NC2C3CN1C23,0.1856 | |
| N#CC12CCC1N=CN2,0.2426 | |
| CC(COC=N)NC=O,0.2632 | |
| O=C1N2CCC2C11CN1,0.2265 | |
| CC1C2C3NC(=O)C1C23,0.2557 | |
| CC1(C)C2CC3OC1C23,0.3147 | |
| CC1C2C3CC2(CO)N13,0.2915 | |
| CC1CCC23CC12CO3,0.2874 | |
| CC1CC2=CC(C)CC12,0.2453 | |
| CC1CNC1(C#N)C#N,0.2498 | |
| O=C1N2CC2C=C1C#C,0.1807 | |
| CC(C#N)C1OCC1C,0.2922 | |
| OC(C=O)C1(CO1)C=O,0.214 | |
| CCN(CC)C(=O)C#C,0.218 | |
| c1c2c(ncn1)ocn2,0.2065 | |
| CC(O)CN1CC1C#C,0.2622 | |
| c1c2c(cnn1)COC2,0.1886 | |
| CCC12C(O)C1CC2C,0.3155 | |
| O=C1NC(=O)N2CC12,0.2357 | |
| CC1CC2OC(C)CC12,0.3048 | |
| CC12CC3(CO)CC1C23,0.3061 | |
| C(c1[nH]c(c(n1)N)O)O,0.2219 | |
| CC1OC(=N)COC1=N,0.2725 | |
| CC1CCC2=C1OC=C2,0.2297 | |
| CC1CC1CCOC=O,0.2852 | |
| CC1C=CCC=CC1=O,0.1859 | |
| CCCC1COC1CC,0.3212 | |
| CC(CCC#C)CC=O,0.2269 | |
| CC1C([NH3+])C1C([O-])=O,0.2721 | |
| CCC1C2COC1C=C2,0.2481 | |
| Cc1ccc(cc1)C=O,0.1927 | |
| CCOC(C)CC#C,0.3066 | |
| COC1CC(C=C1)=NO,0.1929 | |
| N#CC12CCOCC1N2,0.2866 | |
| CC(C)(C)OC(=N)C#C,0.2359 | |
| CN=C1ON=C(N)C=C1,0.1535 | |
| CCC(C)C1(CC)CC1,0.3457 | |
| OC1C2CCC1(N2)C#N,0.2652 | |
| CC12C(O)C1CC21CO1,0.3092 | |
| C1C=C(C(=O)N1)CCO,0.2218 | |
| Cn1ccc(c1)C#C,0.2185 | |
| CCC1(O)CCC(C)=C1,0.2552 | |
| O=C1OCC2NC2C=C1,0.2117 | |
| Cc1c(nn(n1)C=O)N,0.1862 | |
| C1CC1OCCO,0.3413 | |
| O=C1CC2OC2CCO1,0.2633 | |
| C#CC1C2C3CCN1C23,0.2517 | |
| OC1C2CC11CC(=O)C21,0.219 | |
| CC(CN)(OC=O)C#N,0.2497 | |
| Cc1c(cccn1)C#C,0.1982 | |
| CCC12CC3C(C1)C3C2,0.3415 | |
| CC(C)(CCOC=O)O,0.2843 | |
| CC(CO)C(C=O)C=O,0.1956 | |
| CC(CC1CCO1)C#N,0.2975 | |
| CCC1OC1(CC)C#C,0.2853 | |
| c1c2c(oc1N)CCN2,0.2044 | |
| CC1CN=C(N)NC1=O,0.2331 | |
| N=C1OC23CCC12OC3,0.2657 | |
| CCC(=O)COCC,0.2349 | |
| C1C2C1C1=CN=CN21,0.2309 | |
| O=C1CC2(CN2)C11CC1,0.2156 | |
| CC(C)(OC=N)C1CO1,0.2826 | |
| CC1CCC2CCC12,0.3548 | |
| c1(c([nH]nn1)N)C(=N)N,0.2144 | |
| C#CCNc1cnco1,0.2193 | |
| N=C1OCCC1OC=O,0.2648 | |
| CC(O)C(O)C(O)C#N,0.2761 | |
| CC12CCCC1(O2)C#C,0.2747 | |
| CC(O)C1CC(CO)C1,0.3287 | |
| CC1(NC11CCC1)C=O,0.2236 | |
| CCC12CCC1(N2)C#C,0.2702 | |
| CC1(N)C2NC(=N)C12O,0.2273 | |
| CC1(CCCC1)CC#N,0.3426 | |
| CC1CC=CC(O)C1=O,0.2259 | |
| O=C1CN2CC2C=CN1,0.1942 | |
| OC1CC(C1)C1(O)CC1,0.2991 | |
| C1C2CC3OC1C2C=C3,0.2459 | |
| N#CC1C2CCCCN12,0.2536 | |
| O=C1NC2CC1C21CO1,0.2565 | |
| CC1OC(C#C)C1C#N,0.2762 | |
| CC1=C(C)CC(C)(O)C1,0.2542 | |
| OCC1CC2OC1C2O,0.3227 | |
| OC12CC3C4C3C1OC24,0.3026 | |
| O=CC1COCC2NC12,0.2109 | |
| OC1CC2OC3C(O2)C13,0.2994 | |
| CC(C)(C(=O)CC#C)O,0.2276 | |
| CC1OC2CC1C1NC21,0.313 | |
| CC12CC(C)(CC1)C2O,0.3102 | |
| CC1C2CCN1C2C#N,0.268 | |
| O=CC1C2CC(C=O)N12,0.1958 | |
| OC1CCNC(=O)NC1,0.2963 | |
| Cn1ccc(n1)NC=N,0.2163 | |
| OC1C2CC1(O)C(=O)N2,0.2666 | |
| O=C1CCC2COC12,0.2008 | |
| c1c(nc(c(=O)[nH]1)F)N,0.1471 | |
| [NH3+]CC1=N[N-]N=CC1=N,0.1461 | |
| CCCCC1CCCO1,0.3245 | |
| Cc1c(=O)oc(cn1)N,0.1565 | |
| C1C2CC11OCCC1C2,0.3221 | |
| CC1(CO1)C#CC=O,0.2018 | |
| CC1(C)CC1OC1CC1,0.3198 | |
| c1c([nH]c(=O)o1)C(=O)N,0.1884 | |
| OCC1CC(O)C1,0.3299 | |
| OC12C3CC1OC2C3,0.3045 | |
| CN1C2CC1C2(C)CO,0.2621 | |
| CC1(C)C2C3COC1C23,0.3215 | |
| NC1=NC2CC1OC2=O,0.2315 | |
| CC1CC2(C)CC12O,0.3153 | |
| CCC1N=COCC1=O,0.2027 | |
| CC1CC2(C1)OCC2C,0.3065 | |
| CC1CC=C2C3NC3C12,0.237 | |
| OCC12CCC1C2C#N,0.2997 | |
| CCC(O)(CO)C1CN1,0.291 | |
| COC12COC1C(C)C2,0.3 | |
| C(C=O)n1nc(nn1)N,0.1943 | |
| c1[nH]c(=O)n(n1)C(=N)N,0.2197 | |
| CNc1c([nH]nn1)OC,0.2108 | |
| COC12COC1C(=O)C2,0.2 | |
| CCC1(CO)OCC=C1,0.2509 | |
| CC1=CCOC1C#N,0.254 | |
| O=C1C2CC1C(=C2)C#C,0.1963 | |
| NC(=O)C(O)C1CN1,0.256 | |
| CC1(CO)C2C(O)CN12,0.2912 | |
| C#CC#CC(C#C)C#C,0.2279 | |
| C#CC1C2CC2C2CC12,0.3012 | |
| CC1CC1(O)C(O)C#N,0.2926 | |
| CC#CC1CC1(C)C=O,0.2073 | |
| FC1=C(F)C=CC(=N)O1,0.1607 | |
| CCCCc1c[nH]nc1,0.2583 | |
| CC12C3CC3C1C2C#C,0.2526 | |
| COCC1CCC=C1,0.264 | |
| c1cc(oc(=O)c1)C=O,0.1541 | |
| CC1CC(=O)C2(CC2)C1,0.2234 | |
| CC1N=COC1(C)CO,0.2678 | |
| CC1C(C)C(O)C1O,0.2951 | |
| C1CC23CC4OC2CC134,0.2971 | |
| O=C1OC2CNC1CO2,0.248 | |
| O=CC1C2CC=CC12,0.2114 | |
| CC1CCC2(O)COC12,0.3084 | |
| OC1CCCC(=O)CC1,0.2221 | |
| CCc1c(con1)NC,0.2107 | |
| OC1CC2=CCCCC12,0.2572 | |
| O=C1CN2CC2CCN1,0.2587 | |
| CC12CC1C1N2CC1=O,0.2052 | |
| CC1C2C3NC3C12C#N,0.2403 | |
| CCC(=N)NC(=O)NC,0.2585 | |
| c1cc2c(nc1)CC=C2,0.1936 | |
| CC1(CO)COC(=O)C1,0.2781 | |
| OC1CN2CC(C#N)C12,0.2603 | |
| OCC1CC2(CO)CN12,0.2977 | |
| CCC1(C)CNC1=O,0.2806 | |
| CC#CCc1ccno1,0.2412 | |
| OC1CN2CC2CC=C1,0.2197 | |
| CCC1CC1C(C)C=O,0.2244 | |
| CN=C1OC(=O)NN=N1,0.1751 | |
| CC(O)C1CC2(C)OC12,0.3136 | |
| CC1(C)C2C3CC2(C)C13,0.3709 | |
| CC(CN)(C#N)C#N,0.2644 | |
| Cc1coc2c1cc[nH]2,0.2242 | |
| CC12C3CC(OC13)C2=O,0.2056 | |
| CC1(CN=CO1)OC=N,0.2776 | |
| CNc1c(non1)C#C,0.1839 | |
| CC1C2C(=O)OCC12C,0.2701 | |
| COC(=O)C1CC(=O)O1,0.2672 | |
| CCC1C2C3CC1N23,0.3118 | |
| Cc1c(oc(=O)cn1)N,0.1514 | |
| OC1(C=O)C2C3OC2C13,0.1973 | |
| Cc1ncc(o1)CCO,0.2369 | |
| CCCC(O)CC(N)=O,0.2714 | |
| c1c[nH]c(c1C=O)C#N,0.1833 | |
| CNC(=O)NC(C)C#C,0.2863 | |
| N=C1OC2CC3CNC123,0.2489 | |
| CC#CC(C)(C)C(=O)C,0.2257 | |
| CC1CCCCOC=N1,0.2603 | |
| CCC12CNC1C(=O)O2,0.2407 | |
| CN(C)c1c[nH]nn1,0.2013 | |
| CCc1c(nc[nH]1)O,0.2238 | |
| CC(C)N=COC(=O)C,0.2422 | |
| COC1CC11COC=N1,0.2512 | |
| NC12C3C4N=C1OC2C34,0.1454 | |
| CCOC(=O)CN1CC1,0.2522 | |
| CCCCNC(=N)C=O,0.1695 | |
| CCCC1CCC(C)C1,0.3738 | |
| CNC(CN1CC1)C#N,0.2703 | |
| CCC(C)CNCC#N,0.2695 | |
| CCC1OC=NC11CC1,0.2514 | |
| CC(CC#C)N(C)C=O,0.2728 | |
| CC12OCC1CC2O,0.3074 | |
| O=CC1CC(CO1)C#C,0.2157 | |
| CN=C1OC2C(CO)C12,0.2708 | |
| CC1(C)OC1C(O)C#C,0.2808 | |
| Cc1nc(co1)NC,0.2111 | |
| OC12C3CN3C1CC2=O,0.1954 | |
| CC1CCOC=NC1C,0.2538 | |
| COC12CCC1(C)OC2,0.3031 | |
| CC1CCC(C)=CCO1,0.2488 | |
| COCCC1CC(=N)O1,0.2874 | |
| CC(C)(C)C(C)(O)C#C,0.2979 | |
| CC1OC2C3CC3(C)C12,0.3178 | |
| C#CC1C2CC3C2OC13,0.2872 | |
| CC1(C)C2CCC1C2O,0.3258 | |
| CC1(O)CC(C)(CO)C1,0.318 | |
| CC(C)CCC(=O)N,0.2789 | |
| Cn1ncc(n1)NC=O,0.2213 | |
| OCC#CC1CCC=C1,0.2573 | |
| O=CC#CCC1CN1,0.1968 | |
| Cc1ccnn1CC#N,0.2471 | |
| CCC1(C)CCC(O)C1,0.3303 | |
| OCC1C(O)C1(O)C#C,0.2533 | |
| OC1CC11CCN2CC12,0.3004 | |
| CC(C)C12CCC1(C)O2,0.3211 | |
| CC1C2CCC(=O)OC12,0.2686 | |
| CC(C)(C)C1(O)CC1O,0.3148 | |
| CN1CC2(CC1C2)C#N,0.2484 | |
| CC#CC1CCN1C=O,0.2635 | |
| CC1=CC(O)CC1=O,0.1917 | |
| CC(OCC#N)C#N,0.3046 | |
| CC#CC1(CN1)C1CO1,0.2683 | |
| CN=COC1COC1=O,0.2421 | |
| CC12OC1C(O)C2=NO,0.2365 | |
| CCc1cocc1C=O,0.1904 | |
| COC1CCOC(=N)C1,0.275 | |
| Cc1cc([nH]c1C)C=O,0.1753 | |
| COC(C)(CO)C#CC,0.2819 | |
| CC1CN=C(CC=O)O1,0.2284 | |
| CCOc1c[nH]cc1N,0.2321 | |
| NC(C#CC#N)C(N)=O,0.2044 | |
| O=C1CCN1CC1CN1,0.2785 | |
| CC1(C#C)N2CC2C1=O,0.2101 | |
| CC1C(O)C(O)C1C#C,0.2824 | |
| CCCc1cnno1,0.2339 | |
| O=C1C2COC1C=C2,0.2158 | |
| CC#CCn1cncn1,0.2716 | |
| C1C2OC3C4CC3N4C12,0.3025 | |
| CC12CC1CCC2CO,0.3333 | |
| C1CCC(CC1)C#N,0.3476 | |
| C#CCC(=O)C1(CC1)O,0.2238 | |
| N#CC1(CO1)C1CCO1,0.2656 | |
| CCCC(=O)C(=N)OC,0.1959 | |
| CC1C=CCCCC1=O,0.2241 | |
| NC(=O)C1C2C3NC3C12,0.2586 | |
| OC1C(CC#C)C1C#N,0.2872 | |
| CCC12CC(=O)N1C2C,0.2344 | |
| FC1=NC(F)=NC(=N)N1,0.2008 | |
| CC12C3C(C#C)C1CN23,0.2812 | |
| CCC12C3CC(C13)C2=O,0.2432 | |
| CCOC1(C)CC1O,0.316 | |
| O=C1OC23CN(C2)C13,0.2184 | |
| CC(=O)COC(=O)C=O,0.1811 | |
| CN=C1C2C3N=CN1C23,0.2074 | |
| CC1C=CC(=O)C11CO1,0.1817 | |
| COc1[nH]c(c(n1)N)N,0.2309 | |
| OC1CC11CC2NC2C1,0.3103 | |
| COC1(CO)COC1C,0.3022 | |
| CCC1=CC(=N)OC1,0.2152 | |
| COC1(C#N)C2CC1C2,0.3024 | |
| CC(C)N=c1onno1,0.205 | |
| CC1C2C(O)C1C21CO1,0.3256 | |
| N#CC1=CC2CC1O2,0.1982 | |
| COC(=O)CCNC=O,0.2681 | |
| CC1CC(O)C(O)CO1,0.3235 | |
| CC12CN1C(=O)NC=C2,0.2112 | |
| OC12C3C1N1C3C21C#N,0.2307 | |
| c1cc(oc1)NC(=O)N,0.2322 | |
| C#CC#CC(=O)N1CC1,0.1885 | |
| N=C1COC2CC3C2N13,0.2494 | |
| CC([NH3+])C1=C([O-])ON=N1,0.2154 | |
| NC1=CC(=O)C(O)C1O,0.2079 | |
| CC1COCC1C1CC1,0.3179 | |
| CC1OC2(C)CCC12C,0.3134 | |
| CC([NH3+])C1=C([O-])C=CO1,0.1716 | |
| O=CC1CC(=O)C1C#C,0.2124 | |
| N=C1OCC(=C1)C1CO1,0.2054 | |
| CC1C(C=O)C2CN12,0.2086 | |
| N#CC12C3CN1CC23,0.2516 | |
| NC1=NNN=C1OC=N,0.2067 | |
| O=CNC(C=O)C1CN1,0.2063 | |
| CC1OCC11OC1C#N,0.2557 | |
| O=CC1NC1C1CO1,0.2201 | |
| O=CC12CCC1C1OC21,0.2172 | |
| CCN1CC(O)C1C=O,0.2016 | |
| O=C1CC2CC(=O)CN12,0.2124 | |
| CC12C3OC(C13)C2C#C,0.2683 | |
| OC1(C2CN2)C2CCC12,0.2907 | |
| Cc1c([nH]cn1)C(C)C,0.2455 | |
| COc1c(c([nH]n1)O)N,0.2629 | |
| CN1C(C#N)C11COC1,0.2607 | |
| CC12CC(=O)C3CC1N23,0.2184 | |
| COc1nc(c(o1)N)N,0.2237 | |
| c1nc(on1)CCCO,0.2536 | |
| CN1CC2(C)NC2C1=O,0.2525 | |
| CC1C2C=CCN2C1=O,0.2431 | |
| CCC1NC(=O)NC1C,0.3038 | |
| CCC1CC2OCC=C12,0.2362 | |
| COc1cnoc1OC,0.2068 | |
| C1C(=O)CC(=C1C=O)N,0.1807 | |
| CC1(O)C2C3CC2C13C,0.3268 | |
| C1OC2C3NC12C=C3,0.2139 | |
| C1CC1C1CCOCO1,0.3476 | |
| COc1c[nH]nc1C=O,0.1909 | |
| O=C1C(CC11CC1)C#N,0.2172 | |
| CC(=O)N1C=CCC1=N,0.2114 | |
| c1cc(oc1CO)C=O,0.1826 | |
| O=CC12COC1=NCC2,0.2118 | |
| CCC1(OC1(C)C)C#C,0.2835 | |
| CCC(NC(C)=O)C#C,0.2702 | |
| CCNc1cocc1C,0.2243 | |
| N=C1OC23CN(CC2)C13,0.2355 | |
| Cn1c(ccn1)C=O,0.1975 | |
| CC1OC=NCC1(C)O,0.2653 | |
| CCC(O)CNC(C)=O,0.2777 | |
| CC#CC(=O)CC1CC1,0.2013 | |
| CC12CCC(C)(C)C1O2,0.3317 | |
| C#CC#Cc1cc[nH]n1,0.1896 | |
| C1C2C1C1CC2CCO1,0.3179 | |
| c1c(non1)C=O,0.1881 | |
| NC=[NH+]C1=C([O-])ON=N1,0.125 | |
| CC1C2CC3C(N23)C1=O,0.2211 | |
| CC1(CC(C1)C#N)C#N,0.3174 | |
| CC12CC(CC11CC1)O2,0.3247 | |
| COC1CC2COC2C1,0.312 | |
| CC(O)C1OC1CCO,0.3332 | |
| CCC1C2CC(O)C12O,0.3186 | |
| CCC(O)(CO)COC,0.3231 | |
| CC1(O)C2OCC12O,0.2719 | |
| CC1(CO)C2C3CC1C23,0.3202 | |
| C1C2NC3CN=COC123,0.2344 | |
| CC1OC1CC1CN1C,0.3081 | |
| OC12CC1C1OC1C=C2,0.2403 | |
| OC1COCOC1C#N,0.2844 | |
| C1CC1c2[nH]c(=O)[nH]n2,0.233 | |
| C#CC1CC2CCC12,0.3005 | |
| CC(CO)C12CN(C1)C2,0.2967 | |
| CC12C3OC(C13)C2(C)O,0.2916 | |
| CC1NC(=O)C1C1CN1,0.2711 | |
| C1C2OC11COCOC21,0.31 | |
| CCC1OC1(C#C)C#C,0.2555 | |
| CCC(=O)C(C)(C)CC,0.2289 | |
| O=C1C2NC1C1OCC21,0.2278 | |
| OCC1CCC=CC=C1,0.1894 | |
| CN(C)c1cnccn1,0.1739 | |
| C1C2OC3OCCC3C12,0.3164 | |
| CC(O)C1(CC#N)CO1,0.2995 | |
| CCCNC(=O)C(=N)N,0.2205 | |
| N=C1CCN=C(N1)C=O,0.1696 | |
| CCC12COC1C2C=O,0.2124 | |
| CC(CC1CC1)C#N,0.3292 | |
| CC1C=C2CC3C1C23,0.1787 | |
| CC(C=O)N1CC1C#C,0.2174 | |
| C1CC1C(=O)CC#N,0.2365 | |
| O=C1CC=CCC2CC12,0.2273 | |
| CCC1(CC1O)C(N)=O,0.2736 | |
| O=C1OC2CC2NC=C1,0.1965 | |
| c1c(c(nc(=O)o1)N)N,0.1887 | |
| CCC1=CC2(CN2)CC1,0.2345 | |
| CCCC1C2CC2C1C,0.3347 | |
| c1c2n(nn1)C(=O)NC2,0.2316 | |
| N=C1OC2CC1(C2)C#N,0.2854 | |
| OCC1CCC(=O)NC1,0.2675 | |
| OCCC12CC3C1N3C2,0.3048 | |
| OC1C(CC=O)OC1=N,0.2254 | |
| CC1=NCC(=O)OCO1,0.2533 | |
| OCC1CN=CO1,0.269 | |
| CC1OC23CC(C2O)C13,0.3007 | |
| CC1C(O)CC1CC#N,0.3121 | |
| CC(=O)C1COC(=O)N1,0.2215 | |
| N#CC12NC3C1CC23,0.2548 | |
| CCOc1nc(no1)O,0.2579 | |
| CCCOC(C)(C)C#N,0.3005 | |
| OC1(CC1)C1CC(=O)O1,0.2825 | |
| C1C=C(C(=O)O1)CO,0.2335 | |
| CC1OC11C2OC2C1=O,0.2006 | |
| C1OC1C1=CCCCC1,0.2462 | |
| CN=C1NC2C(O)C12O,0.2448 | |
| CN1CC1(C)C#CCO,0.2577 | |
| N=C1CC2CN2CCO1,0.2537 | |
| O=CCC12CC1C1OC21,0.2076 | |
| OC1C2NC(=NC12)C#N,0.1882 | |
| C#CC12NC1CC=C2,0.2319 | |
| CCC1(CC=CC1)CC,0.2652 | |
| c1c[nH]nc-2ccnc12,0.1507 | |
| NC(=O)C1OC2COC12,0.2469 | |
| OCC1OC11CC(=O)C1,0.2169 | |
| N#CC1C2CC=CCC12,0.2663 | |
| CCC(NCC#C)C#N,0.2749 | |
| COC1C2(C)CC1(O)C2,0.3208 | |
| C1CC2(CN=CO2)C=C1,0.2496 | |
| OCCC1CC1N1CC1,0.3139 | |
| Cc1cnoc1NC,0.2179 | |
| CC(C)(CO)C1CCC1,0.3358 | |
| CC1(CCOC(=O)C1)C,0.2715 | |
| CC1=CC2CC2N1C=O,0.2036 | |
| NC1(CO)COC1=N,0.2617 | |
| CN=C1CC(C)O1,0.2797 | |
| CCN(CC=O)C=O,0.2127 | |
| O=CC1C2C3CC2C13,0.2195 | |
| C1C2C3C4CC=C3C1N24,0.1681 | |
| CC(C)(CCCO)C=O,0.2292 | |
| C(C(=O)NC=O)N,0.2135 | |
| CC1C2CC1C(C)(C)C2,0.3655 | |
| CCOC1CC1C1CO1,0.3347 | |
| CN=c1cnc(n[nH]1)O,0.1362 | |
| O=CN1C2CC1C21CN1,0.2504 | |
| CCC1=CC2NC2C1=O,0.1795 | |
| OC12CN3C(CCC1)C23,0.2887 | |
| CCCC1OCC=C1,0.2481 | |
| COC1CN=C(O1)C=O,0.1962 | |
| CC12NC1C1=CCCC21,0.2347 | |
| CC12CC3(CN3)C1(C)N2,0.2909 | |
| COC1(C)C2OCOC12,0.3022 | |
| OC1C2CC1N2C=O,0.2522 | |
| CC#CC(C)C(C)(C)C,0.3002 | |
| CN1CC(C1)(CO)OC,0.2863 | |
| CCN1CC1C(C)=O,0.2028 | |
| c1c(c(co1)N)CCO,0.216 | |
| OC12CC3C4CC1C2C34,0.3232 | |
| COCC1C(C)N1C=O,0.2627 | |
| CN(C)c1ccon1,0.2162 | |
| CC(C#N)C1C(C)N1C,0.261 | |
| CCCC(O)CCCO,0.3308 | |
| COC(=O)c1cnco1,0.2127 | |
| NC1=C(F)ON=NC1=N,0.078 | |
| CC1NC(C=O)C1O,0.1946 | |
| CCOC(=O)C(C)CO,0.2807 | |
| [NH3+]CC1=N[N-]C(O)=N1,0.2548 | |
| NC1=COC(=N)C(F)=N1,0.142 | |
| CC1(CC1C#N)C=O,0.2271 | |
| CN1C2C3C=CC2(O)C13,0.1958 | |
| NC1C(=N)N2CC12C#N,0.2393 | |
| CC(=O)C12CC3CC1C23,0.2265 | |
| COCCC1CC1(C)O,0.3242 | |
| O=CC1(CC1C#C)C=O,0.2069 | |
| CC(=O)OC=NCC=O,0.219 | |
| CCC1COC1CC,0.3213 | |
| CN1C2C(N)C2(O)C1=N,0.2372 | |
| CNC(=O)C(N)C(N)=O,0.2372 | |
| C(CC(=O)N)COC=O,0.2674 | |
| CCC12CC1(O)CC2,0.3198 | |
| C[NH+]1CCC1CC([O-])=O,0.2703 | |
| OCC12OC1CC2C#N,0.3039 | |
| CCC(=O)C1C2CN1C2,0.2198 | |
| CC1CC11OCCC1C,0.3031 | |
| Cc1nc(=O)ccn1C,0.2047 | |
| Cc1c(cn(n1)C)N,0.2218 | |
| NC1=CC(=N)OC1C#C,0.2127 | |
| CC(C=O)(C=O)OC,0.1869 | |
| CN(C)c1c(cco1)O,0.2238 | |
| CCCC(O)CO,0.3173 | |
| CCC(O)C(O)C(C)C,0.313 | |
| CC1=CCOC(=O)C1,0.2642 | |
| C1CN=C2C1=CCO2,0.2061 | |
| CC#CCCC#N,0.2878 | |
| OC1C2C3NC3(C#N)C12,0.2871 | |
| C1OC2C3C4C=CC3C124,0.2228 | |
| C#Cc1cc[nH]n1,0.2274 | |
| CCC1=CCCCC1,0.259 | |
| CC1COCCOC1=N,0.2822 | |
| CCC1NC(=N)C11CO1,0.2531 | |
| CN1C2C3CC3C(O)C12,0.2604 | |
| CC(O)(C#C)C(=O)CO,0.2247 | |
| CCNc1c(nn[nH]1)N,0.2196 | |
| CCC1C(C#CC)N1C,0.2552 | |
| C#CC1(CCC1=O)C#C,0.205 | |
| C1CC1C(=O)N2CC2,0.2511 | |
| COc1nc(co1)C=O,0.1915 | |
| CCN1CC1(C)C,0.3063 | |
| CC1(CN1)C1COC1=N,0.2756 | |
| CC1(CO1)C(O)CO,0.3322 | |
| Cc1nc(co1)CC#N,0.2433 | |
| CC(C)CC(=O)N(C)C,0.269 | |
| OC1CC=CC2CC2C1,0.242 | |
| CC(=N)OCCOC=O,0.2801 | |
| O=CC12CC3C(C13)C2=O,0.2114 | |
| c1c(cncn1)C#N,0.1986 | |
| CCN1CCCOC1=O,0.2945 | |
| CC1(C)CN1CC1CO1,0.3097 | |
| C1CC23OCC4C2OC134,0.2843 | |
| Cc1coc(n1)N(=O)=O,0.176 | |
| CCC1=CCCC1CO,0.2571 | |
| CC12OC(C3NC13)C2O,0.2856 | |
| Cc1cn(nn1)C,0.2499 | |
| CC#CC(O)C(C)CO,0.2873 | |
| COCC#CC(N)C#N,0.2673 | |
| C#Cc1c(c(c[nH]1)O)N,0.1849 | |
| C1C2C3C4C2C1N34,0.307 | |
| COC12CC(C=C1)C2C,0.2382 | |
| C1NC11CC2N=COC12,0.2624 | |
| CC1C(=O)C2NC12C=O,0.1907 | |
| COC12CC1C(C)(O)C2,0.3132 | |
| O=CC(=O)CC1CCO1,0.1546 | |
| CC1OCC(O)C1C#C,0.2854 | |
| CC1(C)OC(=N)C1N,0.2685 | |
| O=C1CC2(CC12)C#C,0.225 | |
| CC(=O)C1CC(O1)C#C,0.2191 | |
| CC1C=CC(=O)OC=N1,0.2052 | |
| CC(C)CCC1(CC1)C,0.3432 | |
| C(CO)N(C=O)C=O,0.2157 | |
| O=C1CC2(CC2O1)C#C,0.2592 | |
| CC(O)CC1CCOC1,0.3032 | |
| C1OC1C1C2CC1CC2,0.3509 | |
| Cn1cc(nc1)C#N,0.2297 | |
| NC1=C([O-])C=CNC1=[NH2+],0.1849 | |
| CCC(C)C(C)CC,0.378 | |
| CC1OCC11OC1CO,0.32 | |
| O=C1NCC23CC12CO3,0.2518 | |
| COCC1(C)CC2NC12,0.3127 | |
| CCNc1c(cco1)C,0.2162 | |
| CC(O)C1OCC(C)=C1,0.2465 | |
| C1CN1c2[nH]c(=O)[nH]n2,0.2399 | |
| c1nc(nc(n1)F)F,0.2387 | |
| CCN(C)c1ccon1,0.214 | |
| CC1C(C)C1(C)NC=O,0.2729 | |
| CC1(CO)CN1,0.3186 | |
| CCN(CC#C)C(=O)C,0.2669 | |
| CN1CC2(CC12)OC=N,0.2349 | |
| O=CC1COCC(=O)O1,0.2098 | |
| OC1C2C3C4C3C2(O)C14,0.2846 | |
| CN1C2CC1C(=O)C=C2,0.1645 | |
| O=C1OCC1OCC#N,0.2514 | |
| CCC1(OCC=C1)C=O,0.1987 | |
| OC1CC=CC1(O)C#N,0.2552 | |
| CC12CN1C(=O)OC2=N,0.2583 | |
| OC(CCOC=N)C#N,0.2727 | |
| OC1CC11CC=CCO1,0.2644 | |
| C1CNCc2c1onn2,0.2087 | |
| O=C1C2CCC1(N2)C#C,0.2291 | |
| CC1=CCC2(OC12)C=O,0.2122 | |
| CC1=C(N)ON=CC1=N,0.1646 | |
| COC1COC1C#N,0.274 | |
| CC1(C)C(O)C2CCC12,0.307 | |
| CCC1=C(N)OC(=N)O1,0.2358 | |
| CC1OC11CC2C1N2C,0.3039 | |
| CC12CN3C1C1(CN1)C23,0.2945 | |
| CCc1[nH]c(c(n1)O)O,0.2132 | |
| CC12OC1C1CCC21C,0.3217 | |
| CC1COC11CC1(C)C,0.2974 | |
| CC1(OCC2OC12)C#C,0.2944 | |
| C1CC23OC2(C1)C1OC31,0.3143 | |
| c1nc(n(n1)C=O)CN,0.2084 | |
| CC1C2CC1C1OC1C2,0.3483 | |
| CC(C)C1=NCC(=O)N1,0.2334 | |
| C#CC1(CN1)C#CC#N,0.2131 | |
| CCCC1OC1(C)C#C,0.2856 | |
| OC12CC1N1N=CN=C21,0.2293 | |
| CC1C=CC2OCC1O2,0.2484 | |
| CC1(CC#N)C2COC12,0.2782 | |
| C1C2C1C1C=CCCC21,0.2623 | |
| CC(O)(CO)C#CC#C,0.2219 | |
| O=C1OC2CC3(CO3)C12,0.2746 | |
| C1CCC(CC1)(C#N)O,0.3101 | |
| OC1C2CNC(=O)NC12,0.2707 | |
| OC1C2CC1CC(=O)C2,0.2182 | |
| OC1CCC=CC1,0.2682 | |
| c1cc(=O)onc1C=O,0.1665 | |
| C1CC1OCC(=O)N,0.268 | |
| CC(O)CC1=NNN=C1,0.2566 | |
| OC1C=CNC1=O,0.2049 | |
| CC12CC(C1)(O2)C1CO1,0.3195 | |
| COC(CO)C1(C)CO1,0.3171 | |
| C#CCOC1C2CC1O2,0.2675 | |
| CC1(CO1)C(=O)NC=N,0.2213 | |
| COC1(C)COC1C=O,0.2195 | |
| OC1C=CC2OC12C=O,0.2146 | |
| OC1CCC2(CO2)C1,0.3229 | |
| C1COCC(=O)NC=N1,0.2263 | |
| CCC12C3OC1CC23O,0.2857 | |
| ON=C1C2OC1C2C#C,0.2535 | |
| CC1CNCC(=O)O1,0.2407 | |
| CC1C2CC2(C#N)C1O,0.29 | |
| OC12CC3CC1N1C3C21,0.2888 | |
| CCC12CC1CN2C=O,0.2568 | |
| CC(O)(CO)C1CCC1,0.3104 | |
| CC(O)(CC#N)C1CC1,0.3099 | |
| c1c(c(on1)N=CN)N,0.163 | |
| OC1(CC1C#C)C#N,0.265 | |
| OC1C=CC2CC1(O)C2,0.2457 | |
| CC(CO)C(O)C#C,0.2954 | |
| COc1ccnc(c1)O,0.2233 | |
| CCCC1OCC1(C)C,0.3177 | |
| Cc1nnn(n1)CC#N,0.2546 | |
| CC1C2CC2C2(O)CC12,0.3183 | |
| CC#CC1OCC=C1C,0.2533 | |
| OC1C2CCC1C(=N)O2,0.2829 | |
| CCC12CCC1OC=N2,0.263 | |
| CC1CC2(C1)OCC2=O,0.2211 | |
| OCC1(CC2CC12)C=O,0.2192 | |
| O=CC12OC1CC2=O,0.1993 | |
| OCC1CC2CC1C2,0.3407 | |
| C1C2C=CC3OCC2C13,0.2429 | |
| C1CC23OC4CC2C4C13,0.3117 | |
| Cc1c[nH]c(=O)c(n1)N,0.1681 | |
| CC1(C)COC2COC12,0.3231 | |
| CC#Cc1[nH]c(=O)on1,0.2038 | |
| CC(=O)C1C2C3CN3C12,0.2056 | |
| CC1CC(=O)C2OC12,0.213 | |
| CC1OC1CCC(N)=O,0.279 | |
| CC(C)C1CC1NC=O,0.2717 | |
| Cc1cc(c([nH]1)C)NC,0.2101 | |
| CC12CN1C(C#N)C2N,0.2521 | |
| CC(C)(CNCC#N)O,0.2696 | |
| CC12CC3C(C=C1)N23,0.2177 | |
| CC1(C)C2OC=NC12C,0.2516 | |
| CC(C)(CCC#N)C#C,0.3036 | |
| OCC1OC2(CC12)C#N,0.2563 | |
| OCC12CCN1C2C=O,0.208 | |
| O=C1CC2(CN2)CO1,0.275 | |
| Cc1c(cc([nH]1)C=O)O,0.1642 | |
| CN=C1OC=C(C)C=N1,0.1601 | |
| CCC12CC(=O)CC1O2,0.2269 | |
| CCOc1nc(co1)O,0.2348 | |
| OC12CN3C1C2OC3=O,0.2548 | |
| OC1CCOC(C1)C#C,0.2924 | |
| OC1(C=O)C2C3CC1C23,0.2236 | |
| CCC(O)(CC)C(C)O,0.3212 | |
| CC1(CO)COC1C=O,0.214 | |
| NC1=C(F)C(=N)C=NO1,0.1624 | |
| CC1CC1(C#N)N(C)C,0.2665 | |
| CC(C)N=COCC#N,0.2647 | |
| CC(=O)NC1COC1=O,0.2607 | |
| OC1CC(NC1=N)C#N,0.2675 | |
| C1CC2CCOC2O1,0.3194 | |
| CCc1cocc1CC,0.2398 | |
| CC1C2(C)CC2C1(C)O,0.3104 | |
| c1ccn(c1)CCO,0.2465 | |
| CC1C2OC1C1(C)OC21,0.3099 | |
| CC12C3C4C3C1C24,0.3049 | |
| OC12CCC1C(=O)NC2,0.268 | |
| CC1CC1(C)C=O,0.2272 | |
| COC(C)C1CCC1=O,0.2209 | |
| CC1OC1CC(O)C=O,0.2181 | |
| c1cnn2c1NCC2,0.2385 | |
| c1c(ocn1)NC2CC2,0.2177 | |
| COC(=N)N1C=NN=N1,0.2402 | |
| c1cc(nc(c1F)F)O,0.2021 | |
| COCC#CC(=N)OC,0.2355 | |
| OCC1C2CC3OC1C23,0.2973 | |
| CC1CC2OCC(O)C12,0.3006 | |
| c1coc2n1c(cn2)N,0.219 | |
| CC1=NC(C=O)C(=O)N1,0.2136 | |
| CC1C2CC3(OC3C)C12,0.3303 | |
| OC1C2C3OC2C13C#N,0.2656 | |
| OC1C2C1C1OC2C1O,0.3152 | |
| CN=C1ON=NC(F)=N1,0.1504 | |
| CCN1CC=CNC1=O,0.2214 | |
| Cn1c(=O)cn[nH]c1=O,0.202 | |
| CC12CC3(C)C1OC23,0.3132 | |
| CCc1cc(on1)OC,0.2391 | |
| CC1(CC1)C(C#C)C#N,0.2953 | |
| CC1(CCC(=O)O1)C#N,0.277 | |
| CCC(C)C1CC1C#C,0.2904 | |
| CC1C=CC2(C)NC12C,0.2403 | |
| NC(=O)OC1COC1=N,0.2818 | |
| CC1CC1(O)CN1CC1,0.3152 | |
| N=COC1=NC=NN=N1,0.1657 | |
| Cc1c2c(c[nH]1)COC2,0.2344 | |
| CNC(=O)C1OCC1C,0.2643 | |
| CC#CC1COCC1C,0.296 | |
| CC1(CC1)C=O,0.2341 | |
| CC#CCC(O)CC=O,0.2201 | |
| CCCCCC1CCO1,0.3293 | |
| CC(O)C1(C)CC=CC1,0.2659 | |
| N#CC1(CN1)C1CCC1,0.2853 | |
| OCC1OCOC1=N,0.2783 | |
| CC1C2NC1C2C#N,0.2762 | |
| [O-]C(=O)CC12CC(C1)[NH2+]2,0.2785 | |
| CC1CC1CCCC#C,0.3134 | |
| O=CC12CC3(CN3)C1N2,0.2195 | |
| c1c(non1)COC=O,0.24 | |
| CC1CN2C3C4NC13C24,0.2718 | |
| CC1(CC1)n2cnnn2,0.2629 | |
| CCC(=O)NC(=O)C#C,0.1987 | |
| CN1CC(C#C)C1C#N,0.2481 | |
| COC(C)CC(O)C#C,0.2845 | |
| CCC1CC=CC(=O)N1,0.2075 | |
| N=C1CC(CC#N)O1,0.2895 | |
| Cc1nc(=O)cc(o1)N,0.2071 | |
| CC#CC(O)C(=O)C#N,0.1729 | |
| CC12NC1C=C1CCC21,0.2349 | |
| OC1CC11C2C3CN2C13,0.2903 | |
| c1c(cn[nH]1)N2CCC2,0.2155 | |
| CC1COC(=O)N(C)C1,0.2937 | |
| CCC12CCC1C2OC,0.3237 | |
| CC1=NC(=N)OC(F)=N1,0.1999 | |
| CC1OC2CCC=CC12,0.2584 | |
| FC1=NOC(=N)C(=O)O1,0.194 | |
| O=CC12CC3CCC1C23,0.22 | |
| C#CC1CCC=CCC1,0.2567 | |
| c1c([nH]c(=O)[nH]1)CO,0.2335 | |
| NC(=O)N1C=NCC1=N,0.2282 | |
| Cc1c([nH]nc1O)C#N,0.2013 | |
| CCC1C(O)COC1=N,0.2838 | |
| CNc1c(non1)NC,0.2108 | |
| OC1(CC2COC12)C=O,0.2191 | |
| C(C#N)C(CC#N)CO,0.2794 | |
| OC1COC2(CC2)C1=O,0.2127 | |
| NC1C2OCOC12C#N,0.2478 | |
| CN1CC(C)(O)C1CO,0.2775 | |
| CC1(COC1=NC)C,0.2824 | |
| C1C2N3CC4OCC24C13,0.3048 | |
| CCC1CC(O1)C#CC,0.2743 | |
| O=C1NC(C=C1)C1CN1,0.2126 | |
| OC12CC(C1)CC2C#C,0.2953 | |
| CCOCC,0.3414 | |
| C1C2C1C1OCCC21,0.3168 | |
| COC1CCCCCO1,0.3306 | |
| C1CN1C12CN3CC1C23,0.2933 | |
| OC1CCC2(NC12)C=O,0.221 | |
| CC1C2C(CO)C2C1O,0.2973 | |
| C#Cc1cc(oc1)N,0.1948 | |
| O=CC1OC11CCC1,0.2174 | |
| N#CC1C2COCC1N2,0.2681 | |
| O=CCCOCC1CO1,0.2284 | |
| CC12OC1CNC2C=O,0.2057 | |
| C1OC1C1CC11CCC1,0.3328 | |
| NC(=O)C1OCC1C#C,0.2527 | |
| CCCCC(C)(C)C,0.3724 | |
| CCCOC(=O)C#CC,0.2341 | |
| OC1C2CCC1O2,0.3113 | |
| COC1CCC11NC1C,0.3071 | |
| CC1OCC(=O)OC1=N,0.2487 | |
| OC1(COC=N)COC1,0.2627 | |
| NC1=NC2CC2O1,0.2715 | |
| C1C=Cn2c1nc(n2)N,0.1802 | |
| CC1OCCC1(C)C#C,0.2985 | |
| CC1C2CC1C=CC2,0.2524 | |
| CN(CC#N)C1CC1O,0.2487 | |
| CC1C2CC1(C)OC2,0.3189 | |
| CC1(CO)OCCC=C1,0.2597 | |
| NC(C#N)C1=NC=CN1,0.2395 | |
| c1c(coc1CC=O)N,0.1746 | |
| CCOC1C2CC(=O)C12,0.2293 | |
| C1OC1C1CCOC=N1,0.2675 | |
| C1CC2C=CC1C1OC21,0.2511 | |
| COC(C)C1(CN1)C#C,0.2832 | |
| COC(C)C1=CC=CO1,0.2353 | |
| O=CCC1(CCO1)C#C,0.2213 | |
| CC12CC(CO1)C(=O)O2,0.275 | |
| CCC(=O)C1(CO1)C#C,0.2228 | |
| CCCc1c(nco1)N,0.2088 | |
| N=C1CN=C(NC=O)N1,0.1973 | |
| COC1CC=CCC1=O,0.2146 | |
| NCC1(OCC=C1)C#N,0.2327 | |
| CC1(O)C2C3CN=C1N23,0.1913 | |
| CC1NC(=O)C1CO,0.2813 | |
| CNc1cn(cc1O)C,0.2252 | |
| N#CC1N2C3CC=C1C23,0.1704 | |
| CC1C2NC2(C=O)C1O,0.21 | |
| c1cc(n(c1N)C=O)O,0.16 | |
| COC(=O)C1C2CCC12,0.2673 | |
| Cn1ccc(n1)CC=O,0.2161 | |
| CCC1OC2CC(=O)C12,0.217 | |
| CC1C2CC1(C)C2C#N,0.3252 | |
| C(CO)NC(=O)C(=O)N,0.2109 | |
| OCC1CC(O)C1C#N,0.2981 | |
| N#CC12OCC3C1NC23,0.2712 | |
| c1c(c(c([nH]1)O)N)C#N,0.2005 | |
| CC1C2CC(=O)NC12C,0.2643 | |
| C1OC2C1C21COC1,0.3032 | |
| C1CC1C1C2OCOC12,0.3095 | |
| CC(O)(CO)C=O,0.2233 | |
| CC12CCC1CNC2=O,0.2691 | |
| OC1C2NC2C1C1CO1,0.3127 | |
| C1CC2C3C4C1C2CN34,0.3238 | |
| CNC(=O)n1ccnn1,0.2273 | |
| CC(=O)c1c([nH]cn1)N,0.1866 | |
| CC1OC11C2CC2C1O,0.3034 | |
| C1CC1(C(=O)C(=N)N)O,0.1765 | |
| NC(=O)C(O)CCC#C,0.2683 | |
| N#CC1CC23CC(O2)C13,0.2765 | |
| CN1CC1CC1CC1,0.3061 | |
| CC12C3C4C3C1(O)C24C,0.2761 | |
| N=COCC1OC1C#N,0.2541 | |
| COCC1(CC1)CC#N,0.2992 | |
| NC1(C=CNC1=N)C#N,0.2025 | |
| CC1CC2(COC2)C=C1,0.2567 | |
| CC12C3C4C1C4(C=O)C23,0.2079 | |
| CC12CC1NCC(=O)N2,0.2522 | |
| CC12C3C4C3C1C(O)C24,0.3083 | |
| c1c(nn[nH]1)NC=O,0.2264 | |
| Cn1c2ccoc2cn1,0.2113 | |
| C1CCC2(C1)COCO2,0.3279 | |
| O=CC1NCC11CCO1,0.2076 | |
| OC(C=O)C1=CC=CN1,0.1681 | |
| O=CCOC1CC2OC12,0.2269 | |
| CCC12CC(C1)CC2=O,0.226 | |
| C1CC1OC2COC2,0.32 | |
| CC1CCCOC(C)C1,0.3211 | |
| CC12CC(C1)C2NC=O,0.2743 | |
| CN1C2C3CC1C23C#N,0.2459 | |
| OC1(CC1NC=O)C#C,0.2586 | |
| COC1OC(=O)C2CC12,0.2741 | |
| CN=C1C(=O)CC=CN1,0.1588 | |
| CCC1CC=CC11CO1,0.251 | |
| CC12CC3CC(C1)C3C2,0.349 | |
| COC(CO)C(C)=O,0.2198 | |
| N=C1OCC1CCC#C,0.2801 | |
| CC1C=CC(C=O)C1O,0.2093 | |
| CC1C(O)CC1(C)CO,0.316 | |
| CC1(C(=O)C=CN1)C,0.1902 | |
| CC12OC1C1OCOC21,0.2999 | |
| CC(O)C(C#C)C(C)O,0.2928 | |
| CCC1(NC1C)C(C)O,0.2947 | |
| N=C1OC2C(NC12)C#C,0.2499 | |
| O=CN1C2C=CC1C=C2,0.1956 | |
| CC(C)CC1(CC1)C#C,0.2947 | |
| CCc1c(c(c[nH]1)N)C,0.2242 | |
| CC1CN(C=O)C=C1,0.2085 | |
| [NH3+]CCC1=CC=C([O-])O1,0.1632 | |
| CC1CC(C=O)C1C=O,0.2043 | |
| CN(CCN1CC1)C=O,0.2694 | |
| CC1CC11OC2CC1C2,0.3077 | |
| CC12C3CC1CC=CC23,0.2455 | |
| CC12CCC1=CC(=O)C2,0.1932 | |
| CC(C#C)C(CO)CO,0.2976 | |
| OC1C(O)C2=CCCC12,0.2397 | |
| O=C(CC#C)CC1CN1,0.2171 | |
| CCC(=O)n1cncn1,0.2271 | |
| CC12C3CC1=CC1C3N21,0.1751 | |
| C1OC11CC2C3OC1C23,0.2993 | |
| C1CC2CCC1CCO2,0.304 | |
| O=C1CC2COC1C=C2,0.1995 | |
| CCCC(CC#C)OC,0.2897 | |
| OC1CC11OCC11CN1,0.285 | |
| c1cc(cnc1)N2CC2,0.2 | |
| NC12CC(OC1)C2C#N,0.276 | |
| CC1OC2C3C2N2C3C12,0.2753 | |
| OC1COC2OCC=C12,0.243 | |
| CC1C2C(O)C3N2C13C,0.302 | |
| CC(O)C(C)OCC#C,0.2821 | |
| C1OC2COCC=C12,0.2496 | |
| CC1C(=O)CC=C1C#N,0.2065 | |
| CCC1C=CCNC1=O,0.251 | |
| OC1C2CC3(CC3)CC12,0.3077 | |
| CC1C2CC(N2C)C1=O,0.208 | |
| NC1(C#N)C2C3CC2C13,0.2947 | |
| CC1C(C)C11CCC1O,0.3184 | |
| c1c2c(co1)OCC2,0.2261 | |
| CC1C=CNC(=N)C1=O,0.1606 | |
| CC(C(C)=O)C1(C)CN1,0.2247 | |
| CC12CC1CC2(C)C#C,0.2995 | |
| CN1CC11CCC1(C)C,0.3061 | |
| CCOCC(=O)C#N,0.1977 | |
| Cc1cnn(n1)C(=O)C,0.2188 | |
| OCC12CC(N1)C21CO1,0.3027 | |
| CCC1(CN1)C#CC,0.2821 | |
| C1C2CC11OCOC1C2,0.3373 | |
| c1cncncc1=O,0.1579 | |
| CC12CN(C1)C2C=O,0.2021 | |
| CC(=O)C1CCCOC1,0.223 | |
| O=C1C2C=CC3CN1C23,0.2168 | |
| CC1CC2CC(C#C)C12,0.2952 | |
| OC1C2CCC1C(=O)O2,0.2754 | |
| CC(=N)Nc1cnco1,0.2139 | |
| c1cnc(nc1)N=CN,0.1928 | |
| C#CC1C2CC1C=C2,0.2307 | |
| CCCOC1CC1(C)C,0.3304 | |
| C#CC(C1CN1)N1CC1,0.2736 | |
| O=C1NC2=CCN3C1C23,0.19 | |
| CC1(C)C2CN2C1C#N,0.2624 | |
| CC1(CCC=C1)NC=O,0.2642 | |
| CC(C)CC#CCC=O,0.2186 | |
| NC12C3C1C1=NC2CN31,0.1599 | |
| CC(O)(C=O)C#CC#N,0.2001 | |
| CC(CCO)C=O,0.2273 | |
| CC#CC#CCC=O,0.2006 | |
| CC1C2C(C1=O)C2(C)O,0.2238 | |
| CCOCC1CO1,0.3407 | |
| CC1CC2CC(CO2)O1,0.3199 | |
| CC(O)CCC1(O)CC1,0.3221 | |
| O=CC(=O)C12CN(C1)C2,0.1257 | |
| C1CCOCCOCC1,0.3148 | |
| O=C1NC2CC=CCC12,0.254 | |
| CC1(CO1)C1C2CCC12,0.3289 | |
| C(=O)n1c(nc(n1)O)N,0.1931 | |
| COCC(=O)CCCO,0.2352 | |
| CNC1(C)CC1(O)C#N,0.2403 | |
| O=C(C#N)C1COC=N1,0.1796 | |
| OC12CC3(C#C)C1CC23,0.2871 | |
| C1C=CC=CCOC1=O,0.1927 | |
| COCC(C)OC,0.3385 | |
| COC1(C)C2NC2C1O,0.3029 | |
| CC1(CC=CCCO1)C,0.2455 | |
| Cc1c(=O)cc([nH]n1)N,0.1916 | |
| Cc1cccc(c1)CO,0.234 | |
| c1cn2c(cnc2[nH]1)O,0.213 | |
| C1CC(C1)(C(F)(F)F)O,0.3527 | |
| CC(=N)OC1C2CC1O2,0.2771 | |
| O=CC12CC3OC1C2O3,0.2236 | |
| CC12C3CC(C13)C2=NO,0.2528 | |
| OC1C(=O)CNC11CC1,0.2014 | |
| Cc1c(c(no1)N)NC,0.2349 | |
| CNC(=O)CC(O)C=O,0.1936 | |
| N#CC12CC3C=CC1C23,0.2294 | |
| C1C2C3OC4CCN2C134,0.1689 | |
| CC(O)C(=O)N1CC1,0.2462 | |
| N=C1CC2CC2O1,0.274 | |
| C1CC1C12COCC1O2,0.3363 | |
| Cn1cnc(n1)NC=N,0.2189 | |
| CC1C2COC(=O)C12,0.2716 | |
| CC1OC(C#C)C(=O)O1,0.265 | |
| CC1=NC=NNC1=N,0.1611 | |
| CCC1CCC(C=O)=C1,0.1934 | |
| C1Cc2nc(nn2C1)O,0.2441 | |
| CNC(=O)N(C)C=NC,0.2455 | |
| Cc1c(c(=O)cco1)O,0.1842 | |
| CC(=O)C12CC(=O)C1O2,0.2007 | |
| OC12CCC1(O)CCC2,0.3115 | |
| CCC1OC(OC)C=C1,0.2598 | |
| CCn1cc(nn1)O,0.2265 | |
| COC1C2CC(C)=CC12,0.2384 | |
| O=C1CC(N1)C1CCC1,0.2853 | |
| ON=C1CC=CC(O)C1,0.251 | |
| CC1C(C)C(C#C)C1O,0.2871 | |
| COC1CCC(=N)OC1,0.2736 | |
| CC1(C2(COC2)CO1)C,0.3069 | |
| C[NH2+]C(C1CO1)C([O-])=O,0.2644 | |
| CC1OCC2OCOC12,0.3147 | |
| CC(CC#N)C#CC#C,0.2294 | |
| C1OC11CC2CC2C=C1,0.2386 | |
| C1COCCC1=O,0.2243 | |
| CN1C2C3(C)CC1C23O,0.2757 | |
| OC1(CC1)C(=O)C1CO1,0.2098 | |
| N=COCC(C=O)C#C,0.2245 | |
| OC12C3C4C3N(C14)C2=O,0.2229 | |
| OCC12C(O)C1C1NC21,0.275 | |
| CC1CC11NC(=O)C1O,0.2636 | |
| CC(=O)C12CC3C1CN23,0.2123 | |
| ON=C1CC=C2CNC12,0.2282 | |
| C#Cc1cnccn1,0.191 | |
| C1OC23COC(CC12)C3,0.3145 | |
| O=CC1CN2C=CN=C12,0.1869 | |
| CC1CCOC(=N)CC1,0.2702 | |
| OC1CC=CC2NC12,0.24 | |
| CC(C)C#CC1CC1O,0.2796 | |
| CC12OC1CCC2C#N,0.3073 | |
| CN(C)C(CCO)C=O,0.179 | |
| CCCC1OC1CCO,0.3378 | |
| CC1(CC(C1)C=O)C#N,0.2221 | |
| CCCC1(O)COC1=O,0.2608 | |
| N=C1OCC=C1C1CO1,0.2133 | |
| COC1(C)COC1=O,0.2537 | |
| CC1(O)CCN2CC12,0.2946 | |
| Cn1nc2c(n1)CCC2,0.2334 | |
| CCc1nc([nH]n1)C,0.2618 | |
| NC(=O)C1CN=CO1,0.2595 | |
| CCN1CC1C1CC1O,0.2905 | |
| CC(=O)Cc1ncon1,0.2298 | |
| CCCC12OC1CC2C,0.322 | |
| CC12C3C1C1=CCN2C31,0.1568 | |
| CCOCC(=O)C(=O)N,0.1787 | |
| CCC1C2C(=O)NC12C,0.2519 | |
| C1CC=C(COC1)C=O,0.1887 | |
| c1nc(c(o1)C#N)C=O,0.1774 | |
| CC1COC1=N,0.2899 | |
| CCC1C2N3CC1C23C,0.3132 | |
| O=CC12CC3OC3C1O2,0.2173 | |
| C[NH2+]C1(CC1N)C([O-])=O,0.2539 | |
| N=C1N=NOC(=N1)C#N,0.2041 | |
| NCC1(CN1C=O)C#N,0.2409 | |
| N#CCNC1C2COC12,0.2554 | |
| OC1C2CC2NC1=O,0.2557 | |
| NC1(CC1OC=O)C#N,0.2431 | |
| CC(OC1CCC1)C#C,0.2876 | |
| C#CC1OC2C3NC3C12,0.2528 | |
| CC1C(O)CC1(C)C#C,0.3029 | |
| c1c2c([nH]c1N)nn[nH]2,0.1951 | |
| CC1(CCC1)CCC#N,0.3357 | |
| OC(C#N)C1CCOC1,0.2747 | |
| Cc1ncc(c(n1)O)F,0.2195 | |
| CC1(C)CC2OC2C1=O,0.2084 | |
| c1cncc(cc1=O)O,0.147 | |
| CN=COc1[nH]ccn1,0.2243 | |
| C1CC23CC1OCC2N3,0.3131 | |
| c1c(c[nH]c1O)CO,0.2404 | |
| CC(=O)C1OC1CC#C,0.2212 | |
| NC1=NC(COC1)C#N,0.2508 | |
| N=C1CN=CN1,0.2275 | |
| CCc1c(cc([nH]1)C)O,0.2205 | |
| C1C(CN1CC#N)C#N,0.266 | |
| OC1CCC(=O)OC1=N,0.2538 | |
| CC1C2CC(C#C)N12,0.26 | |
| CC1C2CCC3OC2C13,0.3083 | |
| c1c[nH]c(c1C(=O)N)O,0.2009 | |
| CCc1[nH]c(c(n1)N)O,0.2308 | |
| CC1CC2C3OC3C=C12,0.2366 | |
| CC1(CN1)C#CCC=O,0.2178 | |
| c1cc2c(nc1)CCO2,0.1981 | |
| C1CN2C3C4OC3C1C24,0.2967 | |
| CN(C=N)C(=O)CC=O,0.223 | |
| CCC1CN2N=CC=C12,0.2656 | |
| CN=COC(C)CCO,0.2724 | |
| OCC12CC1C(O)CO2,0.2978 | |
| COc1cncnc1,0.2074 | |
| CC1(C)C(CO)C1C#C,0.2862 | |
| C1C(=NO)C=CC(=O)N1,0.1737 | |
| CC1C2CCC2=CC1=O,0.1928 | |
| O=CNC12CC(C1)CC2,0.2756 | |
| CC#CCC#CC#C,0.2284 | |
| CC(=O)n1cccn1,0.2189 | |
| O=C1CCCCC1C#N,0.2203 | |
| C1C(CC1=O)CO,0.2227 | |
| CC1(C)CC2C(O)C2C1,0.3155 | |
| COC1C=CCC1(C)C,0.2621 | |
| ON=C1C2CC=CC1O2,0.2347 | |
| CN1CC11CCNC1=O,0.25 | |
| OC1(CC1)C(C#C)C#N,0.2796 | |
| CCC(=O)C(C#C)C#N,0.2312 | |
| CC(=N)Nc1cnon1,0.2072 | |
| COC1(CO)C2CC1N2,0.2759 | |
| N=C1OCC1(C=O)C=O,0.2122 | |
| CC(CO)C#CC=O,0.2051 | |
| CC1N(C)C2C(O)C12O,0.2562 | |
| CN1CC23CC(C12)N3C,0.2752 | |
| C1CC11C2C3N2CC=C13,0.1615 | |
| OC12C3CN4C(CC14)C23,0.3041 | |
| CCC(C#N)C(N)=O,0.2769 | |
| CN1CC(O)C11CC1O,0.2674 | |
| CC1CC2(CC2)C11CO1,0.3237 | |
| CCC#CC1CCCC1,0.2967 | |
| CCOCC1(CN1)C=O,0.2206 | |
| CC1(CO)C2CC1C=C2,0.2319 | |
| CNc1cocnc1=O,0.1743 | |
| CC12OCCC11CC2C1,0.3282 | |
| CC(C)C1(O)CC2CC12,0.3107 | |
| O=C1C2C3CN1C23,0.2453 | |
| CC1C=C2CC3(O)C1C23,0.1759 | |
| CN=C1NC(C)=NC1C,0.224 | |
| CC1CC(=O)C(=C1)C#C,0.1859 | |
| OC1(CC1OC=N)C=O,0.2067 | |
| CC(CC#N)C1CC1,0.3287 | |
| O=CC1=C2NC3C(C1)C23,0.1426 | |
| Cn1cc(c(n1)O)C#C,0.2143 | |
| CC(=O)C1C2COC12C,0.2172 | |
| CC1NC(=O)OCC1O,0.3028 | |
| CCC(O)C1OC1C=O,0.2234 | |
| Cc1cc(ncc1F)N,0.1915 | |
| NC(=O)CC1CO1,0.2707 | |
| Cc1ccc(nc1F)O,0.2084 | |
| C(C(=O)N)C(=O)N,0.2536 | |
| CCC1C(C)C1C1CO1,0.3341 | |
| O=C1NC23CC(C2)C13,0.2497 | |
| C1CC23COCC2C1O3,0.3201 | |
| CC#Cc1nc(no1)O,0.1997 | |
| CCCC(C)C1CC1,0.3619 | |
| CC1CC(CC#N)C1,0.3364 | |
| CC1N2C=NCC12CO,0.2395 | |
| CC1(CCCC(=O)C1)C,0.2237 | |
| CN1C2C3C2C1C3C=O,0.2056 | |
| c1coc(c1N)NC=O,0.1834 | |
| OC1C2C3(CO3)CC12O,0.3081 | |
| CCCC(C)C(C)CC,0.3749 | |
| c1nc(on1)OCC=O,0.2232 | |
| OCC(NCC=O)C#N,0.2192 | |
| CNc1cc(=O)cno1,0.1777 | |
| CC1OCC(C)=C1C#C,0.2037 | |
| CCC1C=CC2NC12,0.2438 | |
| NC(=O)C1C=CCC1=O,0.2096 | |
| CC1=C(COC1=O)CO,0.2305 | |
| COc1c(cncn1)O,0.2103 | |
| C1CC1NC(=O)NC=N,0.2541 | |
| C1C2OC3COC1C2O3,0.3033 | |
| c1c2c(n[nH]1)COC2,0.2436 | |
| C#CCCc1ccco1,0.2334 | |
| c1c(c(=O)c(c[nH]1)F)N,0.1753 | |
| NC1=NCC(=O)OC1=N,0.1943 | |
| CN1CC2OC(=N)CC12,0.2569 | |
| Cc1ncc(nn1)OC,0.1674 | |
| CC1(C=O)C2C(O)CN12,0.2221 | |
| CC#CC(O)CC#N,0.2854 | |
| NC(C#N)C1=NON=C1,0.2212 | |
| OCC1C2C3C(O)C2N13,0.3088 | |
| CC1=CNC(=O)N2CC12,0.2076 | |
| CC1=CC2C3OC2C13C,0.2233 | |
| COCC#CC(=O)C#C,0.1914 | |
| OC(CC(O)C#C)C=O,0.2049 | |
| CN=C1CN=C(N1)OC,0.2354 | |
| CC1CC(=O)OC1(C)C,0.2775 | |
| CC1OC2CC(=N)OC12,0.2836 | |
| C(c1c(onn1)C#N)O,0.2049 | |
| N=COC1COC11CC1,0.2561 | |
| C1C=C(CO1)CNC=O,0.2398 | |
| CC1CC(C)CC(O)C1,0.3352 | |
| C1CC2C3COCC23C1,0.3345 | |
| OCC1CC1COC=O,0.2811 | |
| CC1CCC2CC12C#C,0.2878 | |
| CCOCC12CC(C1)O2,0.3081 | |
| OC1CC23CC(CC2)C13,0.2909 | |
| CC(CCO)C(O)C=O,0.229 | |
| CC(C(C)=O)C(F)(F)F,0.2305 | |
| COC(=O)NC=N,0.254 | |
| COC(=O)CCCC=O,0.229 | |
| CC(C#CC#C)C(N)=O,0.2172 | |
| OC1CN(C1)C(=N)C#N,0.2003 | |
| CCC(C)C(C)C(C)=O,0.2297 | |
| CC(CC(C)=NO)C#C,0.2516 | |
| CC12C3CC1C(=O)CN23,0.2166 | |
| CC(=O)C(C#N)C(N)=O,0.211 | |
| O=C1C=CON=N1,0.2023 | |
| CC(CCC1CC1)C#C,0.3139 | |
| C1CC2OC2CO1,0.3333 | |
| O=CNC1C2CC2C1=O,0.2175 | |
| OC1CC2COCC=C12,0.2511 | |
| C#CC1=CCC2COC12,0.2086 | |
| CCN=C(C#N)N,0.219 | |
| CC1CC(O)C=C1,0.26 | |
| C1CC2COCCCC12,0.3203 | |
| C1C2C=CC3CCC12O3,0.2278 | |
| OC12C3NC1COC23,0.2751 | |
| CN1CC23CC(O)(C2)C13,0.285 | |
| COC12CC1OC1CC21,0.3022 | |
| CN1C(CN=C1N)C#N,0.2363 | |
| CN=CN(C=N)C(=O)N,0.2289 | |
| CC(C)C#CCN1CC1,0.2761 | |
| Cn1cc(cc1O)N,0.2297 | |
| CC1CC11OC2CC12,0.3039 | |
| CC12CC1CC2O,0.3219 | |
| CC12OCC1CC=C2,0.2512 | |
| CN(C=O)C(=O)CC#N,0.2281 | |
| CC(=O)C1(C)C(O)C1O,0.221 | |
| OC1C2C1C1CCC2C1,0.3108 | |
| NC=[NH+]C1=N[N-]C(=N)O1,0.0821 | |
| C#CC1CCC2CC12,0.3108 | |
| CC12OC(=N)C3C1OC23,0.2591 | |
| CN1C2C(=O)C1C21CN1,0.2318 | |
| O=CC1CC1CCC#N,0.2281 | |
| O=CC1CC2OCC12,0.2162 | |
| CC1CC2NC2C11CO1,0.3079 | |
| CCCNC(=O)CO,0.2718 | |
| COCC1=CCC(=O)C1,0.225 | |
| C(C=O)NCC(=O)CO,0.2092 | |
| OCC1(CC(O)C1)C=O,0.2219 | |
| CN=C1NN=NC(N)=N1,0.1548 | |
| OC1CC2(CN2)CC1O,0.3105 | |
| OC12CC(C1)C2(O)C=O,0.2087 | |
| NCC(O)(C#N)C(N)=N,0.2377 | |
| CN=C1N=CN(C)C=N1,0.1802 | |
| Cn1ccc(n1)C2CC2,0.2471 | |
| c1(c(oc(=O)[nH]1)N)N,0.2392 | |
| C#CCCCCCC#C,0.3091 | |
| C1CC12CCN2C(=O)N,0.2723 | |
| COC(C=O)C#CC#N,0.2035 | |
| c1cc(nc(c1)O)O,0.2072 | |
| CN1CC1C1OC1C#N,0.224 | |
| CC1(O)CC1(O)CC#N,0.2942 | |
| CC1CC1(O)COC=N,0.2394 | |
| COC(C)C(C)(C)C#C,0.3068 | |
| Cc1c(onc1C=O)C,0.1928 | |
| C1C2C3CN2CCN13,0.2838 | |
| COCC1CC(O)C1=O,0.2222 | |
| OC1CC1(O)CN1CC1,0.3059 | |
| C#CC12CC1COC2,0.2882 | |
| C1CC23C4C5C4C12CC35,0.2857 | |
| CCC12CC(OC1)C2O,0.3178 | |
| CCC1=CC2OCC1O2,0.2416 | |
| O=CC12CCC3C1CN23,0.2042 | |
| CCc1c(onn1)CC,0.2249 | |
| C1CC(=O)CNCC=C1,0.1955 | |
| Cc1cn(cc1CO)C,0.2455 | |
| CCCCCC(=O)C#N,0.2108 | |
| C1CC2OCCC2O1,0.3247 | |
| NC(=O)C(=N)N1CCC1,0.2037 | |
| CCOC(=N)C#CC,0.2369 | |
| c1cnc[nH]1,0.2585 | |
| OC12CN3CC(OC1)C23,0.2739 | |
| CCC#CCC#C,0.2901 | |
| CCC1OC1(C)C(C)C,0.3338 | |
| CC1C(O)C1(C)CO,0.3117 | |
| CC1CC=CCN1C=O,0.2533 | |
| CN1C2C3C4OC4C2C13,0.2839 | |
| COC1CC2(C1)CCC2,0.3285 | |
| CC1OCC2C3CC3C12,0.3114 | |
| OC1=C(NC=N1)OC=N,0.2125 | |
| CC1(CCO)CCCO1,0.3182 | |
| CN1CC1C(O)CO,0.2907 | |
| CCC1COCCC1O,0.3022 | |
| Cc1nc(oc(=O)n1)O,0.2162 | |
| CCn1ccnc1,0.2538 | |
| CN1C(=O)C2(C)CC12C,0.2457 | |
| CC1C2CCC=C(C)C12,0.2474 | |
| C1C2C1C1OCC2C=C1,0.2453 | |
| N#CC12C3OC1C1C3N21,0.257 | |
| NC(CO)C(C#C)C#N,0.2712 | |
| CN1CC1(C)CC#C,0.2794 | |
| N=C1ON=NC=C1C#C,0.1473 | |
| O=CC1OC1C1CN1,0.2129 | |
| ON=C1CCC(=O)C1O,0.2135 | |
| c1c(c(c([nH]1)N)C#N)O,0.2001 | |
| OC1CC2OC(=N)C2C1,0.2881 | |
| CCOC1=NC2CC2C1,0.2592 | |
| OCC1=CC2CN2C1,0.2315 | |
| CC1(O)CC(=O)C11CO1,0.204 | |
| OCCC(CO)C1CN1,0.3033 | |
| CC1=CC2CC1C21CO1,0.239 | |
| C1CN2C3C4C3C(=C1)C24,0.1939 | |
| CCC12NC1C(O)C2C,0.2991 | |
| N=C1NC(=O)CC1C=O,0.2225 | |
| C1COC(=N1)C(F)(F)F,0.2591 | |
| c1cncc(=O)[nH]c1=O,0.1504 | |
| OC1CC(O)(C1)C=O,0.2242 | |
| CCCC12CC1(O)CO2,0.2988 | |
| OC1C2C(C#C)C1C2=O,0.2355 | |
| CCC1(OCCO1)CO,0.3116 | |
| CC1(COCCO)CN1,0.317 | |
| CC12COC11CC2CC1,0.293 | |
| OCC12CC1(CO2)C=O,0.2161 | |
| CCNC(=N)C(O)C#N,0.2261 | |
| CCC(C#N)C1CO1,0.3116 | |
| OCC12CC(C1)C1CN21,0.3039 | |
| CC12CC(O)C1(C)CO2,0.2995 | |
| C#CC1(COC1)NC=O,0.2638 | |
| O1C2C3OC=NC2C13,0.24 | |
| CCCOC1COC1=O,0.2515 | |
| CCC(=O)C#CCC#C,0.2088 | |
| CC1C(=O)NC=C1C=O,0.1811 | |
| CCC1OCC(=O)C1O,0.2203 | |
| OC1COC2CC1C2=O,0.1995 | |
| COC12CC3(O)C1OC23,0.292 | |
| CC(C=O)C1=NNN=C1,0.2206 | |
| CC12NC1CC2=O,0.2212 | |
| CNC(=O)C1CC1O,0.2541 | |
| COCCN=C1CCO1,0.273 | |
| CC1(CCC2CC12)C#C,0.3142 | |
| CCC(=O)C1CC1CO,0.2297 | |
| COC1CC2(C)CC1C2,0.3324 | |
| COc1cncnc1O,0.2102 | |
| CCC(=O)C#CC=O,0.1952 | |
| CC(=O)N(C)C=N,0.235 | |
| CCC(C)C(C)COC,0.335 | |
| OC1C2C3CC=CC2C13,0.2478 | |
| OC1CNC1=NCC#N,0.258 | |
| CC1=C(C(=O)NC1=O)C,0.1825 | |
| CCc1coc(=O)[nH]1,0.2398 | |
| COCC1NCC1C#N,0.2675 | |
| c1ccn2cccc2c1,0.164 | |
| CC1=CCC(=O)C2CC12,0.2134 | |
| CN1C2C3CC3(C#C)C12,0.2722 | |
| CCOC1C(C)CC1=O,0.2012 | |
| CC(C)N1CC(=O)C1C,0.2076 | |
| O=C1C2C3C1C(C#C)N23,0.2232 | |
| C(C=O)N=CNC(=O)N,0.2188 | |
| CC12CCC1(O)C1OC21,0.318 | |
| COCC1C2CCC12O,0.3244 | |
| O=C1OC23CC(C2)OC13,0.2476 | |
| O=C1CC(OC1=O)C#C,0.1721 | |
| CNC(C#N)C(N)=O,0.2374 | |
| OCC12CCC3CC1N23,0.3199 | |
| OC12CC(C1)C1CC2C1,0.3287 | |
| OC12C3OCC1C(=O)C23,0.2335 | |
| C1CC1CCCCC=O,0.2286 | |
| CC1OC2CC1C2=NO,0.2455 | |
| CCOCC1(CC1)C=O,0.2269 | |
| CC(C#N)C1(C)CC1O,0.3125 | |
| CC1C2NC2(C)C1O,0.305 | |
| CCC1C2OC(=O)C12O,0.2485 | |
| OCC1CC23CN(C2)C13,0.2589 | |
| CNC(=N)N(C=N)C=O,0.2089 | |
| CC1C2CC(=O)C1(C)O2,0.2112 | |
| Cn1nc(nn1)O,0.2352 | |
| OC1CC1C(=N)NC=O,0.203 | |
| CC12CCCC1OC2=O,0.2791 | |
| OCC(O)C1CC1C=O,0.2304 | |
| CC12CN(C1)CC2=O,0.2055 | |
| C1CC2CCC3C1C3C2,0.3229 | |
| N=C1NC=CC1=O,0.1557 | |
| CC1CN(C1)CCC#N,0.267 | |
| CCC12NC3C1OC23C,0.2983 | |
| CCC(C#C)(C#C)O,0.2785 | |
| CC1CCCC(=C1)C#C,0.2112 | |
| COC(C)C1C(O)C1O,0.2923 | |
| C1CC12CC=CCO2,0.266 | |
| O=C1OC23CC(OC2)C13,0.2501 | |
| CC12CC3(CC(O)C13)C2,0.2898 | |
| CC12C=CC3C(C=C1)C23,0.233 | |
| CCCCN(CC)C=O,0.2705 | |
| CC1(CO1)C(=O)N1CC1,0.2366 | |
| ON=C1C2CC1C1NC21,0.2586 | |
| C#CCC1CN1CC#N,0.2691 | |
| NC(=O)C(NC=O)C=O,0.2112 | |
| OCCN1C2CCC12,0.33 | |
| OC12C3CC1OC2=NC3,0.202 | |
| ON=C1C2C3C2N2C3C12,0.233 | |
| C(C=O)N=C(C#N)N,0.2065 | |
| c1cc(c(=O)[nH]c1)N,0.1692 | |
| COC1CC1C(O)C#N,0.2715 | |
| CC1CC1C1=NOC=C1,0.2464 | |
| CC1C=CC2(NC12)C=O,0.2168 | |
| CC1(C)CC(CC#C)O1,0.2943 | |
| CC1=C(CCOC1=O)N,0.2026 | |
| CN(C)c1[nH]c(=O)on1,0.2515 | |
| Cn1c(=O)c(=O)ocn1,0.1881 | |
| COc1cnc(cn1)N,0.167 | |
| C1C2C3OC=NC3CN12,0.253 | |
| CC#CC(O)CC(C)=O,0.2261 | |
| CC1NC1(C=O)C1CO1,0.2192 | |
| CC1C(C#N)C2CC12O,0.2979 | |
| OC1CC2CC(=O)C12O,0.2219 | |
| CC12OC1C(=O)C2CO,0.2103 | |
| OCC(O)(C=O)C#C,0.2036 | |
| OCCC1(O)C2CC1O2,0.3247 | |
| CC#CC#CCC(C)C,0.2262 | |
| CCc1c([nH]nc1N)C,0.2331 | |
| CCC1=NC(=N)C=NO1,0.1951 | |
| CC1C(O)C1C(C)=NO,0.2277 | |
| N#CC1CN1C1CCC1,0.2677 | |
| N#CC12CC1C1CC1N2,0.2609 | |
| CC(C)C12CC1CC2C,0.3206 | |
| CC12C3C(O)C1C3C2=O,0.248 | |
| CNC(=O)C1C(C)C1O,0.2494 | |
| OCC(O)CC(F)(F)F,0.3228 | |
| C(C(=O)N(C=N)C=O)O,0.2193 | |
| CC1CCC(O)C1C#N,0.2977 | |
| CC1OCC2NC12C#N,0.2709 | |
| CC1C2C1C1(O)CCC21,0.2962 | |
| CC12CCC(CO1)C=C2,0.2493 | |
| CCC(=NO)C(C)C#N,0.2535 | |
| O=C1C=CC2OC2C1=O,0.1418 | |
| CC(=O)C(=N)NCC#C,0.1919 | |
| N#CC1=CCCC11CN1,0.1977 | |
| CN1C2C3CC1C(=O)C23,0.2036 | |
| NC1(CNC11CC1)C#N,0.2545 | |
| CN1C2C3C2(C)CC13C,0.2909 | |
| COc1c(n[nH]n1)O,0.2205 | |
| CC12CC3OC1C23,0.3064 | |
| C#CC(=O)n1nnnn1,0.2001 | |
| CNC(=O)C1CCC=C1,0.2484 | |
| CC1CC(=O)C(=N)N1C,0.1682 | |
| OC1CCC(C=O)=C1,0.1914 | |
| CC1CC2C(C3CN3)N12,0.3017 | |
| c1c[nH]cc1C2COC2,0.2431 | |
| CC(=NO)C1CC2NC12,0.2429 | |
| CN=C1CC(CO)O1,0.2784 | |
| O=C1C2CNC11COC21,0.2139 | |
| CN(C)Cc1ncco1,0.2195 | |
| CC1C2OC1C2CC#C,0.2903 | |
| N=CN1C=NCC1C#C,0.2143 | |
| CC(C)C1CC(=O)C1O,0.2235 | |
| C1NC1C1=NC=CN=N1,0.164 | |
| OC1COC1C#CC#C,0.216 | |
| CC(C)(CC#C)C#C,0.2952 | |
| CCC1(O)C2NC2C1C,0.3018 | |
| CC1CC2OC2C11CO1,0.3276 | |
| Cc1c[nH]c(c1C#C)N,0.2075 | |
| CCC#CC=O,0.2053 | |
| CC1(CC=O)C(O)C1O,0.2184 | |
| CC1=C(O)N=CNC1=N,0.1748 | |
| CC1CCC1CCC#C,0.3138 | |
| CCC1CC2(O)C(O)C12,0.3011 | |
| CC1CC2=CON=C2C1,0.2426 | |
| CC(=O)C1CC1(O)C#C,0.2034 | |
| C1CNC=C1C(=O)N,0.1933 | |
| CC1CC2C3C(O)C1N23,0.2924 | |
| CC1(CC2CC12)OC=N,0.2775 | |
| O=CC1COC(O1)C#N,0.2247 | |
| CC(=O)C1(C)C2CC1C2,0.2255 | |
| c1cnc([nH]1)CC2CC2,0.2497 | |
| NCC1(NC1CO)C#N,0.2685 | |
| C1C(=C(CO1)N)C(=O)N,0.1982 | |
| CCn1c(nc(n1)C)C,0.2575 | |
| CCC1NC1(C)C#N,0.2848 | |
| CC1(COC1(C)C)C,0.3116 | |
| C1OCC2C3OC3C12,0.3124 | |
| O=C1NC2COCCC12,0.275 | |
| COC(C)CO,0.3335 | |
| CNc1c([nH]nn1)C#N,0.1767 | |
| OC1CC1C1=NOC=N1,0.2121 | |
| N#CC12CC1COC=N2,0.2484 | |
| c1c(c(nc(n1)F)O)F,0.2157 | |
| C1NC11C2C3CCN2C13,0.3151 | |
| Cc1c([nH]cn1)CC#N,0.2437 | |
| c1coc2c1cc([nH]2)N,0.2133 | |
| Cn1ncc(n1)CC=O,0.2166 | |
| CN=C(N)C(=O)C1CN1,0.1831 | |
| C[NH2+]CC1=COC([O-])=C1,0.2233 | |
| CC1=CC(=CO1)C1CO1,0.2305 | |
| O=CNC1C2CCC12,0.2727 | |
| CC(C)N(C)C(=N)C=O,0.159 | |
| N=C1CCC2NC2CO1,0.2739 | |
| c1c(onn1)N2CCC2,0.2055 | |
| CC(C)(C)COCCO,0.3288 | |
| COCC(COC)C#N,0.306 | |
| CCn1c(ncn1)OC,0.2599 | |
| CC1C2(C)C3CC2C13C,0.3602 | |
| CCC1(CO1)C(=O)OC,0.2594 | |
| CN1C2CC1(C=O)C=C2,0.1858 | |
| O=CC1(CC1)C1NC1,0.2221 | |
| OC1CN2C1COC2=O,0.2858 | |
| CC(CN1CC1)C#N,0.2904 | |
| N=C1OC=CC=NC1=O,0.1787 | |
| CN1C2CC(C)(C)C12C,0.3023 | |
| Cc1cc(on1)C(=O)N,0.2164 | |
| CC#CCC(O)CO,0.2982 | |
| CC12CN1C(=O)C2(C)O,0.2228 | |
| c1c(nno1)NCCO,0.189 | |
| CCC(=NO)CCC#C,0.2506 | |
| CC#CC12C3C4C(C13)N24,0.2379 | |
| c1c(cnc(n1)O)CO,0.2079 | |
| N#CC12C3C1N1CC2C31,0.2519 | |
| C1CC2OC2C2OC2C1,0.326 | |
| CCC(CO)(C#N)C#N,0.2975 | |
| O=CN1CC2OCC2=C1,0.1939 | |
| CN1CC1CC#CC=O,0.1769 | |
| CC1(C)C2CCCC12O,0.3061 | |
| CC#CC1C2CC(C)C12,0.2828 | |
| CN1CC1C1=NC=NO1,0.2119 | |
| OC1C=CC2C3CC12C3,0.2439 | |
| NC(=O)N1C2CC1C=C2,0.2273 | |
| CCC1NC(=O)C1C,0.2797 | |
| OC1CC(O)C2OCC12,0.3091 | |
| CCCC(CCO)C#N,0.3065 | |
| CC1(C)N2CC2C1=NO,0.2354 | |
| CC#CC(C#C)(C#C)O,0.2536 | |
| CCC(C=O)C(=O)OC,0.2272 | |
| CCC(CC)C1CCO1,0.3191 | |
| CC12CC3C1C1CC2N31,0.3046 | |
| C1C2CC34CC(C3)C4C12,0.3405 | |
| CC1=CC2C3N2CC13C,0.2281 | |
| O=C1CN2CC1C(=O)C2,0.1791 | |
| O=C1CC2C=CC3C2C13,0.2184 | |
| C1OC2C1C=C1COC21,0.2364 | |
| CCN1CC(=O)NC1=N,0.2262 | |
| OC1CC1C#CC1CN1,0.2574 | |
| CC(=O)C1C2OC2C1O,0.2271 | |
| COC1CC2OC2C=C1,0.2434 | |
| c1c(c2c([nH]1)CCO2)O,0.2234 | |
| C#CC1C2CC1(O2)C#N,0.2546 | |
| N#CC1CC2(CN2)CN1,0.2749 | |
| OC1C2C3C1C1(CC1)N23,0.3027 | |
| CCC(C=O)C#CCO,0.2182 | |
| c1c[nH]ccc(=O)c1=O,0.1673 | |
| OC12CC1C1OCC1=C2,0.2291 | |
| CC1C2CC(N1C)C2=O,0.2002 | |
| CC1CC1OCC#C,0.2791 | |
| CC1CC(C)C(CO)C1,0.3388 | |
| CC1C2CC2COC1=O,0.2759 | |
| CN=C1C(C)N=CN1C,0.2149 | |
| CN1CC(=O)N(C1=O)C,0.2459 | |
| CC#CC(O)C1(C)CC1,0.2877 | |
| CC1(CC2CC12)OC=O,0.2755 | |
| Cc1c(occ1OC)C,0.231 | |
| OCC1NC1CC1CO1,0.3207 | |
| CC1(C)OCCC2NC12,0.3097 | |
| CC1C2OCC2C1C#N,0.2791 | |
| CC1N(C)C(=O)C=C1N,0.2148 | |
| CC1NC1C1=CC=CO1,0.2248 | |
| CCOC(=N)C1CN1C,0.2477 | |
| CC1=CC2(CCC2)CC1,0.2546 | |
| O=CC1C2CC1C=CC2,0.2134 | |
| CC1=CC(C=O)C2CC12,0.2128 | |
| C(CC(=O)NC=O)CO,0.2219 | |
| CC#CC1(C)CO1,0.2802 | |
| CC(C)C(O)C(=O)C#N,0.1852 | |
| N#CC1C2C3C2N2C3C12,0.2762 | |
| CC1OC(=N)C2(CC2)O1,0.267 | |
| CC1CC2CCOC12,0.3159 | |
| COCCNCC#N,0.271 | |
| OC1CC2CC3CC2C13,0.3302 | |
| CNC1=CC=NNC1=N,0.1679 | |
| C1C2N1CC1=C2NC=C1,0.2295 | |
| OC(CNC=O)C1CN1,0.2789 | |
| CC1CC(C1)C(F)(F)F,0.3912 | |
| CC1C2COC(=N)C1O2,0.266 | |
| OC1C2C3CC4C1C2C34,0.3103 | |
| CC1=CC2CC(=O)C1N2,0.2072 | |
| COC1COCC11CC1,0.3188 | |
| c12c(noc1nno2)N,0.1813 | |
| C#CC12CC1C1CC2O1,0.2791 | |
| CCC(C)(O)CN1CC1,0.2908 | |
| CC12C3OC1(C)C(O)C23,0.2892 | |
| CC12C3C4C3C1C4C2=O,0.2149 | |
| CC1(CO1)C(O)C=O,0.2236 | |
| CC(=O)C#CCOC=N,0.2067 | |
| CC(=NO)C1CC(=N)O1,0.252 | |
| CCC1NC1(C=O)C#C,0.2169 | |
| CCCC(O)C1(O)CC1,0.3167 | |
| CC1C2C(O)C2(O)C1O,0.2884 | |
| CC1C=CC(=O)C11CN1,0.183 | |
| CC1CC2OC(=O)C12O,0.2622 | |
| C1C2C3N=C4OC1C4C23,0.2066 | |
| N#CC12CC1C1CC2C1,0.2983 | |
| CNC1(C)C(O)C1C#N,0.2484 | |
| CCC12CC1(C)C(=O)O2,0.2723 | |
| c1cn2c(n1)OCC2,0.2429 | |
| C1OC1C1CC2CC12,0.3377 | |
| C1C2OC22CN=COC12,0.2707 | |
| CCOC1(C)COC1C,0.3178 | |
| C1CC1C1CC2(CO2)C1,0.3274 | |
| CC12CC1(OC2=O)C#C,0.2437 | |
| C1C=C2CN=C3OC1C23,0.2102 | |
| CC(O)C1COC1C#C,0.277 | |
| N#CCC12NC1C1OC21,0.2551 | |
| CCC(=O)NC(=N)N,0.2281 | |
| OC12CC1N(C=O)C2=O,0.219 | |
| COC=NCC1CC1O,0.2693 | |
| OC(CC#C)C1(O)CC1,0.2977 | |
| O=CC1C2OC3CN1C23,0.1931 | |
| CC12C3COC1C(O)C23,0.304 | |
| OC1COCC(C=O)=C1,0.1894 | |
| FC1=CC(F)=NC(=O)O1,0.1999 | |
| C1COCC(=CC1=O)N,0.1937 | |
| c1[nH]nc(n1)C#N,0.2445 | |
| CC(C)C1NC11COC1,0.2998 | |
| CN=C1NC(=O)NC=C1,0.1969 | |
| OC1CC11OCCC1=O,0.209 | |
| c1nc(on1)OC=O,0.2419 | |
| OCC12CC3C4C1C2N34,0.2857 | |
| COC12CC1(CO)CC2,0.3278 | |
| CC(C#N)C1(C)NC1C,0.2956 | |
| C1C2OC11CC=CC21,0.2356 | |
| CC1C2CC1(CO)CO2,0.297 | |
| C1CC1CN=COC=O,0.2385 | |
| Cc1c(con1)NC=N,0.2137 | |
| CCCc1ncnnn1,0.1622 | |
| CC(C)C#CC(C)C=O,0.2166 | |
| CCC(C)(C=O)C1CO1,0.2236 | |
| CC#CC(=O)C(=O)N,0.1628 | |
| CC1(C)CC1(O)C(N)=O,0.2637 | |
| c1cnn2c1NC(=O)C2,0.2093 | |
| CC(C)C1CC1C(C)C,0.3454 | |
| c1c2c(on1)C=CCN2,0.1657 | |
| CCCc1c([nH]cn1)C,0.2434 | |
| O=CNC1C2CCOC12,0.2671 | |
| CC(C)C12CC(C1)CC2,0.3599 | |
| N=C1OCCC1N1CC1,0.2648 | |
| COc1coc(c1N)O,0.2222 | |
| CC1CC11NCC1C#N,0.2531 | |
| CC1CC2CC(C)(C2)O1,0.3149 | |
| CC12OC3C(CC1=O)C23,0.214 | |
| C#CC#CCC1COC1,0.2297 | |
| CC12OC3(C#N)C1OC23,0.2529 | |
| CC1CC(C)C1CC#C,0.3129 | |
| CC12CCC(CC1)C=C2,0.2644 | |
| CC1CC(C)(O)C(=O)N1,0.2732 | |
| CCC1(CC1)C(C)C,0.3465 | |
| CC12CN1CC1(CO1)C2,0.3107 | |
| CCCC1(CC1)CCC,0.3399 | |
| CC1C2NC2C(C)C1O,0.3126 | |
| CC1OC11C2CC1(C)O2,0.3203 | |
| CCC1(O)CC1C(C)O,0.3179 | |
| O=C1CC(O1)(C#C)C#N,0.2565 | |
| COC1CC2NC2(C)C1,0.3048 | |
| CC(C)COCC(C)C,0.3347 | |
| O=CC1CC2(CN2)C1,0.2253 | |
| CC1C2C3C=CC2(C)C13,0.2249 | |
| Cc1c(n(nn1)C)O,0.2402 | |
| CC1C=CC(C=O)C1C,0.2095 | |
| c1c(c(on1)CCO)N,0.2066 | |
| C1CC1CCOC2CC2,0.3365 | |
| CCC#CC(O)C(C)O,0.2777 | |
| OC1CN2C(CC#N)C12,0.2844 | |
| Cc1cncc(c1O)O,0.2162 | |
| OC1C2COC22COC12,0.2899 | |
| O=C1NCCC11CN1,0.2686 | |
| CCC(C)(C=O)C#CC,0.2153 | |
| c1cn2cn[nH]c2n1,0.2113 | |
| C1C=CC2C3NC(=N1)C23,0.1888 | |
| CC1(OC2CCC12)C#C,0.279 | |
| ON=C1CCCC2CC12,0.242 | |
| CCC(O)COC=O,0.2853 | |
| CC1C2CN1CC(=O)O2,0.2323 | |
| CC(C#CC#C)C1CC1,0.2305 | |
| Cc1c[nH]c(nc1=O)C,0.2116 | |
| COC=NC1CCC1O,0.2517 | |
| OCC1NC(=O)C1O,0.2691 | |
| C1OC23C4CC2(C4)NC13,0.2633 | |
| C#CC1CNC(=N1)C#C,0.2033 | |
| CC1(O)C2NC1C2C=O,0.2199 | |
| Cn1cnc(n1)CC=O,0.2228 | |
| CN(CC(O)C#C)C=O,0.2582 | |
| CC1OC1CC(=O)C#N,0.1897 | |
| CC12CC(C1)N1CC21,0.3181 | |
| C#CC12CC1C1CCC21,0.2571 | |
| [NH3+]CC1=C([O-])C=NN1,0.2217 | |
| COc1ccc(cn1)F,0.1982 | |
| OC1CC(C#C)C11CC1,0.3017 | |
| CCC1(COC1)OCC,0.3204 | |
| CC(=O)Cc1[nH]ccn1,0.1843 | |
| c1c2cnncc2c[nH]1,0.1726 | |
| CN=COC1CC1C#C,0.2623 | |
| CC(O)C1OC1C1CO1,0.3303 | |
| C(CC(CO)CO)C=O,0.2284 | |
| CC1C2OC(C)C1C2O,0.2983 | |
| CC#CC(=O)NC(=N)N,0.1904 | |
| NC(=[NH2+])C1=COC(=O)[N-]1,0.1695 | |
| CCC(C#N)C(C)=NO,0.2539 | |
| CC1NC(=O)C2(C)NC12,0.2572 | |
| CC1=C(N)C(=N)NN=C1,0.1646 | |
| c1cc(oc1)CO,0.234 | |
| C1CC1(COC=O)O,0.2805 | |
| CCC(C)C1(CC)CO1,0.3355 | |
| O=C1OCC1NCC#C,0.2516 | |
| CC1COCCC1(C)C,0.3152 | |
| CC#CC#CCNC=O,0.2191 | |
| O=C1C2OCC11CCC21,0.2076 | |
| CC(=O)OCC(=O)OC,0.2827 | |
| Cc1nc2n(n1)C=CC2,0.2032 | |
| CC12CC1N1CC21C,0.2904 | |
| CCC(=O)C1C(C)C1C,0.2285 | |
| C1CC2C3COC2C1O3,0.3167 | |
| C#CCC1COCO1,0.304 | |
| O=C(C#N)C1CN=CO1,0.1779 | |
| OCC12N(C)C3C1OC23,0.2752 | |
| FC1=CC(=N)NN=C1,0.1608 | |
| CC1CC(C=O)=CN1,0.1796 | |
| OCCC(C=O)C#C,0.2205 | |
| C1CC(C1=O)(C#N)C#N,0.2158 | |
| OCC1C2CC1(O2)C#C,0.2534 | |
| CCC1=CC(C)OC1=N,0.2184 | |
| c1cc(oc1CCO)N,0.218 | |
| OCC(=O)C1CC=CC1,0.2239 | |
| O=C1OCC2CCCC12,0.2749 | |
| CNC(=O)C(=O)C1CO1,0.1696 | |
| C1CC2C3CCOC23C1,0.3081 | |
| CC12CCC(N1)C2C#N,0.2878 | |
| C1CC2(CC2)OCC=C1,0.2576 | |
| CC1(CC#N)NC1C#C,0.268 | |
| CC1=CC2OC1C(=O)O2,0.2259 | |
| CC1(CN1)C(=O)C(N)=O,0.1851 | |
| CC1(CCO)CC1CO,0.3324 | |
| CC12CC3OC1C3C2O,0.2996 | |
| OC1CC1C1=NC=NN1,0.2534 | |
| N#CC1C2C3CC3CN12,0.2471 | |
| CCc1cncn1C,0.2456 | |
| c1c(oc(=O)[nH]1)CCO,0.2367 | |
| [O-]C(=O)C1C[NH2+]C2CC12,0.2708 | |
| c1c(c(c(o1)N)O)N,0.2204 | |
| C1COC2(C1)CCOC2,0.3145 | |
| N=C1OC=C(O1)N(=O)=O,0.1559 | |
| O=C1NC2CCC2N1,0.3014 | |
| CNC(=O)OC1CC1,0.3124 | |
| O=CC1(CO1)C1CCO1,0.2131 | |
| C#CCC#C,0.2978 | |
| C#CC1CCC(N1)C#N,0.2713 | |
| C1NC1C1OC2CC1C2,0.3152 | |
| CC1OC23CN(C2)C13C,0.2515 | |
| CC1CC2(C)CCC=C12,0.2443 | |
| CCC(=O)c1ccno1,0.1934 | |
| CN1N=C(O)OC1=N,0.2378 | |
| OC1COC1C#CC=O,0.2034 | |
| Cc1coc(c1OC)C,0.2317 | |
| OC1(CCC=C1)C#N,0.2545 | |
| NC(=O)N1C2COCC12,0.2902 | |
| OC1(CC1)C12CC(C1)O2,0.3017 | |
| COC(C)(C#N)C(N)=N,0.2507 | |
| CCC(C)(C=O)C(C)C,0.2225 | |
| C(C=O)c1[nH]c(=O)[nH]n1,0.1971 | |
| CC(=O)C12C3CC1CC23,0.2263 | |
| CCOC1=NCC2CN12,0.2702 | |
| CC#CCCNC(=O)C,0.27 | |
| c1c(onn1)C(=N)N,0.1919 | |
| CC1C2C3OC1C(=O)C23,0.2077 | |
| OC1C2CCC1C2C=O,0.2249 | |
| CC12CCC1(CC2)C#N,0.2965 | |
| OC12CC3C1OC23C#N,0.2451 | |
| CC1(O)C2C3NC3C12O,0.2583 | |
| CCC(CCCO)C=O,0.2264 | |
| CN1C=CC2OC2C1=O,0.2019 | |
| c1cc(oc1C=O)N,0.1678 | |
| CC1C2(C)CC(=O)C12O,0.2233 | |
| COc1cc([nH]n1)C#C,0.2021 | |
| O=CC(=O)C1CCC=C1,0.1433 | |
| N=C1OC=NC(=C1)C#C,0.1618 | |
| C1CC=CCCCOC1,0.2548 | |
| OC12CCC3OC1C2O3,0.2921 | |
| O=CC1CCC(=C1)C#C,0.1948 | |
| CC(C)CC#CC(=O)N,0.2341 | |
| N=C(C#C)N1CC1C#C,0.216 | |
| CN1CCC1C(=O)CO,0.2048 | |
| CCCC(C#C)C1CO1,0.307 | |
| N#CC1CC2OC2CN1,0.2733 | |
| CN1C(=N)NN=C1C=O,0.1368 | |
| C1C2N1CC21CC=CC1,0.2528 | |
| c1cnoc1OCCO,0.2378 | |
| C#Cc1c(c([nH]n1)N)O,0.2067 | |
| C(=O)C(=O)N(C=N)C=N,0.159 | |
| CC#CCC(C)(O)C#N,0.2756 | |
| COC12CCC1C(O)C2,0.3045 | |
| CC12NC(C=C1)C21CN1,0.2318 | |
| CC12NC1C1(C)NC21,0.2726 | |
| C1C(=CC(=O)N1)NC=O,0.2038 | |
| CC(C)CCC(C)O,0.3344 | |
| OC1CNC1C#CC#N,0.2125 | |
| CC(C)(CCOC)O,0.3117 | |
| CC12C3C4CC1N2C34,0.3033 | |
| CC(=N)OC(CN)C#N,0.2689 | |
| CCC1(O)C2CN2C1C,0.2894 | |
| CNC12CC1(O)CC2=O,0.2086 | |
| CC1(O)CNC(C1)C#N,0.2731 | |
| CC1(Cn2c1cnc2)C,0.2553 | |
| N#CC1C2CN1CC2,0.2682 | |
| CC1OC23CCC12OC3,0.2797 | |
| CC12CC1C(C#N)C2=O,0.229 | |
| Cc1c([nH]cn1)CC=O,0.1697 | |
| CCC(O)(CO)C(N)=O,0.2721 | |
| CC1CN1CCC(C)=O,0.2143 | |
| CC12CC(O)(C1)C1CN21,0.2997 | |
| C1C2OC3=C(C=CO3)C12,0.2206 | |
| CCN(C)C(=O)CC#C,0.2661 | |
| CC1CNC(=O)N1C=N,0.2431 | |
| COC(CCO)CCO,0.3162 | |
| CC1(CC=O)NC1C#C,0.2064 | |
| C1C2C1C1CC3C2CC13,0.3306 | |
| C1C2C3C4CCC13C24,0.3658 | |
| C1C2OC=NC3COC123,0.2506 | |
| O=C1CC=C(C1)C1CO1,0.2248 | |
| C1CC2C1N1C=NC=C21,0.2499 | |
| NC1(CNC1C#N)C#N,0.2517 | |
| c1c(nc[nH]c1=O)N,0.1913 | |
| c1(c(n[nH]n1)N)N,0.214 | |
| CC1CC=CC(N1)C#N,0.2405 | |
| c1cn[nH]c1NCC=O,0.1818 | |
| CCN=C1CC(O1)C=O,0.2149 | |
| CC(O)C1CN1C(N)=O,0.2767 | |
| C1OCC1C1COCO1,0.3235 | |
| N=CN1CC=CC1=O,0.1967 | |
| OC1CC2(O)COC12,0.2923 | |
| CN1C2CC11CCOC21,0.2832 | |
| NC(CC(N)=[NH2+])C([O-])=O,0.2541 | |
| CC1(O)C2OC(=N)C12,0.2663 | |
| Cc1cn[nH]c1C(C)C,0.2512 | |
| N#CC1C2COC1CN2,0.2751 | |
| CC12NC1COC2C#C,0.2782 | |
| Cc1cc(oc1NC)O,0.2267 | |
| CN1CCC(CO)C1=O,0.2706 | |
| CC12C(O)C1C1CC21O,0.275 | |
| CC1NC1(CCO)C#N,0.2842 | |
| OC1CC2CC12C1CC1,0.3161 | |
| CCC12CC1OC(=N)C2,0.2715 | |
| CC#CC12NC1C1OC21,0.2337 | |
| CCC(CC=O)C1CC1,0.2274 | |
| CC(C)CC(C)C1CO1,0.3396 | |
| C1C2CC1N=CO2,0.2649 | |
| OC1COC=NC1C=O,0.2122 | |
| CC12COC1C2(O)C#N,0.2597 | |
| CC(O)COC(C)C#C,0.302 | |
| c1c2c(ncn1)CC=C2,0.1979 | |
| C1C2C3OCCOC1C23,0.322 | |
| C1CN=C2OC3C(O1)C23,0.2266 | |
| c1cnc(c(n1)N)N,0.1831 | |
| CCCC1(C)OCC=C1,0.2487 | |
| OC12CC3(O)C(C1)OC23,0.3039 | |
| C#Cc1ccc(nc1)F,0.2024 | |
| C1COC(O1)CC=O,0.2294 | |
| CC1=CNCCCC1=O,0.1795 | |
| O=C1CC2CC=CCC12,0.2146 | |
| CCCC(C)CCO,0.3419 | |
| O=CC1OC2CCCC12,0.2157 | |
| FC1=C(F)C(=N)NN=C1,0.1653 | |
| CC(O)(C#C)C1(C)CN1,0.2712 | |
| COC1CC11C2CN1C2,0.3075 | |
| CCC1(C=O)C(O)C1O,0.2179 | |
| C(C(=O)C=O)O,0.1563 | |
| CCC(NC=O)C#C,0.2733 | |
| CC(C)(C(=O)C=O)OC,0.1593 | |
| CC1(CO)CCC1=NO,0.2466 | |
| CC1CC1C1CC(C)O1,0.3294 | |
| O=C1C2CC2C1C#C,0.2208 | |
| CC(C)(CCC1CC1)O,0.3254 | |
| CN1C=NC(=N)C(C)=C1,0.1897 | |
| OC1(COC1C#N)C=O,0.2208 | |
| CC1CCCC1(C)C=O,0.2293 | |
| CC1CC2CN2CC1O,0.277 | |
| O=C(CC1CO1)C1CC1,0.2333 | |
| CC1CC2CC2C1(C)O,0.3297 | |
| COCC12CCC1CC2,0.3299 | |
| CC1C2C3CC(C)C1C23,0.3302 | |
| O=C1C2C[NH2+]C2[C-]1C#N,0.1793 | |
| CC1OCOC1CC#C,0.307 | |
| CC1(O)CN2CC2C1=O,0.2119 | |
| OC12CC1C1OCC1C2,0.3134 | |
| CCN1C=CC(C)C1=O,0.2079 | |
| CC(O)C1NC(=O)C1C,0.2778 | |
| CCC1CC11CC(O)C1,0.334 | |
| CC(=O)C(C)(O)C#C,0.2192 | |
| CN1CC11CC(O)C1,0.3024 | |
| O=CC12CC1C=CCO2,0.213 | |
| COC1CN2CC12C#C,0.2527 | |
| CC1C=CC2OCCC12,0.2619 | |
| CC1(CC2CC2O)CC1,0.3314 | |
| CC1CCC1C#N,0.3306 | |
| CC12CC1C(CO2)C#C,0.28 | |
| CC1=NNN=C(N)C1=N,0.1668 | |
| c1c(c(no1)C#N)CO,0.22 | |
| CCC1C2CC(CO)C12,0.323 | |
| O=CC12CCC1N2,0.2211 | |
| CC1(CCOC1=N)C#N,0.273 | |
| N#CC1C2OC2C2OC12,0.3128 | |
| O=C1CC2C3NC3C2O1,0.2716 | |
| CC1=NC(CO1)C1CC1,0.2686 | |
| CC#CC1C2COC12,0.2766 | |
| NC1(C=CC2CC12)C#N,0.2401 | |
| c1c2c(ncn1)nco2,0.1988 | |
| CC(C#C)C1(CO1)C#C,0.2812 | |
| CC1(O)CC2(CO)CC12,0.3124 | |
| CC1CC(O)(C#C)C1=O,0.1982 | |
| OC1(CC1C1CN1)C=O,0.2019 | |
| Cc1c(ccc(=O)[nH]1)N,0.1577 | |
| CCOCC(O)C1CC1,0.3258 | |
| CC(CO)CC(C)(C)O,0.3108 | |
| CC1(N)C(N)C1C#N,0.2657 | |
| C(C=O)OCC#CCO,0.2282 | |
| ON=C1CC2C(O)C2C1,0.2373 | |
| OC1=CNN=C1C1CO1,0.2291 | |
| CC12OC3CN4C1C2C34,0.2698 | |
| CC1OCC2CCOC12,0.3119 | |
| O1C=NC2C3C4C3C2C14,0.2549 | |
| OCC1(CN1)C(O)C#N,0.2887 | |
| CC1CC2CCC=C2C1,0.2498 | |
| CC(=N)OC1=NNC=C1,0.2453 | |
| CNC1C(OC1=O)C#N,0.2393 | |
| CN1CC1C(O)C=O,0.1954 | |
| C1COC(=O)NC(=O)N1,0.2735 | |
| OC1(CC2NC2C1)C=O,0.2164 | |
| CC1NC(=O)C2CC12O,0.2634 | |
| OCCC1CC2(CC2)O1,0.3048 | |
| CN1C=C(N)OC1=N,0.2199 | |
| OC12CC1C(=O)C21CC1,0.2286 | |
| C(C(=O)N)NC(=O)C=O,0.1775 | |
| CCC(C)(CC#N)C=O,0.2248 | |
| COC1(C)CC2OC12C,0.3244 | |
| CC#CC1=CNC(=N)O1,0.1776 | |
| OCC(O)CCOC=N,0.2824 | |
| CC1NC11COC1C,0.3092 | |
| CCOC(C)C#CC#N,0.2282 | |
| CC1C2C(N)C(C#N)N12,0.2633 | |
| CC1(O)C2COC12C=O,0.2117 | |
| CN(C=O)C1CC1C#N,0.2632 | |
| CCc1c(ocn1)OC,0.2297 | |
| OCC12CC1(CO2)C#C,0.2606 | |
| CN=C1NC(=N)C(C)O1,0.2435 | |
| OCC(O)C1CC(=O)N1,0.2763 | |
| NC1=NC2C3OC1C23N,0.2226 | |
| Cc1c(cc(n1C)O)O,0.2275 | |
| CC1C2CC=C(C=O)C12,0.1896 | |
| C12OC34CC(C3)C4(C1)C2,0.332 | |
| OC1(CC1)C1CC(=N)O1,0.2871 | |
| CCC1(O)C2CC1C2,0.3285 | |
| CC1C2C3CC2C2C3N12,0.3286 | |
| CC([NH3+])C1CC1C([O-])=O,0.2698 | |
| NC(=[NH2+])CC(CO)=N[O-],0.2083 | |
| O=CCC1CCC11CC1,0.227 | |
| N#CCCC1CC=CC1,0.2654 | |
| CC1(CO)CCOC1=N,0.2717 | |
| CC(O)CN1N=CC=N1,0.2469 | |
| CC1CC(C#N)C2NC12,0.2943 | |
| OC1(CCC1C=O)C#C,0.2198 | |
| OCC12CC3OC1C3N2,0.2939 | |
| CC1=CCCC(=NO)C1,0.2502 | |
| CC(C(O)C=O)C1CN1,0.2014 | |
| CCC(O)(COC)C#N,0.312 | |
| CN1C2CC(O)C(=O)C12,0.1973 | |
| c1c(c(=O)[nH]nn1)F,0.188 | |
| CC1C2CC1C1C(O)C21,0.3124 | |
| O=C1COC2CCC2C1,0.2129 | |
| CC1=CN(CCC1)C=O,0.2101 | |
| OC12CC1(CCC2)C#C,0.2756 | |
| CC1CC2OC2(C)CO1,0.3352 | |
| O=C1C2CC2NC1C#N,0.1999 | |
| OCCC(CC#N)C=O,0.2244 | |
| CCC1C2OC2(C)C1O,0.3238 | |
| c1c2c([nH]c1O)COC2,0.2372 | |
| O=CC1(CN1)C1CCO1,0.2136 | |
| CCN(C)CC(=O)C#N,0.1539 | |
| Cc1ccnn1CCO,0.2541 | |
| OC(CC#C)C#CC=O,0.2005 | |
| CC(C)(C)C#CC(=O)N,0.2338 | |
| CCC1C2OC2C1C=O,0.2131 | |
| COc1c(=O)ccon1,0.1923 | |
| CC1C2C=CC1N2C,0.2141 | |
| C1C2C3C4CC=C3C2N14,0.1582 | |
| CCOc1c([nH]cn1)C,0.2198 | |
| CC1C(C)C1(C=O)C=O,0.2112 | |
| CC1CC11CC(=O)CO1,0.2179 | |
| O=C1C2CC3C2C13C#N,0.2422 | |
| CC1CCOC(=O)C=C1,0.2199 | |
| NC1=CNC2=C1N=NO2,0.1197 | |
| CC1(O)CC1OCCO,0.3167 | |
| CCN1C2CC2C1=O,0.249 | |
| C1C2(N1)COC(=O)OC2,0.3155 | |
| C#CC1COCCOC1,0.2962 | |
| COC(C=O)C#CCO,0.2039 | |
| CCCC(=N)OCC=O,0.2299 | |
| O=C1NC2CC2(O1)C#C,0.2704 | |
| Cc1c(c(c[nH]1)O)C#C,0.2057 | |
| CC(C)(CC#N)NC=O,0.2755 | |
| CC1CC(=O)OCC=C1,0.2545 | |
| CC#CC1CC2CN12,0.265 | |
| C(C1CCC=C1)N1CC1,0.2581 | |
| OCC(O)CC#CC#C,0.2281 | |
| CC1OCC1(C)CC#N,0.2829 | |
| CN=C1OC=NC(O)=N1,0.183 | |
| CC1=C(C(=O)N(C1)C)C,0.2173 | |
| CC(C)CC(C)C(C)=O,0.2298 | |
| N=COCC1OCC=C1,0.2402 | |
| Cc1c[nH]cc(c1=O)F,0.1965 | |
| CC(O)CC12CCC1N2,0.3157 | |
| c1cc(cnc1)CC=O,0.2129 | |
| COC(C)C1(CC1)C=O,0.2341 | |
| CC1C=CC2C(O)C12O,0.2268 | |
| COC1CC(O)C1(C)C,0.321 | |
| Cc1c([nH]nc1O)O,0.2554 | |
| CC(O)C(=N)OCC=O,0.213 | |
| CC1=CC(=O)CCC1O,0.1884 | |
| CCC(C)(C)CCC=O,0.2295 | |
| OC1C2CC1CC=CC2,0.2712 | |
| OC12C3CC1NC2=NC3,0.1938 | |
| OCC12CNC1C(=O)N2,0.2415 | |
| C1CC2(C1)C(=O)C=CN2,0.1855 | |
| c1c2c(on1)OCO2,0.2038 | |
| CC1OC11CC2OC12C,0.3278 | |
| CC1C2COC=NC12C,0.2529 | |
| C1CC12C(=O)COC2=O,0.2135 | |
| CNC(=O)C(C)OC,0.2756 | |
| O=C1CC2NC12,0.2224 | |
| C(c1c(non1)N)O,0.2125 | |
| CC1(O)C=CC2NC12,0.2417 | |
| CC(O)C12CC3C(O1)C23,0.2994 | |
| CC(=N)N1CCC1=O,0.2379 | |
| C#CC1COCCC=C1,0.247 | |
| O=CC1C2CC1C(=O)N2,0.2035 | |
| CC1(O)CC2CC(C1)O2,0.3115 | |
| OCC12CCC1OC2=O,0.276 | |
| C#CC12OC3CC1CC23,0.2588 | |
| CC1C2CCC1C21CO1,0.3355 | |
| CCNC1(C)COC1=N,0.2555 | |
| N#CCC1CN1,0.2878 | |
| CC1C=CC2CC2C1=O,0.2153 | |
| C#CC(=O)CC#CCO,0.1891 | |
| CN1CC1C1(CO)CN1,0.302 | |
| c1c[nH]cc(c1=NO)O,0.1707 | |
| Cc1cccnc(=O)c1,0.1675 | |
| N=C1NC(=CC1=O)C#N,0.1384 | |
| c1c(ocn1)CC(=O)N,0.2272 | |
| CN=C1C(=CC(=O)N1)N,0.1726 | |
| CC1=CC(=O)NC(=N)O1,0.2086 | |
| CC1(CC1)c2cnno2,0.2211 | |
| C#CC1N=COC11CC1,0.2591 | |
| CC1C(C#N)C1C#N,0.2968 | |
| C#Cc1cn[nH]c1CO,0.2243 | |
| CC1N=CN2CC12C#N,0.2444 | |
| OC1CC11C2NC1C2O,0.3138 | |
| CCc1c([nH]c(n1)O)C,0.2441 | |
| CN(CCO)CC(=O)N,0.2538 | |
| CC1(C)C2CN1C2C#C,0.2526 | |
| C1OC1C1=CCCOC1,0.2463 | |
| [O-]C(=O)C12CC1NC=[NH+]2,0.2396 | |
| CC(O)C1C(O)CC1O,0.3027 | |
| CCC#CC(CO)C=O,0.2168 | |
| OC1C2C3C2C1C3O,0.3102 | |
| CC1(C#N)C(O)CC1=O,0.214 | |
| O1C2C3C4C5C4C(C13)C25,0.31 | |
| CC12COC=NCC1O2,0.2586 | |
| Cc1conc1COC,0.2458 | |
| CC1CCCC2(C)OC12,0.3358 | |
| COC12CC1(O)C1NC21,0.3096 | |
| CC1C(=O)OC1(C)C,0.2795 | |
| CC1NC(=O)C(O)C1=O,0.2131 | |
| OC(C#N)C1=NC=NO1,0.2547 | |
| OC1CCC(=O)C1C#N,0.2237 | |
| Cc1nnn(n1)CCO,0.2572 | |
| C1OC2=NC3CC(C3)C12,0.2505 | |
| CC(O)C1=CN=C(O)N1,0.2394 | |
| c1coc(n1)OCC#N,0.2366 | |
| CC1NC(=O)C(C=O)=C1,0.1688 | |
| C#Cc1ccc(cn1)O,0.1911 | |
| CC12OC=NC1C1CC21,0.2673 | |
| NC(CC(N)=O)C#N,0.2578 | |
| OC1COC2C3NC3C12,0.295 | |
| OC1COC1=N,0.284 | |
| C(C=O)C(=O)CO,0.2114 | |
| N=COCC1=NC=CN1,0.2279 | |
| CCc1cc(c([nH]1)O)O,0.2232 | |
| N#CC1C2C3C=CC1C23,0.2367 | |
| Cc1nc(cn1C)NC,0.2121 | |
| C1CN(C(=O)C1=O)C=O,0.1562 | |
| CC12CC3C4C(OC13)C24,0.3314 | |
| CC1=NCCC(CO)O1,0.2711 | |
| CC#CC1(O)CCC1C,0.2793 | |
| N#CCC1(CC1)C1CN1,0.2825 | |
| CCC12CCC1C(=O)O2,0.2778 | |
| CCC1(C)COC1=NC,0.2822 | |
| CC1C2CCOCOC12,0.3202 | |
| CC12COC1C1CC2C1,0.3228 | |
| CC(C)Cc1ccn[nH]1,0.2558 | |
| CC(O)(CCO)CC#C,0.2988 | |
| CN1C2C3NC2C13C,0.2871 | |
| CC12CC3C1C2C3=O,0.2444 | |
| CCC1C2CC2C1=O,0.2253 | |
| O=COC1CCNC1=O,0.2563 | |
| CCC12CN3CC3C1N2,0.2803 | |
| COC(=O)c1ncno1,0.2216 | |
| c1conc1OCC#N,0.2557 | |
| CCc1cnc(o1)C#N,0.1995 | |
| OCC12CC3CC(C1)N23,0.2808 | |
| CC12OC3(CNC13)C=C2,0.2049 | |
| COC1CC(=O)C1C#C,0.2144 | |
| CC12NC1C1C2NC1=O,0.2545 | |
| CCC(C=O)C(C)CO,0.2256 | |
| OCC1(O)CCCC1O,0.3186 | |
| CCN1CC11CC2NC12,0.3016 | |
| CNc1c([nH]c(=O)[nH]1)O,0.2224 | |
| C(c1c(oc(=O)[nH]1)N)O,0.218 | |
| CC12CN1C(=O)C21CN1,0.2199 | |
| OC1C2NC3(CC3)C12O,0.2922 | |
| CC(CO)OC(C)C#C,0.2907 | |
| [NH3+]C(C#CC#C)C([O-])=O,0.2211 | |
| C1COCCNC(=O)N1,0.2894 | |
| CC(C)C(O)C1CN1C,0.2922 | |
| O=C1NCC2CN3C2C13,0.2522 | |
| C1CC12C=C(CO2)CO,0.2285 | |
| O=CCC1CCC1C=O,0.2167 | |
| NC1=NC2C3NC2C3O1,0.2644 | |
| COCC12CCC1O2,0.3289 | |
| C1CC23CN4CC(C24)N13,0.2789 | |
| CCCC1=NCC(=N)N1,0.2307 | |
| CNC(=O)C(=N)NC=O,0.2054 | |
| CCC12NC1C(=O)C2C,0.2158 | |
| OCC1C2OC1C2C#N,0.2762 | |
| CC(CC#C)C(C)=NO,0.257 | |
| CCCC(O)(C=O)C#C,0.2147 | |
| c1c(n(nn1)CCO)N,0.228 | |
| CC(=O)N(C)CC#N,0.2707 | |
| C1CC23COCC12N3,0.3075 | |
| CC#CCC1CC1C=O,0.2267 | |
| CC1OC1C1CC=CC1,0.2649 | |
| CC1N=COC1(C)C,0.2714 | |
| CCCCC(C)C,0.3858 | |
| CCC(=N)NC(=O)C#C,0.2018 | |
| C#CC(CC=O)C#C,0.2211 | |
| CC1=CC2N3CC2(C)C13,0.2113 | |
| CCC(C)NC(=O)C#C,0.232 | |
| CCC1COC1(C)C=O,0.2143 | |
| CC(=O)NCCOC=O,0.2636 | |
| CC1(CO)CC2(CO2)C1,0.3211 | |
| O=C1OC2CC12CC#N,0.2751 | |
| CCn1c(c(cn1)O)N,0.2283 | |
| C1OC2C=CC3OC3C12,0.232 | |
| CC1(C)C2OC3C2OC13,0.3007 | |
| Cc1ccn2c1NCC2,0.23 | |
| O=C1CC2C(CC12)C#N,0.2171 | |
| COC(=O)c1c[nH]nc1,0.2391 | |
| CNC1(COC1C)C#N,0.2669 | |
| CC1OCCC11CO1,0.3221 | |
| CCN1CC(=O)C1C#N,0.2074 | |
| CC1C2CC(=O)C12,0.2297 | |
| CC(O)C1C2NC1C2O,0.3051 | |
| CC1C(CC1(C)C)C#C,0.3031 | |
| Cc1cc(=O)cccn1,0.1522 | |
| C#CC1=CC2CC(C1)O2,0.1986 | |
| CCOc1cnccn1,0.1989 | |
| CCC1OCCCC1C,0.3221 | |
| O=CCN1CC1C#N,0.2261 | |
| Cn1ncc(=O)c(n1)O,0.176 | |
| Cn1c(cnn1)OC=O,0.2318 | |
| COC1C2CN2C11CC1,0.3085 | |
| Cn1ccc(=O)nc1,0.2015 | |
| C1CC2(CC2)NCC1=O,0.1992 | |
| OC12CC34N=CN(C13)C24,0.2134 | |
| COCC(=O)C(=O)N,0.1788 | |
| CC12CC(=O)C1(C)CO2,0.2165 | |
| CC12CC3C(CC13)C2=O,0.2258 | |
| FC(F)(F)C1CO1,0.3642 | |
| CN1CC2(OCC12)C#C,0.2336 | |
| CCCCNC(=O)C=O,0.1771 | |
| C#Cc1ccc(=O)on1,0.1678 | |
| NC1=NC2CC2OC1=N,0.1907 | |
| c1cc(c(cc1N)N)N,0.1909 | |
| CCC1=CC2(CO2)CC1,0.2464 | |
| CCCOCC1CC1C,0.3363 | |
| CC(C)C1OCCC=C1,0.2632 | |
| C1C2CN3C=CC=C3C12,0.2329 | |
| C1COC(=N1)C(=O)C=O,0.1514 | |
| COC1C=CC2C(O)C12,0.2276 | |
| CC(CO)C(=O)CC#N,0.2246 | |
| CC12CCN3CC1(O)C23,0.2831 | |
| CC1OC1CC(C)(C)C,0.3331 | |
| CC1(CO)CCC1O,0.3043 | |
| CCC(C#N)C(=O)C#C,0.2055 | |
| O=C1C=CCCC1C#N,0.1925 | |
| C1CC1C(=O)NC2CC2,0.2707 | |
| CC1(C)NC1(C)CC=O,0.2154 | |
| CC(C)([NH+]=CN)C([O-])=O,0.2442 | |
| OC1C2C(O)C1N2C=O,0.2521 | |
| CC1C2C3CC2CC1C3,0.3509 | |
| CC1(O)CC1(O)C#N,0.2822 | |
| O=C1C(NC11CC1)C#C,0.2052 | |
| CCc1cnccc1C,0.2296 | |
| CCCN1CC1C#N,0.2689 | |
| CNC(CCC#N)C#N,0.2676 | |
| C1OC2C1OC21COC1,0.2975 | |
| CC1CCC(C)N1C=O,0.264 | |
| COC1C(C)CC=C1C,0.2601 | |
| CC1=CC(F)=COC1=N,0.1615 | |
| OCC1C2NC2C1C=O,0.217 | |
| CC#CC1COC(=N)N1,0.261 | |
| OC12CCC(C1)OC2,0.3042 | |
| O=C1OC=NC2CC1C2,0.2264 | |
| CC1CC1C([NH3+])C([O-])=O,0.2655 | |
| CNc1[nH]nc(n1)C#C,0.212 | |
| CC1C(O)C11CCC1,0.308 | |
| C1CC(C1)C1C2CCC12,0.3312 | |
| COc1ccnc(n1)N,0.2093 | |
| CCc1ncn(n1)C,0.2636 | |
| OC1C=CC2=CON=C12,0.2019 | |
| CC1C(=O)C=CC1(C)C,0.1917 | |
| CCC12CCC1CC=C2,0.2604 | |
| CC1CN1CCC=O,0.2119 | |
| COC(C)C12CCC1N2,0.3277 | |
| c1cc2c[nH]cc2nc1,0.1586 | |
| CC1COC11CCC1=O,0.1959 | |
| CC1CC2(COC2)C1O,0.2957 | |
| C#CC(=O)N(C=N)C=N,0.2009 | |
| OCC1=CC(=N)N=NN1,0.1695 | |
| C1OCC2C3OC2C13,0.3097 | |
| C1C2OC34CC(C3)C1C24,0.2794 | |
| C1CC(=O)CN=COC1,0.2146 | |
| c1cncnc(c1=O)O,0.173 | |
| CC1CCOC(=N1)C#C,0.2262 | |
| CC(N)C(NC=O)C#N,0.2589 | |
| CC1CCC1(C=O)C=O,0.2012 | |
| CC12CC(O)C1C1CN21,0.2792 | |
| CC(C)C(O)C(C)CO,0.3236 | |
| CC(=O)C1(C)OC2CC12,0.2184 | |
| CC1=C(CC(=O)N1)CO,0.2087 | |
| CC(N=C(N)C=O)C#C,0.187 | |
| CC(O)(CO)C1CCO1,0.3176 | |
| COC1C2CC1COC2,0.3355 | |
| C1CC23OCOC2C3O1,0.3053 | |
| CCC#CC1OCC=C1,0.2523 | |
| CN1C(C)(C)C1(C)C=O,0.2067 | |
| C(=O)Nc1c(onn1)N,0.1919 | |
| CCC1C2C1C(C)C2C,0.3297 | |
| CC12CC1OC(=N)OC2,0.2863 | |
| c1c(c(c([nH]1)O)O)CO,0.2133 | |
| NC(CNCC#N)C#N,0.2695 | |
| CCC1CC2OC(=O)C12,0.2777 | |
| CC1OC2CC3OC3C12,0.3149 | |
| N=CN1C(C=O)C1C#C,0.1924 | |
| C#CCCCCC#C,0.3106 | |
| OCC#CC1CC(=O)O1,0.2753 | |
| CC1C2CC1C(C)(O)C2,0.3303 | |
| CN(C)c1ccncn1,0.2017 | |
| CC12CN3C1C2(N)C3=O,0.2436 | |
| CC#CCC12CCC1N2,0.297 | |
| CNC(=O)C(C)CC#N,0.2742 | |
| CC1=CCc2n1nnc2,0.2127 | |
| O=C1C2C3CC2OC1C3,0.2018 | |
| COC(C)CNC(C)=O,0.2788 | |
| OC1CCC1(C=O)C#C,0.2064 | |
| COC1CC2NC2C1=O,0.1923 | |
| CC(O)CC1(C)CN1C,0.2833 | |
| N=C1NC(=O)COC1=N,0.2087 | |
| CN1CCC2CN2C1=O,0.2766 | |
| c1c(c(c(nn1)F)N)O,0.2041 | |
| OCC(=O)C1C2CC1C2,0.2299 | |
| CC12CC3OC4C1N2C34,0.2924 | |
| CC(C)(C)C(=O)N,0.2747 | |
| NC(=O)N1C=NC2CC12,0.2245 | |
| C1C2C3OCCCC1C23,0.3162 | |
| C1C(CO1)(C#CCO)O,0.2635 | |
| Cc1nc(no1)C(C)C,0.2623 | |
| O=C1OC2CC(C2)C1=O,0.1818 | |
| CC1(O)CNC(=O)C1=O,0.1668 | |
| O=CC1CC2NC12C#N,0.2094 | |
| CCOC1=NCCC1,0.2814 | |
| COCC12CC1C1NC21,0.2822 | |
| CC1C2CC1C2=O,0.2511 | |
| O=C1NC(CC#N)C=C1,0.2114 | |
| COCCC1OC2CC12,0.3204 | |
| CC1(C)C2CC11COC21,0.2925 | |
| C#CCC(=O)C(F)(F)F,0.2186 | |
| C1C2CC3C4OC2C1C34,0.3073 | |
| CCC12C3CC1CCC23,0.3206 | |
| CC(=O)C(C)(C)COC,0.2293 | |
| c1(nnn(n1)C(=O)N)O,0.2107 | |
| C1OC1C1COC1,0.3292 | |
| CC12CC(C1)NC2C#N,0.2735 | |
| CC1C2CCC(=O)C12C,0.2237 | |
| CC12CCC3C(C1)OC23,0.3176 | |
| OC1CC(CC=C1)C#C,0.2575 | |
| CC(C)CNCC#N,0.2697 | |
| NC1=C([O-])C(C[NH3+])=CO1,0.2017 | |
| CC1(C)CCC(O)C1O,0.2955 | |
| CC12C=CC3C(N13)C2=O,0.1893 | |
| N=C1CC(CCC#N)O1,0.2916 | |
| C1C(CO1)OC=O,0.2637 | |
| COc1c([nH]c(n1)N)N,0.2227 | |
| CCC(=NC)NC(=O)N,0.2429 | |
| CNC1=C(OC)ON=N1,0.1704 | |
| CCC1CC(CO1)C#C,0.3028 | |
| OC12CN3C1CCCC23,0.3087 | |
| Cn1ccc(c1C#C)N,0.1863 | |
| CC1=CC2(C)CC3C1N23,0.2206 | |
| OCC(O)C#N,0.2839 | |
| O=CCC1C=CNC1=O,0.1982 | |
| C#CC1=CC=CCC=C1,0.1652 | |
| CC1N2CC(C#N)C12C,0.2664 | |
| CCC12CC1(CN2)C#N,0.2606 | |
| CC1N=COC2(C)CC12,0.2687 | |
| CC1CC(C#N)C1CO,0.2859 | |
| O=CCC12C3CN1CC23,0.2092 | |
| CC1(CC2(C1)CCO2)C,0.3107 | |
| OC1COC2CCC2C1,0.3097 | |
| CCC1CC(=O)C1,0.223 | |
| OC1=CC(=N)C(F)=NN1,0.179 | |
| OC1C2NC(=O)C1C=C2,0.2163 | |
| CCC1C2CC3OC3C12,0.3273 | |
| CCCC#CC(=NO)C,0.2031 | |
| C1C2NC22C=CCOC12,0.2382 | |
| [NH3+]CCOC(=O)C([O-])=O,0.2231 | |
| COC(C#N)C1COC1,0.2682 | |
| NC1=C(OC(=N)N1)C=O,0.1679 | |
| OCC1=CCC2OC12,0.245 | |
| CN1CC(C)(N=C1)C#N,0.2368 | |
| O=C(C#N)C1C2CCC12,0.1918 | |
| CCN1C2CC(O)CC12,0.2843 | |
| c1nc(nn1C=O)O,0.2012 | |
| CC1CC=CC11CN1,0.2462 | |
| CC(C#N)C1=NON=N1,0.249 | |
| Cc1cc(nn1C=O)O,0.2012 | |
| CC1OCOCC2OC12,0.3435 | |
| CC(C)(C)OCC#C,0.2883 | |
| C(CCO)CC(=O)C=O,0.1568 | |
| NC1=NC(CC1O)C=O,0.2083 | |
| CN1N=CC(C)=NC1=N,0.1525 | |
| CCC(C)C(C=O)C=O,0.1949 | |
| COC12CN3C1CCC23,0.3246 | |
| COC12CC3NC1C23O,0.2749 | |
| CCC1C(C=O)C1C=O,0.2119 | |
| CC(O)CCC1CC1C,0.3279 | |
| N=COC1CC1OC=O,0.2779 | |
| c1cc(n(c1)C=O)C#N,0.182 | |
| COCC#CCOC,0.2845 | |
| OCC1C(O)CC1C#C,0.2958 | |
| CC1OCC2OCCC12,0.3085 | |
| CC(C)(CCC#N)C=O,0.227 | |
| C1NC2=NCC3OC1C23,0.2265 | |
| OC12CC3C(CC13)C2,0.3266 | |
| O=CC1C2CC2C11CN1,0.2178 | |
| C1CC(O1)C1=CC=NO1,0.2313 | |
| C1CCC(=O)COCC1,0.2061 | |
| O=C1C(CC11CC1)C#C,0.2094 | |
| CC12CC3CC1(O)C23,0.3025 | |
| OCC1CC2OCC2=C1,0.2429 | |
| c1c2c(no1)CC=CC2,0.2384 | |
| OC1=CC=C2C3CC3N12,0.2079 | |
| C1OC2C1C1C3CC2C13,0.3146 | |
| CCCc1c(cco1)O,0.22 | |
| OC1C2C1C1C2OC1=N,0.2757 | |
| OC1C2COC2C11CC1,0.3014 | |
| O=CC1CCOC=N1,0.2194 | |
| C1C2CC3=CNC=C3C12,0.2415 | |
| CCC(C)(OC=O)C#N,0.2769 | |
| CN1C2C3NC2C13C=O,0.1882 | |
| C1CC23CC(C2)OCC13,0.324 | |
| CN=C1OC=NC=N1,0.1778 | |
| OC1C=CC(=O)C11CN1,0.1772 | |
| CC1C2C3OC3C(C)C12,0.3261 | |
| C1CC1C12CC1C=CC2,0.2463 | |
| O=C1C2CN3CC2CC13,0.2194 | |
| CC(=O)NC1=CCCC1,0.2121 | |
| CCC12NC3C1N(C)C23,0.2808 | |
| OC1CC2(O)CCC2=C1,0.247 | |
| CC1=CC=CCCCC1,0.2023 | |
| CCc1conc1C,0.2487 | |
| OC1C2CCOC12C#N,0.271 | |
| OCC(C=O)C(O)C#N,0.2236 | |
| C1C(=O)CN1CC#N,0.2181 | |
| OCC12CC1OC2C#C,0.2596 | |
| CN=C1NN=CN=C1,0.1524 | |
| CC1(CC(O)CO1)C#N,0.2969 | |
| C1OC11C2CC1CCC2,0.3348 | |
| O=C1CC2NC12C1CN1,0.2086 | |
| C1C2C1C1C=CCOC21,0.2559 | |
| COCCC1(CO1)C#N,0.2642 | |
| CC1OCC1CC1CC1,0.325 | |
| Cn1c(ccc1O)C#N,0.1982 | |
| CC(C=O)C1=CON=C1,0.215 | |
| CC1(O)C(NC1=N)C#N,0.261 | |
| CC1C(C=O)C1C=O,0.2123 | |
| CC1C2COC1(C)C=C2,0.2485 | |
| CCC1=NC(C)C(=O)O1,0.2476 | |
| C1CC11C2CC1O2,0.3214 | |
| CC(O)CC1C(C)C1O,0.3122 | |
| c1(nnc(o1)N)N,0.242 | |
| C1CC(=O)NCC1=NO,0.2387 | |
| CCC(C)C1CC2OC12,0.3266 | |
| CC1COC1C1(C)CC1,0.3206 | |
| CCC1(C)OC11COC1,0.3165 | |
| c1c2c(co1)CCC2,0.2343 | |
| CC1NC11CC=CC1=O,0.1926 | |
| CC1=C(C)C(O)CCC1,0.2496 | |
| NC(CO)(C#N)C1CO1,0.2842 | |
| C1C2OC3CN4C2C1C34,0.2782 | |
| O=C1C2CC1CC(=O)C2,0.2033 | |
| CC1N2C3C4C3C1(O)C24,0.2844 | |
| C1C2=C(CO1)COC2,0.2477 | |
| Cc1cnc(nc1)C#N,0.2022 | |
| CCCOC1C(C)C1C,0.313 | |
| C1CN1C12CC1CC2,0.3006 | |
| CC1(CO)NC1CC#C,0.3003 | |
| CCc1cccc(c1)F,0.2317 | |
| C1CC(=CCOC1)C#N,0.2191 | |
| CC1NC1C(O)CO,0.3025 | |
| O=C1C2COC1C1CC21,0.2069 | |
| CCOC12CN3C1CC23,0.3284 | |
| Cc1cc([nH]c1OC)O,0.2383 | |
| O=CC1C2OC1C1CC21,0.2172 | |
| c1cnn2c1CC2,0.2683 | |
| CC1(C)C2OC(=N)C12,0.274 | |
| NC(=O)OC1CC2NC12,0.2928 | |
| C1CC(C1)C2CC2,0.3527 | |
| C1C=CC(=O)N1C=O,0.1942 | |
| COC=Nc1ncco1,0.1837 | |
| CC1(C)CC2CC1(O)C2,0.326 | |
| CNC(=O)C(=O)NC=N,0.1907 | |
| OC12COC(OC1)C2=O,0.2056 | |
| CC12C3CC3C1(O)C2O,0.2907 | |
| N=C1OCC2C(C#C)C12,0.2665 | |
| O=C1CC2N1CC21CO1,0.2394 | |
| O=CNCC1(CO1)C#N,0.2589 | |
| C#CC1=CCC=CCC1,0.2057 | |
| c1cc([nH]c1)OC(=O)N,0.2198 | |
| CCc1cncnc1,0.2099 | |
| N1C2C1C1N=CN3C2C13,0.2367 | |
| OCCC1N=CNC1=O,0.2268 | |
| CCC1C=CCCC1O,0.2627 | |
| O=C1CC2CC3(CC3)N12,0.2284 | |
| CC(NCC1CC1)C#N,0.2696 | |
| C1COC1=O,0.2878 | |
| c1[nH]c2c(onc2n1)N,0.1825 | |
| ON=C1C2CC1CCC2,0.2538 | |
| C1NC1C12CCC1CO2,0.31 | |
| O=C(CC1CO1)C#C,0.2068 | |
| CCCCC1COC1C,0.3222 | |
| CC1C2C=CCOC12C,0.2437 | |
| CCC1OC(=N)C2CC12,0.2783 | |
| CC12CC(=O)OC1CO2,0.2699 | |
| CC(C)CC1NC1C#N,0.2908 | |
| O=C1C2CC1(CC2)C#N,0.2285 | |
| OC(C#N)C1=CNC=N1,0.2532 | |
| C1OC2C3C4C3C2C14,0.3327 | |
| C#CC(=O)COC=O,0.1989 | |
| CC(CC=O)OC(C)=O,0.2256 | |
| CC(=O)CC(=O)CC=O,0.1961 | |
| CC(C#C)C(C=O)C#C,0.2149 | |
| c1[nH]c(c(n1)NC=N)N,0.1998 | |
| C1CN1C12CC1C1OC21,0.2712 | |
| CC12OC(C1O)C21CN1,0.3087 | |
| C#Cc1ccc([nH]1)CO,0.1962 | |
| COC(=O)C1OCCO1,0.25 | |
| c1cnc(c(=O)[nH]1)C=O,0.1428 | |
| C1CC12COC(=O)O2,0.3201 | |
| O=COCC1CNC1=O,0.2762 | |
| CN1CC2C3C4C(C14)N23,0.2609 | |
| c1c(ncc(n1)N)C=O,0.1754 | |
| CC1(O)CC2CC1C2,0.3309 | |
| CC1CCC(=O)OC1=N,0.2568 | |
| C(C#N)OCC(=O)N,0.261 | |
| OC1C2OC(=NC12)C#N,0.2086 | |
| CC(=O)C(CO)NC=O,0.2293 | |
| CC(C(N)C#N)C1CC1,0.2802 | |
| Cn1cc(nc1)OC,0.2245 | |
| COC12CC1(NC2)C=O,0.1809 | |
| C1CC2OCCNC2=N1,0.2487 | |
| CCC1OC(CO)C1=O,0.2166 | |
| NC1(C#N)C2C3NC3C12,0.2432 | |
| OC1C=CC(=N)NC1=O,0.2079 | |
| CC(=O)C#CCC#N,0.2067 | |
| CC1CCC2CC1O2,0.3154 | |
| O=C1OC2C3CC(C3)C12,0.2771 | |
| Cc1c(cccn1)F,0.2232 | |
| CCc1nc[nH]c(=O)n1,0.2031 | |
| CC(C)C1(C)COC=N1,0.2708 | |
| CC1CC(=O)NC1(C)C,0.2727 | |
| OC12CC1OC1COC21,0.2975 | |
| CC1(CC1O)OC=N,0.2793 | |
| O=C1C2C3C2N2C3C12,0.2102 | |
| [O-]C(=O)C1C2C[NH+]1C2,0.2077 | |
| CN(C(=O)C#C)C(=N)N,0.1853 | |
| CC1C2C3C1COC23C,0.32 | |
| N#CC12OC1CCC=C2,0.2329 | |
| CC1N2C=NCC2C1=O,0.2035 | |
| CC#CC1NC2CC12O,0.2548 | |
| OCC1CCC11CN1,0.2936 | |
| N=C1NC(=N)NC(=O)N1,0.2495 | |
| CCc1cc(cn1C)N,0.2163 | |
| N=C1OCC2CC(=O)C12,0.2135 | |
| CCC12CC1C(O)CO2,0.295 | |
| OC1C=CCOCC=C1,0.2168 | |
| CC1C2CC3C2C13O,0.3137 | |
| CCC1(O)CC2CC2C1,0.3265 | |
| C1C2C3CC4(CN1C24)O3,0.2357 | |
| CC1=NCCCCO1,0.2546 | |
| CCC1CC11CCC1O,0.3258 | |
| C1C(=CC(=O)CN1)C=O,0.1256 | |
| CC1(C)CC2(CN12)C#N,0.2597 | |
| Cc1c[nH]nn1,0.2526 | |
| COCC1CC(=O)O1,0.2699 | |
| CCC1CC(C)C1C,0.3548 | |
| N=C1N=CC(=O)NN=N1,0.1689 | |
| CC(=O)c1cnnnn1,0.1461 | |
| CCC#CC1OC2CC12,0.2601 | |
| CCC1CC(CC#C)O1,0.295 | |
| NC1=CNN=C(O)C1=N,0.1575 | |
| CC1(COC1)OC2CC2,0.3216 | |
| COC1CC(CC#C)C1,0.2996 | |
| CC1(CC#C)CC1CO,0.3085 | |
| CC1CC(OC=N1)C#N,0.2654 | |
| N=COC1(CC1)C#N,0.2803 | |
| CN1CCC1C#CCO,0.2529 | |
| CC1C2N3C1C(C)C23C,0.3207 | |
| OCC1C2C3N1C2C3=O,0.2355 | |
| CC1C(CC#C)C1C#N,0.2947 | |
| CC(OC=N)C#C,0.2826 | |
| c1ncn(n1)CC=O,0.218 | |
| ON=C1COC2CC2C1,0.2456 | |
| CNC12CN=C3OC1C23,0.1693 | |
| OC12C3OC1C3NC2=N,0.243 | |
| CC(=O)C1CC2CCN12,0.1961 | |
| CC1=CC(O)C(=O)NC1,0.2513 | |
| CC1CC2OC2(C)C1O,0.3238 | |
| CCOC1C=CC2NC12,0.234 | |
| CC1CC11CC(=O)C1O,0.2156 | |
| N#CC1CCOCO1,0.2959 | |
| CC1OC11C=CC2CC12,0.2384 | |
| C1C2CC3=NON=C3N12,0.2199 | |
| CC(O)C(C=O)C(C)=O,0.2047 | |
| CCC(OC)C(=O)C#C,0.1886 | |
| C1OC2COC=NCC12,0.2579 | |
| O=C1C2C3CC1CC23,0.2266 | |
| CC1COC1C#CCO,0.2693 | |
| CN=C1C=CNC=N1,0.1835 | |
| C1OC2CCC=CC2O1,0.2527 | |
| CC(CNC(N)=O)C#C,0.2949 | |
| CC(=O)C(O)C1CCO1,0.2205 | |
| CC1(CC1)C2(CC2)C#C,0.2857 | |
| CCCC,0.4107 | |
| N=C1CC2=C(O1)N=CN2,0.2092 | |
| CC1OC(=O)NC1CO,0.3054 | |
| c1cnoc1C(=N)N,0.1996 | |
| N=C1C=NON=CC1=O,0.1688 | |
| CC(O)CCCCC=O,0.2288 | |
| CCCOC12CC(C1)C2,0.3385 | |
| CC(C)(O)C(C)(O)C#N,0.3202 | |
| COC1(C)CC2(CN2)C1,0.3195 | |
| CC1OC(=N)C(C=O)=C1,0.1787 | |
| Cc1cc(nc(n1)C)O,0.2278 | |
| CNC(=O)N1CCN=C1,0.2301 | |
| CN1CC(O)CC(=O)C1,0.2043 | |
| Cc1c(nc([nH]1)C)C#C,0.2139 | |
| CC1CC(C)(CC=O)C1,0.2243 | |
| C1NC1C1=CN=CO1,0.2316 | |
| CC1N(C)C(=N)NC1=O,0.2265 | |
| c1ccnc(=O)c(c1)O,0.1514 | |
| Cc1c(c(ncn1)O)F,0.2239 | |
| CC(O)C1C2C3CN2C13,0.2996 | |
| Cc1cc(no1)C(=N)N,0.2116 | |
| CC(=O)C12NC3C1NC23,0.2111 | |
| NC(C#N)C#CC1CO1,0.2636 | |
| c1c(c(c([nH]1)N)O)O,0.2206 | |
| CCCC12OC1CC2=O,0.216 | |
| C#CC1C(C#C)C1C#N,0.2571 | |
| CC(O)C(C)(C)CC=O,0.2242 | |
| C1C2OC3C4OC3C2C14,0.3151 | |
| CC1(C)C=CCC1O,0.2642 | |
| C1CC1C12CC3C1CC23,0.3478 | |
| COc1cocc1CO,0.238 | |
| CC1C2OC1(C=O)C2O,0.2137 | |
| CC1(CC1)N(C)C=O,0.2673 | |
| CN=C1OC(=O)NC1C,0.2663 | |
| COC(C)C(C)C1CC1,0.3347 | |
| COCC1C(O)CN1C,0.2981 | |
| CC(O)(CCC#N)C#N,0.3152 | |
| CC12CCC1(O)CCO2,0.312 | |
| CC12CC1CCCC=C2,0.2509 | |
| NC1CC(=O)NC1=O,0.2264 | |
| N=C1OCC11CC2CN12,0.2555 | |
| CC12CC3(C)CN1C23C,0.305 | |
| CC(O)C#CC(=O)CO,0.2059 | |
| CCC1CCOC1=N,0.2844 | |
| CC(C)Nc1cc[nH]n1,0.2241 | |
| CC(C)(O)C1CC2OC12,0.3201 | |
| Cn1ccc2c1[nH]nn2,0.2133 | |
| CC12OC1CCC2(C)C,0.3279 | |
| CCc1cnc(cn1)F,0.206 | |
| c1coc2c1CC=CC2,0.2307 | |
| COC(C)(C=O)C#N,0.2209 | |
| c1c(nncn1)C(=N)N,0.1675 | |
| CC1C2CCC(C)C12,0.3342 | |
| C1C=CCC11CN=CO1,0.2613 | |
| c1c(c(co1)N)N,0.2312 | |
| NC1=CC(C[NH3+])=C([O-])O1,0.1504 | |
| c1cc([nH]c1)OCC=O,0.1597 | |
| COC1CCC(O1)C=O,0.2228 | |
| CCC1(CN(C1)C=O)C,0.2672 | |
| C1C2NC3=C(OC=C3)C12,0.2015 | |
| Cc1cc(c(nc1)F)O,0.2079 | |
| OC1C2COC(=N)C1O2,0.26 | |
| Cc1cc(on1)C2CC2,0.2346 | |
| CC1(CC1)C12CC(C1)O2,0.3248 | |
| OC1C(C#C)C1(O)C#N,0.2576 | |
| O=COC1CC(=O)C=C1,0.1902 | |
| Cc1cc(oc1C)C,0.228 | |
| O=C1C2C3C2C1C3C#N,0.238 | |
| COC1CC=CC1C=O,0.2103 | |
| O=C1CN2CC12C#C,0.2175 | |
| OC1C2OC(C=O)C12,0.1991 | |
| ON=C1C(O)CC1C#C,0.2423 | |
| CCC#CC1NC1CC,0.2766 | |
| CC1CC2(CC2)CC1O,0.3242 | |
| CC1CC11OCC1(C)O,0.29 | |
| OCCC1OCC11CC1,0.3159 | |
| CC1C2CC2NC1=O,0.2633 | |
| FC1=CN=C(F)C(=N)N1,0.166 | |
| Cc1cc(c(o1)N)NC,0.2064 | |
| C1OC2CC11NC1CC2,0.3169 | |
| OC1C=CCC11CCC1,0.261 | |
| OC1C(O)C1COC=N,0.2736 | |
| OC1C2N3C1CC23C=O,0.2166 | |
| C#CC12COC1CCO2,0.2819 | |
| ON=C1C2C=CC1C=C2,0.2115 | |
| CN1C=CC(=N)C(N)=N1,0.172 | |
| COC1COCC1C=O,0.2281 | |
| C#CC(=O)CCC#N,0.21 | |
| OC1CC2OCC=CC12,0.2514 | |
| N#CC1CC2(CCO2)C1,0.2885 | |
| NC(CC1CCO1)C#N,0.2805 | |
| CN=C1C=C(N)NN=N1,0.1545 | |
| CCC1CCC1(C)CO,0.3349 | |
| COC1C2C3NC1C23O,0.2786 | |
| CNC(=O)C(C)C#CC,0.2707 | |
| CC(OCC#C)C(C)=O,0.2287 | |
| OC1CCC11CC(=O)C1,0.223 | |
| CC(CO)NCC#N,0.2677 | |
| NC1=NCC2OC1C2O,0.2408 | |
| CCCCC1CC(=N)O1,0.2898 | |
| C1OC1C1CC2OC12,0.3342 | |
| CCC(CC)(CO)O,0.3021 | |
| CN1CC2OCCN=C12,0.2445 | |
| OC1C=CCC(=O)C1O,0.2183 | |
| C1CC23CC4OC2C4N13,0.2976 | |
| Cn1cc(cc1N)OC,0.223 | |
| CC1CC1C1CCC1O,0.3227 | |
| CC12CC1OC(=O)O2,0.3182 | |
| OC1CN2C1CC21CC1,0.2839 | |
| CCN1CC(C)C(=O)C1,0.2055 | |
| CC1C2OC(=O)C2N1C,0.2315 | |
| COC1C2C1C(O)C2C,0.3054 | |
| Cn1cc(oc1=O)O,0.2449 | |
| OCCOC1COC1=O,0.2536 | |
| Cc1ccn[nH]c1=O,0.1787 | |
| OCC1(O)C=CCC1=O,0.2106 | |
| c1(c(c([nH]c1O)N)O)N,0.2078 | |
| CC1C2NC(=O)C12C#C,0.2434 | |
| CN1CC(C#C)C1C=O,0.1975 | |
| OCC(=O)CCOC=N,0.2356 | |
| CC1OC=NCC1C#N,0.271 | |
| O=C1CC23NC12CC=C3,0.2118 | |
| CN1CC1C1(CC1)C=O,0.2048 | |
| OC1(CC(C1)C=O)C=O,0.2069 | |
| OCC1CC11CCC1,0.3253 | |
| OC1(CC#N)C2CC1C2,0.3132 | |
| C1CC12CC(C2)C=O,0.2229 | |
| CCOc1c[nH]nc1N,0.2247 | |
| CC1NC1(CO)C1CO1,0.3154 | |
| C(C#CC=O)C#N,0.2034 | |
| CCC(C)(CC)C(C)C,0.3653 | |
| NC1C2N=CNC12C#C,0.2217 | |
| CC(C)(C#C)C1COC1,0.2919 | |
| N=C1OCC=CC1C#N,0.248 | |
| CC1(CC1O)OC1CC1,0.3151 | |
| CC1C2C3CC4C1N2C34,0.2694 | |
| N=COC(C=O)C#C,0.207 | |
| OC1CN2C1=NOC2=O,0.2398 | |
| CC(N(C)C)C(=O)C#N,0.1515 | |
| CCC12C3C4C(C13)N24,0.281 | |
| CN1C=C([O-])C(C[NH3+])=N1,0.2206 | |
| OC1C2CCCC2C1=O,0.2182 | |
| Cc1nc(co1)C#C,0.2147 | |
| c1c[nH]c(c1O)CC=O,0.1721 | |
| CC1C(C)C1C1CO1,0.3332 | |
| CC1CC2(OC12C)C#N,0.2689 | |
| O=C1CNC2CCOC12,0.2011 | |
| CC(=O)CC(O)CC#N,0.2317 | |
| C#CC1=CNC(=O)C1,0.1819 | |
| C1NC1C1CCN=CO1,0.2728 | |
| CC#CC(C)CC=O,0.2191 | |
| CC12CC1C(C=C2)C#C,0.2469 | |
| Cc1c(c(oc1N)C)O,0.2182 | |
| OC1COC2CC=CC12,0.2609 | |
| c1c(coc1N)NC=O,0.1944 | |
| CN1CC2OC2C1C#C,0.2604 | |
| N=C1C=NON=CC1=N,0.1843 | |
| CC(C)C1CC(O1)C=O,0.2125 | |
| CC(CO)C(C)(C)C#N,0.3193 | |
| O=CC1C2CC1C21CO1,0.2216 | |
| CNC(=O)C1CCC1C,0.2702 | |
| N#CC12OCC1C1CC21,0.2634 | |
| OC1C2C1C1(CC1)C2=O,0.2261 | |
| CCCc1c(cn[nH]1)N,0.2253 | |
| CC1(N)C(C#N)C1C#N,0.2559 | |
| CCC12CC1(O)CCO2,0.2974 | |
| CN1CC2C1CN2C=O,0.2504 | |
| O=CN1CC2(CN2)C1=O,0.2107 | |
| CC1OCC=CC2NC12,0.2479 | |
| CC12C(O)C1C(O)C2O,0.3259 | |
| CC1=CCN(CC1=O)C,0.1745 | |
| Cc1ccn2c1OCC2,0.2295 | |
| CC1COCC1=O,0.2177 | |
| CC12COC(C1)C(=O)O2,0.2536 | |
| CCN=C1OCC11CO1,0.2602 | |
| CC#CC(=O)C(C)(C)C,0.2034 | |
| CC1C2CCC12CC#N,0.298 | |
| Cc1cnc(o1)CN,0.2309 | |
| NC(C#C)C#CC(N)=O,0.2256 | |
| CCCCC1(COC1)C,0.3149 | |
| NC(CCC(N)=O)C#N,0.2746 | |
| CC1(CC(=O)C12CC2)C,0.2179 | |
| CC12C3C4C(C1N34)C2=O,0.2194 | |
| CCOCCCC(=O)C,0.2352 | |
| CCOC(C)CC1CC1,0.3341 | |
| O=CC1OCC2CCC12,0.217 | |
| N#CC1C2C3C4C1C2N34,0.2704 | |
| Cn1cncc1CC#N,0.2447 | |
| CC12OC3C1C2CC3=O,0.2137 | |
| OC1CCC2=C1C=CN2,0.2419 | |
| C#CC1CC1CN1CC1,0.2804 | |
| Cc1c(c(=O)ocn1)N,0.167 | |
| O=C1OC2C3CN1C23,0.2654 | |
| CC12OC3CCC1OC23,0.3068 | |
| c1cnn2c1CC=CC2,0.2414 | |
| CC(=O)C1NC11COC1,0.2214 | |
| CN(C)c1cc(oc1)N,0.2184 | |
| c1c(nc(cn1)F)O,0.1994 | |
| OC1C2CNC(=O)OC12,0.3039 | |
| CN=c1c(cnn[nH]1)N,0.1653 | |
| O=CCC12OC1C1NC21,0.1959 | |
| CN1C2C3C1COC23C,0.2901 | |
| CC1OC(=O)C1C1CN1,0.2563 | |
| CCCCc1nc[nH]n1,0.2679 | |
| CCCCC#CC1CN1,0.2671 | |
| CC1=CC2NC3C1C23O,0.2268 | |
| CC(CC#N)(CO)CO,0.3052 | |
| CC1NC11C2CC2C1O,0.3019 | |
| c1c2c(cnn1)n[nH]n2,0.1615 | |
| C#CC(CC#N)C#N,0.2932 | |
| CC1C2OC(C#N)C12O,0.249 | |
| CC1C2NC(=O)C1C2C,0.2584 | |
| CC#CC1C2CCC12,0.2842 | |
| CCCC(C#C)C#CC,0.2873 | |
| COC1C2CC1C(=O)O2,0.2693 | |
| OC12CN(C1)CC=C2,0.2213 | |
| CCC(C)(O)C=O,0.226 | |
| ON=C1CC(C=C1)C#N,0.1911 | |
| OC1COCOCC1O,0.309 | |
| NC1=CNC(O)=NC1=N,0.1884 | |
| O=C1NCC(C#C)C1=O,0.1696 | |
| COC12CCC1C1CC21,0.3021 | |
| C1C2C3C4OC2CC4N13,0.3014 | |
| FC1=CC(=O)NC(=N)N1,0.2118 | |
| O=C1CCC2CCC2=C1,0.189 | |
| O=C1CC2C3CCN1C23,0.245 | |
| N=C1CC2C(CC2=O)O1,0.2144 | |
| CC1(CCCC=C1)C#N,0.2609 | |
| CC1(CC#N)COC1=N,0.2873 | |
| CC(C)N1C(C)CC1=O,0.2733 | |
| CC12COC3CC1C23C,0.3175 | |
| CC1C23CCC12COC3,0.3088 | |
| CC(C)C1C2OC=NC12,0.2547 | |
| CCC1(C=O)C2CCN12,0.2171 | |
| CC1CC1CC1CN1C,0.303 | |
| c1c(c(c[nH]1)O)CCO,0.228 | |
| ON=C1C2C3C2C2C3C12,0.2414 | |
| CC1OCCC11CN1,0.3173 | |
| COC1C(C)C(O)C1C,0.311 | |
| CC(C#N)C1(O)CC1C,0.3076 | |
| ON=C1C2CC1N2C=O,0.2399 | |
| C1CC(C1)(CC#N)C#N,0.3269 | |
| C1CC1C1OC1C1CO1,0.3358 | |
| OCCC1(CO)CC1O,0.3103 | |
| c1cn(cc1C=O)C=O,0.185 | |
| CC(C)(O)C1(CO1)C#N,0.2835 | |
| CCC1=NOC(=N)C=C1,0.1673 | |
| CC1C2OC2C=CC1O,0.2352 | |
| NC(=O)C1=CN2CC2C1,0.202 | |
| Cc1c(occc1=O)C,0.2018 | |
| CC1COC1(C)C1CN1,0.3123 | |
| CC1CC(C)(C#C)C1=O,0.2091 | |
| CC(O)CC(C)CCO,0.3325 | |
| CC1=CC(O)CC11CC1,0.2446 | |
| OCC1C2C3OCC3N12,0.2747 | |
| C1OC11C2C3CN=C1N23,0.193 | |
| OCC1COCOC1=O,0.2552 | |
| CC1C(O)C2OC12C=O,0.2176 | |
| CC1C2C(C#C)C2C1O,0.2848 | |
| CC1C2CC11CCCC21,0.3456 | |
| CNCc1ncncn1,0.1744 | |
| CC1C(C=O)C1(C)C=O,0.2037 | |
| OC1C2C(O)CC12C#N,0.2682 | |
| CN1C2CCC2OC1=O,0.2998 | |
| COC1(C)C2OC2C1=O,0.1945 | |
| CC(=NC)OCCC#C,0.2779 | |
| COc1cccc(c1)O,0.2198 | |
| CC1=CCC(O)C2NC12,0.2407 | |
| C1CC2C3CC=CC23C1,0.2385 | |
| CC#CCC(=O)C1CN1,0.2181 | |
| C#CC1(CC#N)CO1,0.2837 | |
| CC1OC1(C)C1CO1,0.3326 | |
| C1CC1C(=O)C#CC=O,0.1956 | |
| CC#Cc1c[nH]nc1,0.2229 | |
| C1CN1C1C2C3OC1C23,0.2893 | |
| C[NH2+]C1(CCC1)C([O-])=O,0.2628 | |
| CC1CC1CC1(C)CC1,0.3418 | |
| O=CC12CC3C1N2C3=O,0.2126 | |
| N=COC1=NC=NC=N1,0.2163 | |
| C(COC=O)OCC#N,0.2767 | |
| CC1C2C(C#C)C2C1C,0.288 | |
| CCC(C#CC)C(C)C,0.3022 | |
| OC(C#C)C1C2CC1C2,0.2932 | |
| O=C1OC2OC1C=C2,0.223 | |
| C(#N)c1c([nH]nc1N)N,0.2185 | |
| CC(CC=O)(CC=O)O,0.2061 | |
| OCC1OC23CN(C2)C13,0.2556 | |
| C1CC2COCC3C1C23,0.3133 | |
| COC1CC1C#N,0.2912 | |
| CCC#CC1COC1C,0.2887 | |
| CCC1C2CC1C2,0.3839 | |
| NC1=[NH+]C2=C(C1)N=N[N-]2,0.1322 | |
| c1nc2n(n1)c(no2)O,0.2422 | |
| OC1CC(=CC1O)C#N,0.2188 | |
| C1CC1CC(=O)NC=O,0.2165 | |
| CC1(O)CCC1(N)C#N,0.2767 | |
| CCN=C1NCC1OC,0.248 | |
| CC(C)(O)C1(C)CN1,0.291 | |
| CN(C)c1c(cno1)N,0.2117 | |
| CC12COCC1N1CC21,0.31 | |
| COCC1N2CC2C1=O,0.2184 | |
| COC1C2C3CN=C1N23,0.1913 | |
| CC1(CCC1=O)NC=O,0.2149 | |
| CCC1(CC1(C)C)C#N,0.3104 | |
| CC(C)CC(C#N)C#N,0.3239 | |
| CC1(OCCO1)CC=O,0.2253 | |
| O=CC1CC(C=C1)C#N,0.2112 | |
| CC1CCC2NC12C#C,0.2666 | |
| Cn1cc(nn1)C2CC2,0.2349 | |
| CC12CC1OC1C(O)C21,0.3112 | |
| CC1OC(=N)C2CC12,0.2789 | |
| CCC1OC2CC2C1C,0.3058 | |
| CC(C)(C(N)=[NH2+])C([O-])=O,0.2255 | |
| CC1C2CC(C2)C1C,0.3736 | |
| CC(CO)N=C1CCO1,0.2641 | |
| c1cnnc(n1)F,0.1673 | |
| CN(C=O)C(=N)NC=O,0.2193 | |
| CC1(CC2CC2)CC1O,0.3288 | |
| CC1CC2(OC12)C=O,0.2205 | |
| OC12CCC3C4C(C14)C23,0.3046 | |
| CCC(C#N)C(C)(C)O,0.3068 | |
| CCNc1ncc(o1)N,0.2272 | |
| O=CC12CCC3OC1C23,0.2126 | |
| O=C1OCC23CC(C2)C13,0.261 | |
| CCc1c(oc(n1)C)N,0.2171 | |
| CC(C#N)C1CC(C)O1,0.2931 | |
| CC(C)C12OC1C1CC21,0.2925 | |
| O=C1C2C3N2C1C31CN1,0.2255 | |
| OCC1CC11CN2CC12,0.2898 | |
| CC1C(CC=O)C1C#C,0.2256 | |
| C#CCC1COCC=C1,0.263 | |
| CC(OCCO)C1CC1,0.3365 | |
| CC12CC1OC2C1CO1,0.3054 | |
| CC1OC2C(O)C12,0.3036 | |
| CN1C2C3C(O)C2C13C,0.2836 | |
| N#CC1=CCN2CC12,0.1923 | |
| C(=O)C(C=O)(C=O)C#N,0.2143 | |
| CCC1CCOCC1,0.3309 | |
| CC(=O)C1(C)COC1=O,0.2219 | |
| CCC1OC11CCOC1,0.3252 | |
| CC1CC1C1C2COC12,0.3094 | |
| CC1NCC(=O)NC1C,0.2647 | |
| C1OC1C12COCC1N2,0.3297 | |
| CC1C[NH2+]C1C([O-])=O,0.2621 | |
| c1cc(n2c1CCC2)N,0.2334 | |
| c1cc(ccc1O)F,0.2065 | |
| CC12CCC1(C)C2C#N,0.2981 | |
| CNC(=O)C(O)C(N)=O,0.2474 | |
| CCCN1C=NCC1=O,0.2279 | |
| CN1CC1C1(O)CC1O,0.2828 | |
| CCc1cc([nH]c1N)O,0.2364 | |
| N=C1NC=C(O1)C1CO1,0.2058 | |
| O=C1C=CC2=CCCC12,0.1632 | |
| OCCC1CC1CO,0.3347 | |
| CCCC(O)C#CC#C,0.2238 | |
| CC1OCC(=O)C2CC12,0.2162 | |
| C1CCOC(OC1)CO,0.323 | |
| OCC(O)C(CO)CO,0.2987 | |
| CCC1(CC)OC1C#N,0.2887 | |
| CC(O)CCC1CCC1,0.3337 | |
| CCCC1(CC1)C2CC2,0.3331 | |
| CCCC(O)CCO,0.3287 | |
| O=C1C2CC2C2OCC12,0.2157 | |
| CC(C)CCNCC#N,0.2697 | |
| CC1OC1C1=CC=CN1,0.2321 | |
| CC(C1CO1)C(C)(C)O,0.3333 | |
| CCOc1cc(c[nH]1)N,0.2341 | |
| OC1CCC2=CON=C12,0.2392 | |
| c1coc(=O)nc1C=O,0.1569 | |
| CN=C1OC2CCC1C2,0.2759 | |
| COCC12CCC1N2,0.3362 | |
| CC12CC1(C)C(CO)O2,0.3046 | |
| O=C1CC23CC2(CC3)C1,0.218 | |
| CC(C)NC(C#N)C#N,0.2499 | |
| Cn1cccnc1=O,0.18 | |
| C1CC11CN2CC(C2)O1,0.3005 | |
| N#CC12CC(C1)C21CC1,0.3082 | |
| CCC1C2C3C(C)C2C13,0.3672 | |
| C#CCCNC(=O)N,0.2999 | |
| CC(CO)(CO)C#C,0.296 | |
| CN1CC(=O)CCC1=O,0.2147 | |
| CC1(C)OC(=O)CC1O,0.2767 | |
| OC(C#N)C1=NCCO1,0.2632 | |
| CC1C2OC1C1CCC21,0.3262 | |
| OC1C[NH+]2C=CC(=O)[C-]12,0.1493 | |
| CCCOC(C)C1CO1,0.3395 | |
| N=C1C=NON=C1C#N,0.1854 | |
| OC12CC(C1)CC21CC1,0.3181 | |
| CC(CCO)C1(O)CC1,0.3285 | |
| CCC(O)C#CC(C)=O,0.2084 | |
| NC1=CN=C(O1)C1CO1,0.206 | |
| OC1C(O)C11CC2NC12,0.277 | |
| CN=C1OCC1OC=N,0.2604 | |
| O=C1OC2CC(C2)C=C1,0.2138 | |
| CC1=CC2OCC2C1=O,0.1922 | |
| CCC(C)C(=O)C(N)=N,0.1954 | |
| Cn1c(c(oc1=O)O)N,0.234 | |
| OCC12OC1C(O)C=C2,0.2412 | |
| C1CN1C(=O)C(=O)CO,0.1759 | |
| CC(=O)C(C#C)C1CN1,0.2218 | |
| Cc1c(nc(o1)CO)N,0.2079 | |
| CN1C2CCOCC12C,0.3005 | |
| c1cc(=O)[nH]c(c1N)N,0.17 | |
| CCC(CCOC)C=O,0.2265 | |
| [NH3+]C1C2OC(C12)C([O-])=O,0.1452 | |
| CCC1CNC(=O)NC1,0.2937 | |
| CCC1(CO1)C(C)C=O,0.2197 | |
| CCNC(=N)C=O,0.1702 | |
| CC(C)(CCC#C)OC,0.3109 | |
| CC1OC2C1CC2(C)O,0.3039 | |
| CC1(CC1C#N)C1CN1,0.2813 | |
| CC1(O)CC1C(O)C#C,0.2835 | |
| c1c2c([nH]n1)COC2,0.2469 | |
| CC12CC3C1N3C2C=O,0.2135 | |
| CC(C)CCCCC#N,0.348 | |
| c1c[nH]ncc1=NO,0.1575 | |
| CC1CCC2OCC12,0.3206 | |
| CC1(C=O)C2OC=NC12,0.2253 | |
| CCC(C)(C=O)C(C)=O,0.2059 | |
| CCC1C=CCC2OC12,0.2658 | |
| CCC12OC3C1OC23,0.2965 | |
| CC1OCC(O)C11CO1,0.2972 | |
| CCC1(C)COC=N1,0.2714 | |
| CC1CC1(C)C(C)(C)O,0.3198 | |
| CC1OC2CC1(O)C2,0.3026 | |
| c1(c(c([nH]c1O)O)N)N,0.2126 | |
| COC1=NC(=N)NN=C1,0.1623 | |
| CCOC1(CO)CC1C,0.31 | |
| N=C1OCCOC1C=O,0.2277 | |
| C1CC(=O)C(=C1N)C#N,0.2016 | |
| CC1OCOC(=O)C1N,0.2447 | |
| C1CC1C(CO)CO,0.3198 | |
| CN1N=CC(O)=CC1=N,0.1582 | |
| CCC1=CC2C(O)C2C1,0.2333 | |
| CNC1C(O)C(O)C1=O,0.189 | |
| CCCCC1CC1CC,0.3525 | |
| CNC(=O)N1CC=CC1,0.2373 | |
| CC(C)N1CCC1C#N,0.2551 | |
| N=C1N=CNN=C1C#C,0.1646 | |
| c1c(nn(n1)C=O)CO,0.2119 | |
| CC(OCCC#N)C=O,0.2274 | |
| OC1C2CCNC(=O)C12,0.2479 | |
| c1cnc(cc1O)C=O,0.1852 | |
| CC(C)(C)C(=O)CC#C,0.2279 | |
| CC1CC2(CC3OC23)O1,0.3126 | |
| CC(C)NC(=O)C(=O)N,0.2111 | |
| C1C2CCC3CCC3C12,0.3291 | |
| CN=COCCCO,0.2728 | |
| CCC1(CO)CC(=O)N1,0.2826 | |
| CCC1C2OC(C)(C)C12,0.3161 | |
| C1CN1CCC(=O)C#N,0.1635 | |
| CCC(=O)COC=N,0.2212 | |
| CC1C=CN2N=NC=C12,0.2104 | |
| CC1=C(O)C=CC(=N)O1,0.1497 | |
| C1CN2C(=N1)C=CC2=O,0.1648 | |
| CC12CCC1CCC=C2,0.266 | |
| COC(=O)CCC#C,0.2738 | |
| OC1C2C1C1OCOC21,0.3211 | |
| CC12OC1C1(CN1)C2=O,0.2017 | |
| CC12CC3(CO3)C1C2O,0.3271 | |
| CCC#CC(C)(O)C=O,0.2127 | |
| C[NH2+]CCC([O-])=O,0.2763 | |
| CC12CC3OC(CC1)C23,0.3148 | |
| CC1(CCOC1=N)C=O,0.2264 | |
| CC1OC(C)C=C1,0.248 | |
| CC1N2CC(O)CC12C,0.282 | |
| N=C1C=NOC=N1,0.2028 | |
| c1c(=O)nc(oc1O)F,0.2241 | |
| CC1=CCCC11CO1,0.2501 | |
| Cn1c(c(cn1)OC)O,0.2298 | |
| OCC(=O)C1OC1C#C,0.2232 | |
| CC1=NNC(=N)C(O)=C1,0.1746 | |
| CC1C2N1C1CC21CO,0.2808 | |
| CC1CC(O)(CC#C)C1,0.2918 | |
| CCC1(C=O)C(C)C1C,0.231 | |
| C1C2(N1CCO)COC2,0.3086 | |
| COCC(C)C#CCO,0.2785 | |
| CC1OCC11CC1C=O,0.2242 | |
| NC1=COC([O-])=C1C[NH3+],0.1345 | |
| CN1C2C3C(=O)C1C23C,0.2155 | |
| OCC12CN(C1)C21CC1,0.2929 | |
| COCC1(CC=O)CN1,0.2285 | |
| C1OC2C3OCC1C23,0.3045 | |
| ON=C1C=CC2CC1C2,0.1889 | |
| CC1=C(C)CC(CO)C1,0.2542 | |
| OCC1CC2NC2C=C1,0.2497 | |
| CC1(C#N)C(O)C1C=O,0.216 | |
| Cc1c([nH]c(=O)[nH]1)CO,0.219 | |
| CC1(CC=O)NC1C=O,0.1976 | |
| OC12CCN3C1CCC23,0.2915 | |
| OCC1(CC=CC1)C=O,0.2201 | |
| CCC(=O)C(C)C(C)O,0.2261 | |
| OCC1CNC(CO)=N1,0.2465 | |
| OCC1C2NC2C1C#N,0.2668 | |
| CC1OC1C(=O)NC=N,0.2312 | |
| CC12C3C4N3C1C24C#C,0.2313 | |
| CC1CC2(CO)OC12C,0.323 | |
| CC#Cc1nnon1,0.1988 | |
| CC(O)C1NC1C,0.3164 | |
| C#CCCC(=NO)CO,0.248 | |
| CCN=C1OC(C)C1N,0.2633 | |
| OC1COC2(CC2)C1O,0.3101 | |
| Cc1ccnc(c1O)O,0.2046 | |
| CC1CC(O)C2C(O)C12,0.3051 | |
| CC1C2C3OC3CC12C,0.3245 | |
| OCC12CC(O)(C1)C=C2,0.2394 | |
| c1cnoc1C#CC#N,0.1796 | |
| c1coc(=O)o1,0.2556 | |
| COC1C2NCC(=O)C12,0.2008 | |
| N#CC1CC(C=C1)C#N,0.2646 | |
| C(C#CC(=O)C=O)C#N,0.1535 | |
| CC1=C(C(=O)OC1)C#N,0.2108 | |
| C1CN1CCCCC#N,0.2773 | |
| CC#CC1C2OC=NC12,0.2373 | |
| N=C1C=NOC=CC1=O,0.1696 | |
| CCCCOC(=O)NC,0.3159 | |
| CCCC1CC1C#N,0.3164 | |
| CC1CCC(O)C11CN1,0.309 | |
| CN1CC11C2C3CC2C13,0.3168 | |
| CCC1(O)CC2OC2C1,0.3257 | |
| CC12OC3C(C=C1)C23,0.2288 | |
| Cc1c(nc(n1C)O)O,0.2326 | |
| c1cc(nc(c1F)N)O,0.1917 | |
| OCC1CC2OC2C1O,0.3076 | |
| CC(C)(C)CCCC#N,0.3481 | |
| CNCC(=O)C#N,0.1552 | |
| CC(C#N)C1CC1C#N,0.318 | |
| N=C1CCC(=O)N1C=O,0.2147 | |
| CC(C)C1OCC2OC12,0.3337 | |
| O=C1OC2C3CC1C2O3,0.2658 | |
| CC(=O)NCC1CC1,0.2771 | |
| N=C1ON=CC(=O)N=C1,0.1659 | |
| CN(C=N)C(=O)N1CC1,0.2401 | |
| O=COC12C3CC1CC23,0.2589 | |
| Cc1ccc(cc1C)O,0.2151 | |
| CC1=CC(=O)CC2OC12,0.1837 | |
| CC1CN2C(C=O)C12C,0.2022 | |
| O=COC1CCC1C#N,0.2853 | |
| c1c(c(ncn1)C=O)N,0.1498 | |
| CN=COc1ccc[nH]1,0.2154 | |
| c1c[nH]nc1NC=N,0.2207 | |
| [NH3+]C1CCC1CC([O-])=O,0.1266 | |
| C#CC12CN3C1CCC23,0.2745 | |
| C#CC(=O)c1ncno1,0.184 | |
| OC1C2C=CC(O)C12O,0.2258 | |
| CCC1(NC2CC12)C#N,0.2559 | |
| CC1=CC2C3CC1C23O,0.2357 | |
| C#Cc1cn[nH]c1N,0.2227 | |
| CC1CC(CC#C)C1O,0.2951 | |
| OC12C3COC1C(=O)C23,0.2151 | |
| NC1=C(N)C(=N)NN=N1,0.1487 | |
| CC(=O)C1C2NC2C1=O,0.2103 | |
| C1CC1C#CC#CCO,0.2119 | |
| CC1N=C(N)C(=O)C1=O,0.117 | |
| CCn1cc(cn1)OC,0.2282 | |
| CC(=O)NCC(O)CO,0.2778 | |
| C1C2C3OC4CC3N2C14,0.2954 | |
| N#CC1=CCC2NC12,0.2097 | |
| CN1C(C#C)C1(C)C=O,0.2032 | |
| CC1CC1N1C=CN=C1,0.2504 | |
| CC1CC(CO1)OC=N,0.273 | |
| CCOCC1(C)NC1C,0.3195 | |
| CC1=COC(O)=NC1=N,0.2126 | |
| CC1=CC=CC2OC2C1,0.1854 | |
| O=CC1CCC(C1)C#C,0.2275 | |
| OC1COC2=COC=C12,0.2185 | |
| COC(CC1CC1)C#C,0.2997 | |
| C1CC23CC(CO2)CC13,0.3117 | |
| C#CC12CC3CC1C23,0.2729 | |
| CCOCC#CC(C)O,0.2837 | |
| CN=C1N2CC2C1(C)O,0.2399 | |
| CC1C2CC2CC2OC12,0.3374 | |
| N#CC1CCOCCO1,0.2839 | |
| CC12OC1C(O)CC=C2,0.2411 | |
| CN1CCn2c1ncc2,0.2306 | |
| CNC1(C#N)C2CCC12,0.2588 | |
| CC1NC(CC#N)C1=O,0.2164 | |
| OC12CC(C1)C1OCC21,0.3136 | |
| CN1CCCCC1C#N,0.2635 | |
| CC(=NC1CCC1)OC,0.2681 | |
| C1OC11C2COCC1N2,0.3126 | |
| CN=C1C(=O)CCN1C,0.1578 | |
| c12c([nH]nc1[nH]nn2)N,0.1821 | |
| CC#CC(=O)CCCO,0.2094 | |
| C(CNC(=O)N)CO,0.303 | |
| COC1CCOCOC1,0.3304 | |
| CC1CC(O)C1(C)C#C,0.293 | |
| CN1C2CC(=O)C12C,0.2089 | |
| NC(=NCC=O)C1CO1,0.2249 | |
| CC12CN3C1C(O2)C3=N,0.2234 | |
| C(Cn1nnnn1)CO,0.2446 | |
| C#CC1CC2OC12C#C,0.2601 | |
| OC1=C(F)C=COC1=N,0.1684 | |
| OC12CC(OC1)C21CO1,0.2999 | |
| C#CCOC(C#C)C#C,0.2601 | |
| O=CN1CC2CC1CO2,0.2703 | |
| c1cc(nccc1=O)O,0.1598 | |
| CCC1(C)OC2C(O)C12,0.2958 | |
| CC1(C=O)C2OCC12O,0.2215 | |
| COCC1CCCC1,0.3356 | |
| OCC1CC2C(O)CC12,0.3171 | |
| COCCC1OC1C#N,0.2593 | |
| COC1CC11COC1,0.3106 | |
| CCc1ccc(cn1)N,0.1931 | |
| CC1C(=O)COC1=O,0.2129 | |
| COC=NC1CC1CO,0.2474 | |
| CC1=CC2CCN2C1=O,0.2127 | |
| CNC1=NC(=N)C=CO1,0.2056 | |
| NC1=C(C=O)C(=N)OC1,0.1849 | |
| C#Cc1c(cc([nH]1)N)O,0.186 | |
| CC(C)C1(CC1)C#N,0.3196 | |
| CC(O)C1=CNC(C)=N1,0.2446 | |
| CCC1(CC)C2COC12,0.306 | |
| CC1(CC1)N(C=N)C=O,0.2327 | |
| CC12CC3(O)C1COC23,0.2974 | |
| C1CC23CC4(COC24)N13,0.252 | |
| OCCCC(O)C=O,0.2292 | |
| CC#CC1CC(=O)O1,0.2734 | |
| FC1=CC(=N)OC(=O)O1,0.2228 | |
| N#CC12NC1C1OCC21,0.2496 | |
| CCc1conc1OC,0.2511 | |
| c1c(=O)cc([nH]c1O)O,0.2194 | |
| CCOC12C3CC1CC23,0.3205 | |
| CC1=CC(=NC)OC1=O,0.1896 | |
| C#CC1COCOC=N1,0.2596 | |
| CC(C(C)=O)C(=O)CO,0.2264 | |
| CC(C)(C#C)NC=O,0.2748 | |
| CC1(CC1)C(CO)C#C,0.304 | |
| CCC1(CC(C)C1)C#N,0.3354 | |
| NCC(=O)OC(=N)C#N,0.1877 | |
| CN(C=O)C1CC1O,0.2649 | |
| N=C1CC2NC2C(=O)N1,0.2335 | |
| C#CC12CCN1C=NC2,0.2406 | |
| C1N2CC11N=COCC21,0.2397 | |
| CC1(CC1)N=C2CCO2,0.255 | |
| C1NC1C12CC1CO2,0.3003 | |
| OCCCC1CN1C=O,0.2529 | |
| CC1COC1C1CN1C,0.2966 | |
| CCC1(C)CC(O)CO1,0.3139 | |
| CCc1nc(co1)OC,0.2158 | |
| CN1C2(C)CCC12C#C,0.2679 | |
| CC12CN=CN1CC2=O,0.2071 | |
| CCCn1c(ccn1)N,0.2436 | |
| C1C2OC3C4C3C2C14,0.3099 | |
| CC1C(C=O)C1(C)C#C,0.2142 | |
| OCC1OC2CCOC12,0.3195 | |
| CCCC(C)(O)C#C,0.3007 | |
| CCNc1cc(co1)C,0.2209 | |
| CC1=NC2CC2C(=O)N1,0.2276 | |
| CCOC1C(O)CC1O,0.304 | |
| OC(CC#N)C1CC1O,0.2638 | |
| CN1C2CC1C(=O)OC2,0.2375 | |
| CC12CC3CC1C1C2N31,0.3283 | |
| CC#CCn1nnnn1,0.2341 | |
| [NH3+]C(CC([O-])=O)C#C,0.2642 | |
| c1c(nncn1)N,0.1679 | |
| CC1(COC=N1)C(N)=O,0.2497 | |
| Cc1ccnc(n1)F,0.2159 | |
| CC1=CC2CC1(CO)C2,0.2376 | |
| CCC12CC(O)C1(C)O2,0.3108 | |
| Cc1cc(on1)N,0.2344 | |
| CC(O)(C#C)C#CCO,0.2698 | |
| CC1C(O)C2CCOC12,0.2935 | |
| C#CC(C1CN1)C1CO1,0.2802 | |
| CN1CC(=O)C1CC#C,0.203 | |
| CCNC(=O)OCCO,0.3116 | |
| CCCCC1CCO1,0.3293 | |
| CC(C)C1CN1C(C)=O,0.2567 | |
| CC12C3CC(=O)C1OC23,0.212 | |
| OCC12CN1CCCC2,0.2925 | |
| OC1C2NC=CC(=O)C12,0.1789 | |
| CC(C=O)C(=N)NC=O,0.1994 | |
| CC(=O)C(O)C1COC1,0.2175 | |
| NC1=CC=COC1=N,0.1604 | |
| CCC1CCC1(O)CC,0.3188 | |
| CCCC1C2OCC12O,0.2872 | |
| c1(c(nc(=O)on1)O)N,0.1701 | |
| C1C2NC2C=CC2OC12,0.2529 | |
| CCC(=O)CN=COC,0.2218 | |
| N=C1COCC(N1)C=O,0.1897 | |
| COC1CC(=O)NC=C1,0.2123 | |
| CC(C#CC=O)C(C)=O,0.187 | |
| CC1=NCCNC(=O)N1,0.2424 | |
| NC1C2COC12C#N,0.2304 | |
| CC1CC2(C)CC2(C)O1,0.3023 | |
| C1C2NC1C1=NNN=C21,0.226 | |
| c1c(non1)CC2CC2,0.2525 | |
| OC1CN2CC2CC1=O,0.2051 | |
| CC1C(O)C2=CN=CN12,0.2502 | |
| CC1C2CC=CC(O)C12,0.2621 | |
| COCC12CC1C(=O)O2,0.2756 | |
| CCc1cnnn1C=O,0.2025 | |
| CC1OC(=O)C1(N)CO,0.2464 | |
| COCC(C#C)C(C)C,0.3121 | |
| c1c(c[nH]c1O)C(=O)N,0.1986 | |
| COC=NCC(F)(F)F,0.2722 | |
| CC(=O)CC#CC#N,0.2295 | |
| Cc1c[nH]cc1C=O,0.1934 | |
| CC(C)C(C#N)C1CO1,0.3102 | |
| c1cnc(cn1)CC#N,0.1962 | |
| CN1C2CC(N)C12C#N,0.2496 | |
| OC12C3CC11CCC2C31,0.3358 | |
| CN1C2C3C1C(O)C23O,0.2617 | |
| CC12CC=C(C#C)C1N2,0.1954 | |
| CC#CC(C)C(N)C#N,0.2746 | |
| CC(O)(CC(N)=O)C#C,0.27 | |
| CC1CC2(CC12)C#N,0.289 | |
| O=CC1(NC2CC12)C#N,0.2035 | |
| C1COCC(=N1)NC=O,0.2206 | |
| C#CCc1[nH]nc(n1)N,0.2324 | |
| O=CC(C=O)C1CO1,0.2066 | |
| OC12CC3OCC1OC23,0.2885 | |
| CC(C)OCCC1CO1,0.3361 | |
| C1C2OC3CC2C13,0.3369 | |
| CC12CC(C1)C2C1CC1,0.3577 | |
| Cn1c(noc1=O)N,0.2576 | |
| c1c2c([nH]n1)OCO2,0.2238 | |
| CCN1CC(C1)OCC,0.2942 | |
| CC1CC2C3C1OC23C,0.3063 | |
| CCC(=O)C1CCC=C1,0.2144 | |
| COc1c(cc[nH]1)CO,0.2371 | |
| OC12CC1C1CC2C=C1,0.2475 | |
| C#Cc1cc(oc1N)N,0.2006 | |
| O=C1NC(C#C)C2OC12,0.2514 | |
| CC12CC1CCC(=O)C2,0.2243 | |
| CCC(C)(N)C(F)(F)F,0.3286 | |
| CCCC1=CC(=O)CC1,0.1938 | |
| OC1CCCC11CCC1,0.3182 | |
| Cc1ccc(c(c1)C)N,0.2041 | |
| Cc1c2n(cn1)CC=C2,0.1787 | |
| CC1(CC2(O)CC12)C=O,0.2256 | |
| CC(O)C1(C)OC2CC12,0.3059 | |
| CC12CC3CC1C23C,0.3215 | |
| C1OC2C3CC=CC12O3,0.2258 | |
| CCC1(O)COC11CC1,0.2837 | |
| COC1CC2OC=NC12,0.2638 | |
| O=CC1CC2N=COC12,0.2225 | |
| CC1C2(C)COC12CO,0.2928 | |
| CC1=CCC2CC1O2,0.2418 | |
| OC1COC2CC(=O)C12,0.209 | |
| C#CC1C2CC1C1OC21,0.2971 | |
| CC1(OC2CNC12)C#C,0.26 | |
| COC(=O)c1conn1,0.2323 | |
| COCC1CC1,0.3419 | |
| O=C1NCC2COCC12,0.2731 | |
| C1C(CO1)CNC=O,0.2725 | |
| CC1C(C)C11CC(=O)C1,0.2213 | |
| O=CC1NC=NC1C#N,0.2028 | |
| COCC1CC(N1)C#N,0.2656 | |
| OCCC12NC1CC=C2,0.2456 | |
| CC(C#C)C(C)C1CO1,0.3106 | |
| O=CC1COCC11CC1,0.2235 | |
| OC12C3C=CC1C=CC23,0.2367 | |
| CCC1=C(NC(=O)C1)C,0.2096 | |
| CC(=O)C1C=CNC1=O,0.2043 | |
| CC12C3N1C1C=C2C=C31,0.1417 | |
| Cc1cc2c([nH]1)[nH]cn2,0.2164 | |
| CCC(C)(CO)OC,0.3158 | |
| CCC(CC)C1CC1,0.3523 | |
| OC1CC2(CC=O)CC12,0.2207 | |
| N=COC1CC2OCC12,0.2652 | |
| CC(C=O)C1CN1C=O,0.2064 | |
| CC(OC(N)=O)C1CN1,0.2936 | |
| CC1C2CC(OC=N)C12,0.2813 | |
| COCC(N)C(=O)OC,0.2578 | |
| CC1(O)C2CC3OC1C23,0.298 | |
| C1C=CCC(=O)C1=O,0.1602 | |
| CC1CN(C=O)C1=N,0.2293 | |
| OC(CC(=O)C#C)C#C,0.1998 | |
| C1C2NC3=NON=C3C12,0.2052 | |
| C1NC11CCCOC1,0.3192 | |
| OC(C#N)C(=O)C#C,0.2094 | |
| CC1CCCC(=O)NC1,0.2699 | |
| CC1CC2(CC2)C11CC1,0.3286 | |
| CCC(C)N1N=CC=N1,0.2581 | |
| OCC1NCCNC1=O,0.252 | |
| c1c([nH]c2n1cnn2)N,0.2258 | |
| O=C1OC=NC2CCC12,0.2402 | |
| CC(O)(CO)C#CC#N,0.2284 | |
| O=CN1C2C3CC=C1C23,0.1473 | |
| OCC1=CC2OCC1O2,0.2431 | |
| CCC(C)C#CC(C)C,0.3 | |
| Cc1nc(=O)n(nn1)C,0.1638 | |
| C1C2CN1C1=C2ON=C1,0.2188 | |
| c1cc([nH]c1)OC=O,0.2083 | |
| CN1CC1CC(C)(C)C,0.2922 | |
| CC(=O)C1(CCC1)C,0.2288 | |
| COC(C)C1CC(C)O1,0.3263 | |
| CCC(CCC=O)C#N,0.2283 | |
| CCN=C1C(O)C2CN12,0.2402 | |
| C1CN(C(=O)C=C1)C=O,0.1857 | |
| O=CC1CC2CC(C1)O2,0.2181 | |
| NC(=O)C1CC(N1)C=O,0.2129 | |
| CC1(C)CC2(O)COC12,0.2966 | |
| CC1(C)CN2C(C#C)C12,0.259 | |
| COC1(CC1)C#CC#N,0.2164 | |
| CC#CCOCC1CC1,0.2835 | |
| CC1CCC(C1)OC=O,0.286 | |
| C#CC1(CN1C=O)C#C,0.2421 | |
| C1CN1CCC(F)(F)F,0.3302 | |
| O=CC1C2CC(=O)NC12,0.2142 | |
| CC(O)C1NC11CCC1,0.309 | |
| CC(CC#N)NC(C)=O,0.276 | |
| c1c(coc1N)CO,0.2234 | |
| CC1(CC2NC2C1)C=O,0.2293 | |
| C#CC1C2C3C4C3C2C14,0.288 | |
| CC1CCC2COC1C2,0.3096 | |
| CCC(C)C1CC1(C)C,0.3361 | |
| COC1CC2CCC12C,0.3225 | |
| CC12OC3COC1C23O,0.277 | |
| CC1=CC2(C)CN2C1=O,0.2008 | |
| CCOC1CCC=CC1,0.2682 | |
| OCC1COC(=N)C1,0.2856 | |
| CC(C#N)C#CC(C)=O,0.2066 | |
| CC1C2CC1C1CC21,0.3488 | |
| C1C2C3OC22C=CC1C32,0.2246 | |
| O=CC1=C2COC2CC1,0.1852 | |
| C1CC23C4C5C4C12CN35,0.2572 | |
| OCC1C2CN=COC12,0.2757 | |
| OCC12CCC3OC1C23,0.2902 | |
| CC#CC(O)C(C)C#N,0.2836 | |
| Cc1c(cnn1C)NC,0.2146 | |
| CC1OC(=O)C2OC12,0.2508 | |
| NC(=O)C1OC2C(O)C12,0.215 | |
| CN1C(=O)CC=C1C#N,0.177 | |
| OC1CC1C1=CCOC1,0.2365 | |
| NC(=O)C1OCC1=O,0.2031 | |
| CN=C1CNC(=O)CO1,0.2589 | |
| O=C1NC=CC11CO1,0.194 | |
| CCC1=CC2CC1C2=O,0.2413 | |
| CC1C(O)C2(C)OC12C,0.3205 | |
| CC12CC3C(CO1)C23O,0.2934 | |
| OC1CC11C=CCC1O,0.2485 | |
| OC1CC=CC1C#N,0.2659 | |
| CC1CC=C(C#C)C1=O,0.1854 | |
| N=C1OC2C3CC1NC23,0.2485 | |
| C1C=C(C(=O)O1)CC=O,0.2 | |
| CC#Cc1cnoc1N,0.2099 | |
| OC1CC=CC(=O)C1O,0.182 | |
| c1ccc(=O)[nH]c(=O)c1,0.1632 | |
| OC(CCC#N)C1CO1,0.313 | |
| CC1(O)CC2(CN2)C=C1,0.2412 | |
| OC1C2OC3(CC3)C12,0.2899 | |
| CCn1cc(nc1)OC,0.2244 | |
| C#CC1C2C3CC3C12,0.2554 | |
| CC1CC(CO)C=C1,0.2624 | |
| OC1CC1(O)CNC=O,0.2721 | |
| C1OC23CC4CC12CC34,0.3096 | |
| OC1COCC(=O)C1O,0.2094 | |
| C(CCO)CNC=O,0.2824 | |
| CC1N2CC11OC(=O)C21,0.2183 | |
| [NH3+]C1(CC1)C1=N[N-]N=N1,0.2661 | |
| C#CC1(CC(=O)C1)CO,0.2211 | |
| OC1C=CCNC1=O,0.2516 | |
| c1c([nH]cn1)OC=O,0.2198 | |
| Cc1c([nH]nn1)NC=O,0.2049 | |
| CC12C3C4C3N1C4C2=O,0.2098 | |
| OC1CC1(C=O)C1CO1,0.2092 | |
| CC1OC(OC1=N)C#N,0.2876 | |
| CC1C(=N)OCC1=O,0.2182 | |
| O=C(C#C)C1(CN1)C#C,0.1822 | |
| N=C1OC2C3CC3C2=C1,0.2021 | |
| CC12CC=CC3OC1C23,0.224 | |
| OC12COC1C1(CN1)C2,0.2906 | |
| C(CCOCC=O)CO,0.2293 | |
| C1CC11OC2CN3C2C13,0.3013 | |
| C#CCC1(CO1)C#N,0.277 | |
| CC1NC2C1C2(O)C#N,0.2462 | |
| CC12COC(CCC1)O2,0.3263 | |
| OCCCC1CCC1=O,0.2197 | |
| CN1C(=N)ON=C1C,0.2279 | |
| COCC(O)C(C)(C)C,0.3226 | |
| OC12CCC1C21CCC1,0.3062 | |
| CC(CO)C(C)(C)C#C,0.3172 | |
| CC12CCC3C4C3C1C24,0.2842 | |
| CCCCCCCC,0.3858 | |
| O=C1CC2NC2C1,0.2263 | |
| OCC12OC3CCC1C23,0.2945 | |
| CC1(C)C2CCC1C2=O,0.2285 | |
| CCN(C=NC)C(=O)N,0.2446 | |
| NC1=COC(O)=NC1=N,0.1925 | |
| C1CC1(CO)C#CCO,0.2732 | |
| CC(O)C1C2OC1C2=O,0.2458 | |
| CC1C2CC1(C2)N1CC1,0.3167 | |
| O=C1CC2OCC=CC12,0.2115 | |
| CCCOc1ccc[nH]1,0.2415 | |
| N=C1ON=CC=NC1=O,0.1673 | |
| c1nc2c(o1)CNC2=O,0.2298 | |
| CC(C)C(=O)C(=N)NC,0.1715 | |
| C1C(=O)OCC(=N1)N,0.2469 | |
| O=C1CN2CC(C#N)C12,0.207 | |
| c1nc(nn1C=O)CN,0.1838 | |
| c1cnc([nH]1)OCC#N,0.2241 | |
| OCCC1(CN1)C=O,0.2228 | |
| C#CC1CCC(O1)C#N,0.2858 | |
| CN(C)C(CO)C(C)=O,0.1873 | |
| C1C2CC3C4CCC12C34,0.3331 | |
| C1C=CC2N=COC12,0.2557 | |
| CC12OC3(C)C1OC23C,0.307 | |
| ON=C1CC2OCCC12,0.2447 | |
| CCC(C)(C=O)N1CC1,0.1886 | |
| O=CNC1CC11CCC1,0.271 | |
| CCC#CC(C)(C)C=O,0.217 | |
| c1cn[nH]c1CNC=O,0.2434 | |
| CCC1=C(C)CCC1O,0.2513 | |
| CC1CC2CCC2O1,0.3129 | |
| CC1OC2C3CC12OC3,0.2841 | |
| Cc1cnoc1C(C)C,0.2391 | |
| CC1C(NC1C=O)C=O,0.1996 | |
| CC(O)C1=NC(C)=NN1,0.2626 | |
| C1C=CC23C4C5C(C24)C135,0.2157 | |
| N#CC1CC2CNC2=N1,0.2482 | |
| OC1(CC1)C1CCO1,0.3088 | |
| OC1CC(O)C2NC12,0.3118 | |
| CCc1nc(=O)nco1,0.2129 | |
| OC1C=CCCC1C#C,0.2594 | |
| CC1C=CC2COC1C2,0.2556 | |
| COCC1COCC1=O,0.2178 | |
| C1C=Cn2c1nc(n2)O,0.1908 | |
| CC12CCC3OC1C23O,0.2852 | |
| OC(C=O)C1=NNC=C1,0.2131 | |
| COC1CC(C)C1,0.3303 | |
| CC(=O)n1cnc(n1)N,0.1849 | |
| CCC1OC2CC(C)C12,0.3094 | |
| CC1NC11C2NC2C1=O,0.2114 | |
| CCc1ncc(n1C)O,0.2356 | |
| OC1C(C=O)C1C1CC1,0.2224 | |
| C#CC1C2CC1(C2)C#C,0.2749 | |
| CC1(C)CC(O)C(=O)C1,0.2227 | |
| c1(=O)c(=O)onc([nH]1)N,0.1885 | |
| CC(=O)c1ccncn1,0.1707 | |
| N#CC1C2CC2C11CC1,0.292 | |
| c1c(c([nH]c1N)O)N,0.2152 | |
| C1Cn2c1nc(n2)C#N,0.2346 | |
| O=CC1(NC1C#N)C#N,0.2197 | |
| CCc1nc(on1)N,0.251 | |
| COCc1c(n[nH]n1)O,0.2342 | |
| CC12CN3C(C=C1)C23,0.2295 | |
| OCC1CCC=C1,0.2641 | |
| C1CC2=CCC(=O)N2C1,0.2067 | |
| C1CC1OC(=O)CN,0.2603 | |
| CNC1(C#N)C(C)C1C,0.2565 | |
| Cc1c2c(co1)[nH]cn2,0.1833 | |
| C#CC12N=CN3CC1C23,0.2158 | |
| OCC1CC1C1CCC1,0.334 | |
| C1C=CCOC=N1,0.2555 | |
| c1nn(c(=O)o1)CCO,0.2417 | |
| CN=C(C#C)OC1CC1,0.2225 | |
| c1[nH]c(c(n1)NC=O)O,0.1889 | |
| CN(C=O)C(CN)C#N,0.2663 | |
| O=C1CCCCC1C#C,0.2166 | |
| [NH3+]C1C2CC1(O2)C([O-])=O,0.2577 | |
| CCC1CCCC1O,0.3293 | |
| O=C1CC2C3CC2C3O1,0.2703 | |
| OCC1OC2CC1C2,0.3257 | |
| CCC1C2C3C2C1C3O,0.3245 | |
| CCC(C)C1=CN=CN1,0.2489 | |
| CC1CC(C)C(O)CO1,0.3213 | |
| CC1CC=C(C)C1C#N,0.2568 | |
| CC12CC1CC1CN1C2,0.3055 | |
| CNC=Nc1ccno1,0.1834 | |
| CN1C2CC3C2(C)C13C,0.2925 | |
| CC(CCCO)CC#C,0.3137 | |
| OC1CCC2OCC12,0.3094 | |
| CCC1C(O)C2CC12C,0.303 | |
| CC1C2C3C(O)C2(C)C13,0.321 | |
| N=C1C=NOC(=C1)C#C,0.1742 | |
| CC1CCCC(C)C=C1,0.265 | |
| CC(C)(CC#C)OC,0.303 | |
| CC(C#N)C(C)(C)O,0.3152 | |
| OC1CCC23CC12CC3,0.2958 | |
| O=C1OC2C(NC12)C#C,0.24 | |
| CC1(CC(=O)NC=N1)C,0.2339 | |
| C1C2CC3=C(N=NO3)N12,0.1906 | |
| N=C1NN=CNC1=O,0.186 | |
| N=C1OCC(=O)C2OC12,0.2097 | |
| CN(CCO)C(=O)CO,0.2566 | |
| CCC1(CCCO1)OC,0.3377 | |
| OC1CC1(C#N)C1CC1,0.2801 | |
| CCC1=CCC(C)OC1,0.2609 | |
| CC1(C(=O)CN1C)C,0.2021 | |
| COCC1CC1CC#C,0.307 | |
| CC1(CO)NC1C#N,0.287 | |
| CC(=NO)C(O)CC=O,0.2309 | |
| CC1(O)C2CC(O)C12,0.3073 | |
| CC12CC3C1C3(O)C2=O,0.2359 | |
| c1c[nH]c2c1CCOC2,0.2403 | |
| CC#CC12CC1C(=O)C2,0.2211 | |
| OCCC1CC(CO)O1,0.3175 | |
| CC1OC(=O)CC1=NO,0.2446 | |
| CCCC1CC(=O)C1C,0.2212 | |
| CC(O)CN1N=NN=N1,0.2542 | |
| COC1C2CC(O)CC12,0.307 | |
| CC1OCC2(CN2)C=C1,0.2515 | |
| N=COC1(CC1)C#C,0.2713 | |
| CNC1C(C)NC1C#N,0.248 | |
| c1c(cn2c1CC=C2)N,0.1738 | |
| CCn1c(nnc1N)N,0.2466 | |
| C1C=C(C(=O)N1)C#N,0.197 | |
| C(c1c(nno1)C#N)O,0.2202 | |
| CN1CC2=CC3OC3C12,0.2127 | |
| C1C2CCC11OCOC21,0.3345 | |
| CC(=O)C1OC11COC1,0.2212 | |
| CN=C1OC2CCOC12,0.2648 | |
| CC(C)(C1CC(=O)C1)O,0.2251 | |
| CC1C2C(C)C=CC12C,0.242 | |
| CCC(OC(C)C)C#N,0.3008 | |
| c1coc(=NCC=O)[nH]1,0.1926 | |
| CC1CC(CO)C(=N)O1,0.2692 | |
| CC1CC2(CC12C)C=O,0.2228 | |
| CN=C1OCOC1C,0.2757 | |
| FC1=NOC(=O)C(=N)O1,0.2057 | |
| O=C1CC2NC2(C1)C#N,0.2272 | |
| CCC(=O)NC(=O)N,0.2434 | |
| COC(C)(C)C1CN1C,0.2942 | |
| CC1C(O)C(=O)C1CO,0.2202 | |
| OC1CC2CC2C1,0.3318 | |
| CC(=O)CC1CC1CO,0.2337 | |
| c1cnnc(n1)CO,0.1656 | |
| O=C1CC2C3COC3C12,0.2178 | |
| CC12CNC1=CC(=N)O2,0.196 | |
| CC#CC1=CCCC1,0.2067 | |
| C1OC11COCCC=C1,0.2446 | |
| C(CNC(=O)C=O)C#N,0.1754 | |
| N#CC1C2OC1C2=O,0.2452 | |
| CCn1ccccc1=O,0.1768 | |
| CC1(C#C)N2CC1(O)C2,0.2734 | |
| CCCN1CC1C,0.3107 | |
| N=C1CN=C(N1)C#C,0.191 | |
| CCCOCCC=O,0.2283 | |
| CCC1(CO)C2COC12,0.3023 | |
| CC1CN(C)CC(=O)N1,0.2553 | |
| CCC1=CCC(C1)C=O,0.2207 | |
| CN=c1[nH]c(=O)cn[nH]1,0.1757 | |
| CC1C(C#N)C11COC1,0.2793 | |
| CC1C=CC2OC2C1=O,0.2071 | |
| CC1OC2=NCCC12C,0.2617 | |
| CC#CC1CC(C)(C)O1,0.2753 | |
| CC1N2CC3(O)C2C13C,0.2787 | |
| CC1=CC(=O)CC2CC12,0.1873 | |
| CCC1CC23CC(C2)C13,0.3052 | |
| C1CC23OC4CC12CC34,0.2993 | |
| CC1=CC(=O)CC1C=O,0.1856 | |
| OCC12OCC1C2O,0.2929 | |
| CC1N2CC2(CO)C1=O,0.2186 | |
| N#CCC1NCC11CN1,0.2763 | |
| Cc1cc(=O)nc[nH]1,0.2067 | |
| CC1(O)C2C3CN3C12,0.2823 | |
| O=C(C#C)C1OC2CC12,0.1859 | |
| OC1COC1C1CO1,0.3184 | |
| C(c1c(c([nH]n1)O)O)O,0.2223 | |
| CC12C(O)C1NCC2=O,0.2098 | |
| C1OCC2C3NC3C12,0.2942 | |
| OC1C2CCC2C1C#C,0.282 | |
| CCOCCC(=NO)C,0.255 | |
| N1C2C3OC4C1C2OC34,0.2722 | |
| N=COC1CC1C#N,0.2771 | |
| O=CC1NCC2CC1O2,0.1991 | |
| OC1COC(=O)CC=C1,0.2491 | |
| C1C(=NCC#N)OCO1,0.2732 | |
| CN=C1C=N[N-]C(N)=[NH+]1,0.1688 | |
| CC1C2N1C(C#N)C2=O,0.2153 | |
| CC12CC3(C)N1CC23O,0.3087 | |
| CC12OC1CC2=NO,0.2497 | |
| N=C1CC(O1)C#CC#C,0.2174 | |
| CC1(CCN1C(=O)N)C,0.2884 | |
| c1coc(c1O)CO,0.2248 | |
| CC1OCC2(C)CCC12,0.329 | |
| FC(F)(F)C1CN1,0.3538 | |
| OC12CC1COC2,0.3239 | |
| Cn1c(ccn1)C2CC2,0.2502 | |
| C#Cc1c(nc(o1)N)N,0.1855 | |
| ON=C1CC2CC2C=C1,0.1874 | |
| Cc1c(onn1)N2CC2,0.2065 | |
| CCOC1(COC1)C#N,0.2783 | |
| COC1CCC1OC=O,0.279 | |
| C1C2C3C=C4CCC13C24,0.1564 | |
| N#CCC1C2C3C1CN23,0.2827 | |
| N=C1NC2CNC2C1=O,0.1725 | |
| C1C2NC2C2OC12,0.3083 | |
| CCC1(CN1)C(O)CO,0.3038 | |
| O=CCCC1COC=N1,0.2287 | |
| CC12CC(O1)C=CC=C2,0.1764 | |
| O=C1CNC2C3NC3C12,0.1951 | |
| OCC1C2OC1C2C#C,0.2772 | |
| CC(C(O)C=O)C(N)=O,0.1947 | |
| CC(=O)C(=O)C(C)(C)O,0.1455 | |
| OC(C=O)C1OC1C#N,0.2288 | |
| CC1C(O)C(C#C)C1=O,0.2066 | |
| CCC(=O)C1(CC1)OC,0.2238 | |
| CCCC1OC1CC#C,0.31 | |
| C1OCC2OC2C2NC12,0.3092 | |
| CC1COC(=O)C11CC1,0.2769 | |
| CC1OCC(=O)C(=N)O1,0.1853 | |
| CC1CC2COCOC12,0.3342 | |
| CC(=O)CC(=O)CO,0.2085 | |
| CCC12CC1OC(=N)O2,0.2992 | |
| CC1=C2COC2C2OC12,0.2282 | |
| CC(C)(C(=O)OC)O,0.2815 | |
| CC12OCC3C4C3C1C24,0.2877 | |
| C1CN1C(=O)C2COC2,0.2375 | |
| CCC1(CC(=O)C1)C=O,0.2148 | |
| OC1CC1OC1CC1,0.3104 | |
| C#Cc1cc[nH]c1C=O,0.171 | |
| N=C1CC2(O1)C1CCC21,0.2743 | |
| C#CC12CC1C1COC21,0.259 | |
| CC1C=CC2CC12C#C,0.2415 | |
| CC12NC1C1C2CC1=O,0.206 | |
| CCCC1C2OCC12C,0.3044 | |
| CC1=C(C)C(=N)OC1,0.2184 | |
| COC12CCC1(O)C2C,0.2859 | |
| CC12CC1C1CCC1=C2,0.2362 | |
| CC1(OC=O)OCC=C1,0.2513 | |
| O=CCC12CC1C1NC21,0.1925 | |
| C1OC2CCCCC1O2,0.3223 | |
| CC1OC(=O)C(C)=C1N,0.2149 | |
| COc1cc[nH]c1C#C,0.192 | |
| CC1=CNC(=O)C11CN1,0.1942 | |
| C1NC1C1CC2(CC2)O1,0.2946 | |
| OCC1CCC2CC1O2,0.3128 | |
| c1cncc(c1F)CO,0.238 | |
| CC1OCCC1(C)O,0.3155 | |
| CC1CC11OC(=O)C=C1,0.2096 | |
| CC1CC2(NC12C)C#C,0.2494 | |
| COCC(C)N1CC1C,0.3014 | |
| COC1CC2C3NC3C12,0.2895 | |
| O=CCC12NC1C1OC21,0.1953 | |
| COC(=O)NC1CC1O,0.2925 | |
| CC#CC(C)C1(O)CC1,0.298 | |
| CC=O,0.2342 | |
| COCC1(CC=O)CO1,0.2236 | |
| c1c(c(=O)[nH]nn1)CO,0.1827 | |
| CC1(CC#N)CCOC1,0.2911 | |
| CN=C1OC(C=O)C1C,0.2122 | |
| OCC(O)(C#C)C1CO1,0.2973 | |
| CC1(O)CC2OCC2=C1,0.2367 | |
| CC1OC(C)=NC1C=O,0.2105 | |
| CC1C2C=CC1C2C#C,0.229 | |
| CCC(C)C(O)CC#C,0.3056 | |
| C1C(=O)COCC(=O)N1,0.1959 | |
| CC1C2CN1C2(C)C#C,0.2589 | |
| CC1(O)CC2C3CC1N23,0.2948 | |
| C1CC2C3C=CCC23C1,0.2471 | |
| CC1CC2CC(O2)C1=O,0.2061 | |
| CCC(C)CC1(C)CC1,0.3405 | |
| CC1(NC=O)C2CC1C2,0.2789 | |
| CC1(COCCO1)C#C,0.2792 | |
| O=CC1=CC(=O)ON=N1,0.147 | |
| CC1(CC2NC2C1)C#N,0.2905 | |
| O=CC1CC(=O)O1,0.2263 | |
| OCC(=O)C1CN=CO1,0.2203 | |
| CN=C1N=NOC(C)=N1,0.2225 | |
| CCc1coc(=O)cn1,0.1656 | |
| CN1C2CC(=O)C=CC12,0.1731 | |
| CC1(CO1)C1OCC=C1,0.2478 | |
| OC(CCCC=O)C#C,0.2283 | |
| O=CC#CC1CN1C=O,0.1942 | |
| CNC1C=CC(O)C1=O,0.2003 | |
| CC(CO)N(C)C(C)=O,0.2668 | |
| N=C1CNC(=O)O1,0.2726 | |
| Cn1cc(cn1)CCO,0.2533 | |
| C1COCCC1CC#N,0.2906 | |
| c1ccoc(=O)c(=O)c1,0.1584 | |
| CC1=CC(=O)C2CC1O2,0.1747 | |
| CCOC1CC2OC2C1,0.3277 | |
| c1coc(=NCCO)[nH]1,0.2204 | |
| CC12C3CC(C13)C2O,0.3205 | |
| CC1C2CCC1C(=O)O2,0.2752 | |
| CC1(CO)C2C3OC3C12,0.2813 | |
| CC1(C)CCC1C#C,0.2996 | |
| COc1cnc(=O)oc1,0.1618 | |
| OCC1CCC=C1CO,0.2592 | |
| C1CC2CCCC12,0.3604 | |
| CC1C2N1CC=C2CO,0.234 | |
| C#CC(=O)C1=CNCC1,0.1546 | |
| CC1[NH2+]C1(C)CC([O-])=O,0.2727 | |
| CCNC1=NCCC1=O,0.1748 | |
| N=COC1CCC1C#N,0.2812 | |
| OC1C=CC2OCC12,0.2444 | |
| OCC12C3CC1CCN23,0.3102 | |
| O=C1CC2C3C4C3C1C24,0.2132 | |
| Cc1ncc(cn1)O,0.2041 | |
| c1c[nH]c2c1oc(c2)N,0.1972 | |
| CCC(C)C#CCOC,0.281 | |
| OCC12CCC1OCO2,0.3325 | |
| CCC1OC(=N)C1CO,0.2804 | |
| CCc1c(n[nH]n1)OC,0.2313 | |
| CCC1CCC(=O)C1C,0.2187 | |
| CC(=O)N1CC2CC12,0.2586 | |
| C1OC2C3CC12OCC3,0.284 | |
| CC(C)(CCC#N)O,0.3211 | |
| CCOC1=NCCN1,0.2765 | |
| CC1(O)C2OC(=N)C12N,0.2409 | |
| O=C1CC2OC3C(N1)C23,0.2577 | |
| CCC12CC3C(CC13)O2,0.3249 | |
| O=CC1OC2CNC12,0.2058 | |
| CC#CCN=COC,0.2666 | |
| CC(C)([NH3+])C1=CN=N[N-]1,0.255 | |
| CCC1(C)CC2(CO2)C1,0.3321 | |
| CN(C1CC1)C(=O)C#C,0.207 | |
| CCC1(CCCC1)O,0.3261 | |
| O=CC1(CN1)C1CC1,0.2204 | |
| CCC1C2CC(C2)C1=O,0.2238 | |
| CN1CC2OC(=O)CC12,0.2453 | |
| COCCc1ccon1,0.2491 | |
| CCOC(C)(CC)C=O,0.2132 | |
| CCn1c(ccn1)C#C,0.2118 | |
| NC(C#N)C1=NNC=C1,0.258 | |
| COCC(=N[O-])C(N)=[NH2+],0.1439 | |
| O=C1COCCC2CN12,0.2369 | |
| OC(CC1COC1)C#N,0.2578 | |
| COC1CC11CCC1O,0.3017 | |
| CC1(NCC1=O)C#N,0.2142 | |
| CC(C1CC1)N(C)C=O,0.2718 | |
| CC1(O)C2N=COC12C,0.2451 | |
| CC1OC11CN(C)C1C,0.2991 | |
| CNC(=O)C(C)C(C)C,0.2781 | |
| CCOC1C2NC2C1C,0.3019 | |
| CC(O)C12CC1(C)OC2,0.2906 | |
| CCC1(O)C2CC=CC12,0.2368 | |
| C#CCOc1n[nH]nn1,0.2308 | |
| C1C(CC(=O)C1=O)O,0.1462 | |
| C1C2CC3CC(O3)C12,0.3178 | |
| CC12CCC(O1)C2(C)C,0.3198 | |
| CN1CC11CCCOC1,0.3016 | |
| CC1COC2COC2C1,0.3237 | |
| CC1(COC=O)CN1,0.2729 | |
| CCN1C2CCC12C#N,0.2718 | |
| N=C1OCC(C=O)C=C1,0.2033 | |
| CN(C)C(=O)CNC=O,0.2589 | |
| CCC1(O)CCC1=O,0.2176 | |
| CCCC12CC(C1)OC2,0.3132 | |
| CC(C)(CO)OC=N,0.2848 | |
| CC12COC1C1CC1C2,0.3168 | |
| CC1OCOC1CO,0.3294 | |
| CC1OCC=C2COC12,0.2491 | |
| CC(C=O)(C=O)O,0.1927 | |
| CC12CC3C4C1N4C23,0.3019 | |
| CCNc1c(non1)C,0.2109 | |
| CC(C#N)C(N)C(N)=O,0.2485 | |
| CC#CC1CC(O)C=C1,0.2532 | |
| CC1OC=NC1C=O,0.2124 | |
| CC12CC(C1)C(C)(O)C2,0.3303 | |
| CC12OC1CC(O)C=C2,0.2448 | |
| CNC(=O)C#CCO,0.2372 | |
| CCNc1cc(oc1)C,0.218 | |
| CCCOCC(=O)NC,0.273 | |
| O=C1CCC(NC1)C#N,0.201 | |
| CC1CN1C1CC=CC1,0.2521 | |
| O=CCC1CC11COC1,0.2227 | |
| CCC1CC2N1CC2=O,0.1994 | |
| CN(C1CC1)C(=O)C=O,0.1671 | |
| Cc1c(nc(cn1)O)O,0.189 | |
| c1cnn2c(n1)ncn2,0.1815 | |
| CC(=O)C1C2CC(=O)C12,0.2064 | |
| CC(C)CC1(CC1)CO,0.3338 | |
| c1cc(nc(c1)O)CO,0.2097 | |
| C1CC11C2C3C2C2C3C12,0.3079 | |
| Cc1[nH]cc(n1)C2CC2,0.2334 | |
| CC(O)CC(C)(O)C=O,0.224 | |
| CC1=NC(=CO1)C1CN1,0.2247 | |
| CC1=C2C(O)CC2OC1,0.233 | |
| c1nc(c(c(n1)F)N)N,0.2102 | |
| CCC1C(N1C)C(N)=O,0.2584 | |
| CC1OC2C=CCC12O,0.2494 | |
| CCC(O)(COC)C#C,0.2896 | |
| OC1CC1N=CNC=O,0.1991 | |
| C1C2C3OCC4C3C4N12,0.2906 | |
| C1C2CN=COC12,0.2736 | |
| CCCC(C)C(C)O,0.3294 | |
| CC(CO)C1CCCC1,0.3399 | |
| CC1(C)C2N3CC2(O)C13,0.3111 | |
| CC(C1CC1)C1(C)CC1,0.348 | |
| C#Cc1cnc(o1)O,0.1979 | |
| CC#CC12CC1N1CC21,0.2437 | |
| CN1CC2(O)CC1C2=O,0.2031 | |
| O=C1CC2NC12C1CC1,0.2162 | |
| CC1OC1C1(C)CCO1,0.3217 | |
| CCC1(C)CC1C#C,0.2881 | |
| CC1N2C3CC(C23)=C1C,0.1612 | |
| CC1CCOC(C)C=C1,0.2625 | |
| CCC1C2OC3C2OC13,0.3032 | |
| COc1c(c[nH]c1O)O,0.2272 | |
| CC(=NO)C(C)(C)OC,0.2558 | |
| NC(CO)=[NH+]CC([O-])=O,0.2493 | |
| CC1(C)C=CC2OCC12,0.2505 | |
| CCCC1OCC(C)=C1,0.2489 | |
| CC1=NC(O)=NOC1=N,0.1595 | |
| CCNC(=O)C(C)OC,0.2744 | |
| CC(O)C1OCC11CO1,0.3085 | |
| CC(O)C1=CC=CO1,0.2353 | |
| C1CC2(C1)C(=O)OCO2,0.2697 | |
| OC1CC2C3CC3(O)C12,0.2799 | |
| O=C1C2OC2C11CO1,0.2015 | |
| c1c(nc(nn1)F)N,0.1846 | |
| CC12CC(CC#N)C1N2,0.2977 | |
| CC1(CC(=O)C#C)CO1,0.1992 | |
| C1C2N1CC1=C2C=NO1,0.2169 | |
| C1CNC(=O)CC1=NO,0.2417 | |
| CC(O)CC(C)(O)C#C,0.3027 | |
| OC1CCC1C#CC#N,0.2287 | |
| O=C1C=CC2C3CC12O3,0.1779 | |
| CNC12C3OC1C(O)C23,0.2912 | |
| NC1=NC2C3OC1C23O,0.2233 | |
| C1OC2CC3OC12C=C3,0.246 | |
| CC1CC(C)(O)C1C,0.3203 | |
| OCC1OCC1C=O,0.2154 | |
| N=CN1C=NCC1=O,0.2266 | |
| c1cnc2c(n1)cn[nH]2,0.186 | |
| CC12CC1(NC=N2)C#C,0.2375 | |
| c1c(c[nH]c1O)CC#N,0.2327 | |
| CC1CC(C)(C)C1=NO,0.2499 | |
| CC(C)CC12CN(C1)C2,0.2952 | |
| N=C1NC(CC1=O)C#C,0.18 | |
| O=CC1CC2CN12,0.2122 | |
| O=CC(CC#N)C1CC1,0.2224 | |
| C1C2OC=NC3CC12C3,0.2498 | |
| C#CCCC(CO)CO,0.3107 | |
| CC12CC1OC(O2)C#C,0.2789 | |
| CC1=CCC2NC2C1=O,0.1915 | |
| CCC1C2OC2C1(C)C,0.3314 | |
| CC1CC2OC2(C)C1C,0.3265 | |
| CC(NCC=O)C(C)=O,0.2089 | |
| OCC1=NC(=N)OC=C1,0.1739 | |
| C1C2CC1OCCCC2,0.3062 | |
| CC12CC1OC(=O)CN2,0.237 | |
| COC(C)C1CC1(C)O,0.3167 | |
| CC(C)CC(O)C1CO1,0.3422 | |
| C#CC(CCO)C#C,0.296 | |
| CC1OC11COC1C=O,0.217 | |
| NC1=C(O)C(=N)C=CN1,0.1746 | |
| CC1=CC(O)(CC1)C=O,0.2106 | |
| NC1=NC(=N)OC=C1,0.1797 | |
| O=CC1CCC2(CC2)O1,0.2055 | |
| COC(=N)N1CC1C#N,0.2545 | |
| CC1CC2(CO2)CC1C,0.3257 | |
| CCOCC1(COC1)O,0.3155 | |
| CC(N)C(N)(CN)C#N,0.261 | |
| CCC1OC1(CC)C#N,0.2993 | |
| O=C1NC2CCN=C2O1,0.271 | |
| COc1c(onn1)C#N,0.1797 | |
| CC(=O)C1COC1C#N,0.2288 | |
| CC1CC2COC2(C)C1,0.3163 | |
| CCCCOC1COC1,0.3183 | |
| CC1CN2C=C(C)C=C12,0.2468 | |
| c1cnc2c(n1)CCN2,0.1765 | |
| N=COC1CC(=O)CO1,0.2224 | |
| C1CC1C(=O)CC(=O)N,0.2103 | |
| C1C2CCOCC1C=C2,0.2594 | |
| CC1(CN=CO1)C=O,0.2129 | |
| CC(C)(C)C(=O)CO,0.2295 | |
| OC1CCC11CC2NC12,0.3047 | |
| CCC1CC1(C)C,0.3443 | |
| CC1C2CC11N=COC21,0.2558 | |
| CCC1CNC(C=O)=N1,0.1632 | |
| CC(O)CC1COC1=O,0.2809 | |
| [O-]C(=O)C1CC2C[NH2+]C12,0.2652 | |
| O=C1NC=NC1C1CN1,0.2141 | |
| CCC(O)C(C)(O)CC,0.3123 | |
| CC1OCC1(C#N)C#N,0.268 | |
| OC1CCCC(O)CC1,0.3306 | |
| OC12C3C4C=C1CC2N34,0.1781 | |
| CCC#CC1CC(C)O1,0.274 | |
| Cc1c(c(=O)cno1)N,0.1602 | |
| COC12CCC1OC2C,0.303 | |
| CC1=NC2(C)CC2(C)O1,0.26 | |
| OC12CC1C(C=O)=CC2,0.1907 | |
| Cc1coc2c1cno2,0.2192 | |
| CC(O)C1CC(O1)C=O,0.2141 | |
| C1C2C3C4COC4C3N12,0.2676 | |
| C1C(CO1)c2nnon2,0.1874 | |
| CC12C3CC1CC2C3,0.3369 | |
| CNC(CCO)C#N,0.2709 | |
| OC1C2C=CC1C21CN1,0.2356 | |
| c1c(c(co1)CO)CO,0.2436 | |
| CC1(C=O)C2CC1C2O,0.2311 | |
| CCC(CO)C(=O)C#C,0.2037 | |
| N#CC1=CC2C3CC1N23,0.1803 | |
| CC1OC11CCNC1=O,0.2505 | |
| CC1C2COC1C1OC21,0.3339 | |
| OCC1CC1OC=O,0.2629 | |
| CC1=NC=NOC1=N,0.171 | |
| OC1CC2OC3CC12C3,0.3051 | |
| CC1CC(CO1)C(N)=O,0.2721 | |
| OC1=CC(=N)N=NO1,0.2269 | |
| CC1CC(C=C1)C#N,0.2629 | |
| COC1C(C)C2OCC12,0.3007 | |
| OC12C3CC1C(O3)C2=O,0.209 | |
| OC12CC(C1)OC1CC21,0.3066 | |
| CC1C(O)C(C)C1=NO,0.2483 | |
| CC1C=C(C)C(C)C1O,0.2584 | |
| CN1C2CC1(C)C21CN1,0.2917 | |
| CC1=CC2(CO)CC1O2,0.2359 | |
| C1OC11C=CC2NC12,0.2385 | |
| OCC1C2COC(=O)C12,0.2657 | |
| CCC#CC1C(C)N1C,0.2556 | |
| CC1CNC2=C1OC=C2,0.2041 | |
| CCOC1C2OC(C)C12,0.3043 | |
| CC(C)C(O)CNC=O,0.2819 | |
| C1COCO1,0.3437 | |
| CCc1cnn(n1)CC,0.2483 | |
| CN=C1OC2CC1(C)C2,0.2786 | |
| CN=c1[nH]cc(o1)N,0.2251 | |
| CCC1(CCC=C1)CC,0.2614 | |
| CC1NC11CCC11CN1,0.2829 | |
| COC1CC2C(C)N2C1,0.2904 | |
| O=C1C2CN2C11CC1,0.2221 | |
| c1nc(=O)nc(o1)F,0.2179 | |
| Cn1c(ccn1)C#C,0.2116 | |
| CC12OC3C4C(CC13)C24,0.3317 | |
| CC1C2C(C)C1(C)C2=O,0.246 | |
| CC(C)C(C)(CO)C#C,0.3114 | |
| CC1(CC1CC#C)C#C,0.2834 | |
| C#CC1C2C3OCC1C23,0.2703 | |
| C1OC1C12CC1OC2,0.3021 | |
| CC1OC(C)C11CN1,0.3113 | |
| N#CC12NC3=NCC1C23,0.1711 | |
| Cc1cc(n[nH]1)N(=O)=O,0.1961 | |
| c1cocc-2cncc12,0.1399 | |
| O=C1CC2CN3C2C13,0.2141 | |
| CC1NC(C)(C=C1)C#N,0.2327 | |
| Cc1ncon1,0.2687 | |
| CC(=O)C1(C)NC1C#N,0.2198 | |
| OCC1(C#N)C2CCC12,0.2937 | |
| CC1OC2(CC12)C=O,0.2191 | |
| N=COC12C3CC1OC23,0.2542 | |
| CN1CCCN=C1C=O,0.1653 | |
| CC(C)(C)CNCC#N,0.2688 | |
| CCCCC(O)C#N,0.3131 | |
| COCCOC(=O)C=O,0.1804 | |
| CC(O)C1=C(O)NN=C1,0.2497 | |
| C#CC12CC(CCC1)O2,0.268 | |
| C1C(=C(C(=O)N1)CO)N,0.2104 | |
| OC1C2OCC12CC=O,0.2137 | |
| CNc1cc(n(n1)C)O,0.2343 | |
| O=C1NC2C3CC12OC3,0.2402 | |
| OC1C2C3C(O)C1C23O,0.3036 | |
| O=C1NC2CC3C2C13,0.2578 | |
| N=C1CC2=C(O1)N=CO2,0.2051 | |
| CC1CC=CC(=O)C1=O,0.1471 | |
| COC=NC(C)C1CN1,0.2546 | |
| C1OC2C3CCC12CC3,0.3241 | |
| CC1=CC2OC2C(O)C1,0.236 | |
| CC1(C=O)N2CC1(O)C2,0.2149 | |
| ON=C1CC2CC2C1,0.2505 | |
| NC1=CC2=C(N1)ON=N2,0.1249 | |
| C#CC12C3C4C3C1CC24,0.2679 | |
| NC(=O)C1C2COC12,0.2635 | |
| CC(O)(C#N)C1(O)CC1,0.2926 | |
| C#Cc1c(nno1)C#N,0.1873 | |
| C#CC12CC1CC21CN1,0.2568 | |
| CN1C2C1C1(C)CC2C1,0.307 | |
| NC12CN=C3OC1C23N,0.1565 | |
| Cc1c(nco1)OC,0.2118 | |
| O=CCCC1CC2NC12,0.2176 | |
| O=CC1NC(=O)C1C#C,0.2119 | |
| Cc1cnc(c(=O)[nH]1)N,0.1667 | |
| O=CC12CN1C1(CC1)C2,0.2121 | |
| C1CC2C3N=COC23C1,0.2542 | |
| CC1(C)C2OCOC12C,0.3227 | |
| C#CCCn1cnnn1,0.2632 | |
| CC1(C)C2OC2C11CO1,0.3222 | |
| CC(O)CC1CO1,0.3296 | |
| O=C1OC2CC2C=C1,0.2118 | |
| N=C1CN=C(N1)C#N,0.1879 | |
| N=C1NC=NOC1=O,0.1973 | |
| COC12C3C4C(C13)C24C,0.2828 | |
| CC12CC1(O)CC2(C)O,0.3123 | |
| CC1C2COC(=O)CC12,0.2746 | |
| Cc1cc([nH]n1)C(=O)N,0.2189 | |
| OC12CC3OC(C1)C23,0.3075 | |
| COC(C)C1=NC=NO1,0.2468 | |
| CC(=O)C12CC1N=CO2,0.2234 | |
| OC1(CCC11CC1)C#N,0.2912 | |
| CCCC(OC)C#C,0.3014 | |
| CC1C2COC2C1C#C,0.2837 | |
| CCC1C2C(C)OC12C,0.31 | |
| CC1CN=CN1C=O,0.2228 | |
| ON=C1CNC1C1CN1,0.2343 | |
| C#CC1CCC1C1CO1,0.3011 | |
| CC12NC1CC(O)C=C2,0.2454 | |
| NC1C2OC2COC1=O,0.2611 | |
| CN1C=C(C)C(=O)C1=N,0.1386 | |
| CC12C3CC4CC1C4N23,0.302 | |
| CC12CN3CC1C3C2=O,0.2166 | |
| COC1C(=O)CC11CN1,0.1968 | |
| Cc1cc(c[nH]1)CCO,0.2408 | |
| CC(O)C1(CN1)C1CO1,0.3195 | |
| C1CC23CC(N=CO2)C13,0.2432 | |
| CCC1C2CC1C(C)C2,0.3692 | |
| COC12COC1C=CC2,0.2514 | |
| O=C(CC1CC1)C1CN1,0.2269 | |
| Cc1[nH]c(c(n1)O)NC,0.2232 | |
| CC1OC(C#C)C11CC1,0.272 | |
| OCC#CC1C2CC1C2,0.2693 | |
| CC#CC1CC2CC12O,0.287 | |
| CC1(C)C2C3CC1CN23,0.3167 | |
| CC(C)c1ccno1,0.2454 | |
| Cc1c([nH]c(=O)[nH]1)C,0.2305 | |
| CC1OC2(C)C3CC2C13,0.3322 | |
| c1coc(c1N)N(=O)=O,0.1614 | |
| COC(CO)CO,0.3127 | |
| CC1OCC(O1)C1CC1,0.3385 | |
| CC#CCC#CC#N,0.2268 | |
| CN=C(C=O)N(C)C,0.1629 | |
| ON=C1COCOC1=N,0.2108 | |
| Cc1cc(n(n1)C)C,0.2572 | |
| C1C2OCC3C4C2C4N13,0.314 | |
| CN(C=N)C(=O)C1CN1,0.2301 | |
| CCC#CC(CO)C#N,0.2814 | |
| CC12OCCC3C1CC23,0.3324 | |
| COC1C(CO)C1CO,0.3034 | |
| O=CCC12CC1C=CC2,0.2102 | |
| CC1CC(O)C(C)(O)C1,0.3163 | |
| NC(C#N)C1CC1C#C,0.2816 | |
| CC1=NC2CC3C(O1)C23,0.2641 | |
| CC(C#N)C(C)(N)C#N,0.2892 | |
| OCCC1C2NC2C1=O,0.2149 | |
| C(=N)Nc1nc(no1)O,0.2167 | |
| C#CC1(C(=O)CN1)C#C,0.2064 | |
| C1CC1CN(C=O)C=O,0.2152 | |
| NC(=O)C#CC1CCO1,0.2339 | |
| CC(O)(C=O)C1CC1O,0.2168 | |
| CCOC1=NCC(=N)N1,0.2422 | |
| CC1C(C)(C)C11CCO1,0.2946 | |
| CC(CC1(C)CO1)C#C,0.3085 | |
| c1cnc(=O)nc(n1)O,0.1493 | |
| OC1CC1C1=CN=NN1,0.2402 | |
| CC1(C)OC(C=O)C=C1,0.2028 | |
| c1c(c(c[nH]1)OC=O)N,0.2016 | |
| COC(C)(C)C1OC1C,0.3346 | |
| C1C2CC1C1CC(C2)O1,0.3153 | |
| C1C(=CC(=O)C1=O)N,0.1538 | |
| N1C2C3OC4C1C4OC23,0.2305 | |
| C1OC11C2C3OC1OC23,0.3213 | |
| Cn1c(ccn1)C#N,0.2222 | |
| C(N1CC1)C12CC1CC2,0.3004 | |
| OC1C(O)C11NCC1=O,0.2013 | |
| CC(O)C1=C(C)N=CN1,0.2387 | |
| Cc1cc(c(=O)[nH]c1)N,0.1688 | |
| C1CC2(C1)CCC=C2,0.2595 | |
| O=CC1OC2COC1C2,0.2198 | |
| CC1OC(C=O)C1O,0.209 | |
| CCC#CC(O)CC#N,0.2844 | |
| COCC12CC1OC2=O,0.2592 | |
| O=C1C2C3C(CN23)C1=O,0.1489 | |
| CCC(C)(NC)C#N,0.2724 | |
| C#Cc1ncc(o1)CO,0.1948 | |
| C1OC11CC2COC2C1,0.3161 | |
| CC12C3C4OC1CC2C34,0.3133 | |
| C(OC1CCC1)C1CO1,0.3311 | |
| CC12NC(=O)N3CC1C23,0.2534 | |
| CN1CC1C1(C)CN1C,0.3043 | |
| CCc1coc(n1)C#C,0.1975 | |
| CC1C2(O)CC1(C)OC2,0.2973 | |
| CCC12CCCC1C2O,0.3043 | |
| Cc1c(ocn1)CCO,0.2379 | |
| CC1=NOC(=C1)C1CN1,0.225 | |
| CC(CO)CC#N,0.3158 | |
| CCNc1c([nH]nn1)O,0.2381 | |
| CC#CC1NC1CO,0.2742 | |
| C1C2OC3OC2C2C3N12,0.3017 | |
| CC1CC2OC2C1(C)C,0.3286 | |
| OCC1NC(CO)C1=O,0.2132 | |
| CC#CC1CCCC1=O,0.2089 | |
| O=C1COCCNC=C1,0.1756 | |
| CC1NC1C(=O)N1CC1,0.2418 | |
| C1CC11CC2NC2C=C1,0.2391 | |
| COC1CN=C(O1)C#N,0.227 | |
| CC(=N)OC(C)(C)C#C,0.2849 | |
| CCN1C2CC2(O)C1=O,0.2315 | |
| CC12C(NC1=O)C1CN21,0.2526 | |
| CC1OCC2(CO2)C=C1,0.2437 | |
| C#CC1CC2CCC2O1,0.2859 | |
| CC(O)C1C2C3OC1C23,0.3068 | |
| O=CC1CC11C2CN1C2,0.2252 | |
| Cc1ccncc1C#N,0.2116 | |
| O=C1CC2C3OC2C3N1,0.2646 | |
| O=CC1OC2CC1C2,0.2152 | |