0 B15R2.2195 C(=C\c1ccccc1)/c2ccccc2 TN2282 [0,0,0,0,0,0|2,0,0]=2 1 B15R2.2195 c1ccc(CNc2ccccc2)cc1 T0651 [0,0,0,0,0,0|2,0,0]=2 2 B15R2.2195 c1ccc(\N=N\c2ccccc2)cc1 T0609 [0,0,0,0,0,0|2,0,0]=2 3 B16R2.71 Oc1ccccc1NCc2ccccn2 T7490 [0,1,0,0,0,0|3,0,0]=4 4 B16R2.88 N[C@@H](CC1=CC=CC=N1)C2=CC=CC=C2 T15706 [0,1,0,0,0,0|3,0,0]=4 5 B16R2.88 O=C(Oc1ccccc1)c2ccccc2 T5651 [0,1,0,0,0,0|1,1,0]=3 6 B16R2.132 Oc1ccc(OCc2ccccc2)cc1 T0759 [0,1,0,0,0,0|1,1,0]=3 7 B16R2.252 CC1=CC=CC(\C=C/C2=CC=CC=C2)=N1 T23353 [0,1,0,0,0,0|3,0,0]=4 8 B16R2.252 Cc1cccc(C#Cc2ccccc2)n1 T2497 [0,1,0,0,0,0|3,0,0]=4 9 B16R2.252 Cc1cccc(C#Cc2ccccc2)n1 T6598 [0,1,0,0,0,0|3,0,0]=4 10 B14R2.6 C1=CC=C(NC2=CC=CC=C2)C=C1 T8048 [0,0,0,0,1,0|1,0,0]=2 11 B14R2.6 C1=CC=C(OC2=CC=CC=C2)C=C1 T0621 [0,0,0,0,1,0|0,1,0]=2 12 B14R2.6 c1ccc(Sc2ccccc2)cc1 T0574 [0,0,0,0,1,0|0,0,0]=1 13 B17R2.143 O=C(Nc1ccccc1)Nc2ccccc2 T2716 [0,1,0,0,0,1|2,0,0]=4 14 B17R2.2342 O=C(OCc1ccccc1)c2ccccc2 T0729 [0,1,0,0,0,1|1,1,0]=4 15 B17R2.2342 O=C(\C=C\c1ccccc1)c2ccccc2 T2S0961 [0,1,0,0,0,1|2,0,0]=4 16 B17R2.2342 O=C(\C=C\c1ccccc1)c2ccccc2 T3322 [0,1,0,0,0,1|2,0,0]=4 17 B17R2.3417 O=C(NC1=CC=CC=C1)C2=CC=CC=C2I T3601 [0,2,0,0,0,0|2,0,0]=4 18 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2O T0753 [0,2,0,0,0,0|2,0,0]=4 19 B17R2.5121 [O-][n+]1ccccc1SSc2cccc[n+]2[O-] T7969 [0,2,0,0,0,0|2,0,0]=4 20 B17R2.5360 OC1=CC(O)=C(\N=N\C2=CC=CC=C2)C=C1 T8284 [0,2,0,0,0,0|2,0,0]=4 21 B17R2.10205 O=C(c1ccccc1)C(O)c2ccccc2 T3939 [0,2,0,0,0,0|2,0,0]=4 22 B17R2.3212 Oc1cc(O)cc(\C=C\c2ccccc2)c1 T3843 [0,2,0,0,0,0|2,0,0]=4 23 B15R3.3 c1ccc-2c(c1)[I+]c3ccccc32 T7191 [0,0,0,1,1,0|1,0,0]=3 24 B15R3.3 c1ccc2c(c1)sc3ccccc32 T0352 [0,0,0,1,1,0|0,0,0]=2 25 B17R3.1830 C1=Cc2ccccc2Nc3ccccc31 T0598 [0,1,0,1,0,0|2,0,0]=4 26 B17R3.1830 c1ccc2c(c1)CCc3ccccc3N2 T0628 [0,1,0,1,0,0|2,0,0]=4 27 B17R3.54615 OC1=CC2=C(C=CC=C2)C3=C1C=CC=C3 T22537 [0,1,0,1,0,0|2,0,0]=4 28 B13R2.3 C1=CC=C(C2=CC=CC=N2)N=C1 T23274 [0,0,0,0,2,0|2,0,0]=4 29 B13R2.3 C1=CC=C(C2=CC=CC=N2)N=C1 T23275 [0,0,0,0,2,0|2,0,0]=4 30 B13R2.3 C1=CC=C(C2=CC=CC=N2)N=C1 T23276 [0,0,0,0,2,0|2,0,0]=4 31 B13R2.3 C1=CC=C(C2=CC=CC=N2)N=C1 T23278 [0,0,0,0,2,0|2,0,0]=4 32 B17R2.2382 c1ccc(CCNCc2ccccc2)cc1 T8629 [0,0,0,0,0,2|2,0,0]=4