0  B15R3.3  C1=CC2=C(C=C1)C3=C(CCNC3)N2 SC-02317 [0,0,0,0,0,0|0,0,0]=0
1  B14R2.3  NNCCC1=CNC2=CC=CC=C12 SC-59031 [0,0,1,0,0,0|3,0,0]=4
2  B14R2.3  OCCCC1=CNC2=C1C=CC=C2 SC-42250 [0,0,1,0,0,0|2,0,0]=3
3  B14R2.6  C1=CC=C(CC2CCNCC2)C=C1 SC-03336 [0,0,1,0,0,0|1,0,2]=4
4  B14R2.24  O=C1CCCCC1C2=CC=CC=C2 SC-49209 [0,0,1,0,0,0|2,0,1]=4
5  B14R2.517  CC1=C(CCN)C2=C(C=CC=C2)N1 SC-96776 [0,0,1,0,0,0|2,0,0]=3
6  B16R3.1722  C1=CC2=C(C=C1)C3=C(CCNCC3)N2 SC-14325 [0,0,0,0,0,1|0,0,0]=1
7  B13R2.1  BrCCC1=CNC2=CC=CC=C12 SC-22808 [1,0,1,0,0,0|1,0,0]=3
8  B13R2.1  ClCCC1=CNC2=C1C=CC=C2 SC-48667 [1,0,1,0,0,0|1,0,0]=3
9  B13R2.3  C1=CC=C(C2CNCCN2)C=C1 SC-35598 [1,0,1,0,0,0|1,0,1]=4
10  B13R2.3  C1=CC=C([C@H]2CCCNC2)C=C1 SC-23713 [1,0,1,0,0,0|0,0,2]=4
11  B13R2.26  CCCC1=NC2=C(C=CC=C2)N1 SC-27880 [1,0,1,0,0,0|1,0,0]=3
12  B13R2.26  CCCC1=NC2=CC=CC=C2N1 SC-64932 [1,0,1,0,0,0|1,0,0]=3
13  B13R2.26  COCC1=NC2=CC=CC=C2N1 SC-64934 [1,0,1,0,0,0|2,0,0]=4
14  B13R2.26  NNCC1=CC2=CC=CC=C2O1 SC-59025 [1,0,1,0,0,0|2,0,0]=4
15  B13R2.45  CN1C(CN)=NC2=C1C=CC=C2 SC-49535 [1,0,1,0,0,0|1,0,1]=4
16  B13R2.135  OCC1=C(Cl)NC2=C1C=CC=C2 SC-42447 [1,0,1,0,0,0|2,0,0]=4
17  B15R2.4  COC(=O)CC1=CNC2=C1C=CC=C2 SC-32036 [0,1,1,0,0,0|2,0,0]=4
18  B15R2.4  [C@@H](N)(CO)CC1=CNC2=CC=CC=C12 SC-09003 [0,1,1,0,0,0|2,0,0]=4
19  B15R2.5  O=CCCCC1=CNC2=C1C=CC=C2 SC-42182 [0,1,1,0,0,0|1,0,1]=4
20  B15R2.5  OCCCCC1=CNC2=C1C=CC=C2 SC-42280 [0,1,1,0,0,0|1,0,0]=3
21  B15R2.73  CCCC(=O)C1=CNC2=C1C=CC=C2 SC-63762 [0,1,1,0,0,0|1,0,1]=4
22  B15R2.17719  BrCCCC1=CNC2=C1C=C(Br)C=C2 SC-62942 [0,1,1,0,0,0|2,0,0]=4
23  B15R2.17719  ClCCCC1=CNC2=C1C=C(Br)C=C2 SC-65068 [0,1,1,0,0,0|2,0,0]=4
24  B15R2.17719  NCCCC1=CNC2=C1C=C(Br)C=C2 SC-73846 [0,1,1,0,0,0|2,0,0]=4
25  B15R2.17719  OCCCC1=CNC2=C1C=C(Br)C=C2 SC-62941 [0,1,1,0,0,0|2,0,0]=4
26  B15R2.29  CN1CCC(NC2=CC=CC=C2)CC1 SC-53087 [0,1,1,0,0,0|0,0,2]=4
27  B15R2.993  CC1=C(CN(C)C)C2=C(C=CC=C2)N1 SC-21424 [0,1,1,0,0,0|0,0,0]=2
28  B15R2.4190  CC(C)C1=C(C=O)C2=C(C=CC=C2)N1 SC-52874 [0,1,1,0,0,0|1,0,1]=4
29  B17R3.35227  ClC1=C2CCCCC2=NC3=CC=CC=C31 SC-17083 [0,1,0,0,0,1|1,0,1]=4
30  B13R2.64  C1=CC=C(CC2CCNC2)C=C1 SC-50777 [0,0,1,0,1,0|1,0,1]=4
31  B13R2.64  C1=CC=C(OC2CCNC2)C=C1 SC-36627 [0,0,1,0,1,0|1,0,1]=4
32  B13R2.64  C1=CC=C(OC2CCNC2)C=C1 SC-61531 [0,0,1,0,1,0|1,0,1]=4
33  B13R2.15  O=C1CCCC1C2=CC=CC=C2 SC-36875 [0,0,1,0,1,0|1,0,1]=4
34  B13R2.18  BrC1=CC=CC=C1C2CCNC2 SC-42036 [0,0,1,0,1,0|1,0,1]=4
35  B13R2.18  ClC1=CC=CC=C1C2CCNC2 SC-41700 [0,0,1,0,1,0|1,0,1]=4
36  B15R2.4392  CC1=NC2=CC=CC=C2C(CNN)=C1 SC-59974 [0,0,1,0,0,1|1,0,1]=4
37  B15R2.2115  COC1=CC=C2C=CC=CC2=C1CN SC-59180 [0,0,1,0,0,1|2,0,0]=4