0  B16R2.42567  COC1=CC2=C(C=C1)NC=C2CC(=O)N Z407486572 [0,0,0,0,0,0|3,0,0]=3
1  B16R2.42567  COC1=CC2=C(C=C1)NC=C2CC(=O)O Z385472506 [0,0,0,0,0,0|3,0,0]=3
2  B15R2.9410  CC(N)CC1=CNC2=C1C=C(C=C2)F Z1198156503 [1,0,0,0,0,0|3,0,0]=4
3  B15R2.9410  CC(N)CC1=CNC2=C1C=C(C=C2)O Z1255489555 [1,0,0,0,0,0|2,0,0]=3
4  B15R2.9410  CC(N)CC1=CSC2=C1C=C(C=C2)O Z4560488456 [1,0,0,0,0,0|3,0,0]=4
5  B15R2.9410  CC1=CC2=C(C=C1)NC=C2CC(=O)O Z1138836786 [1,0,0,0,0,0|3,0,0]=4
6  B15R2.9410  CN(C)CC1=CNC2=C1C=C(C=C2)Br Z1269196757 [1,0,0,0,0,0|1,0,0]=2
7  B15R2.54412  COC1=CC2=C(C=C1)NC=C2CC#N Z410711518 [1,0,0,0,0,0|2,0,0]=3
8  B15R2.54412  COC1=CC2=C(C=C1)NC=C2CCN Z336079372 [1,0,0,0,0,0|2,0,0]=3
9  B15R1.4  COC1=CC=C(C=C1)CNCCN(C)C Z5025782753 [0,0,1,0,0,0|2,0,1]=4
10  B15R2.3137  COC1=CC2=C(C=C1)NC=C2C(=O)C Z382706504 [0,0,0,0,1,0|2,0,0]=3
11  B15R2.3137  COC1=CC2=C(C=C1)NC=C2C(=O)O Z385370196 [0,0,0,0,1,0|3,0,0]=4
12  B14R2.2  CC(=O)CC1=CNC2=C1C=CC=C2 Z277541166 [2,0,0,0,0,0|2,0,0]=4
13  B14R2.2  CN(C)CC1=CNC2=C1C=CC=C2 Z56917380 [2,0,0,0,0,0|0,0,0]=2
14  B14R2.6419  CC1=CC2=C(C=C1)NC=C2CCN Z2106599153 [2,0,0,0,0,0|2,0,0]=4
15  B14R2.6419  N#CCC1=CNC2=C1C=C(C=C2)O Z1198149461 [2,0,0,0,0,0|2,0,0]=4
16  B14R2.6419  NCCC1=CNC2=C1C=C(C=C2)O Z1741979085 [2,0,0,0,0,0|2,0,0]=4
17  B14R2.2497  CCC1=CNC2=C1C=C(C=C2)OC Z1262565884 [2,0,0,0,0,0|0,0,0]=2
18  B14R2.2497  COC1=CC2=C(C=C1)NC=C2C=O Z385369982 [2,0,0,0,0,0|1,0,1]=4
19  B16R1.4  COC1=CC=C(C=C1)NC(=O)NCC(C)C Z104811994 [0,1,1,0,0,0|2,0,0]=4
20  B16R2.15533  CC(C)(N)CC1=CNC2=C1C=C(C=C2)Br Z3461683569 [1,1,0,0,0,0|2,0,0]=4
21  B16R2.15550  CC1=CC2=C(C=C1)NN=C2C(=O)N(C)C Z383001956 [1,1,0,0,0,0|1,0,1]=4
22  B16R2.42564  COC(=O)C1=CNC2=C1C=C(C=C2)OC Z1146452526 [1,1,0,0,0,0|1,0,1]=4
23  B16R2.42564  COC1=CC2=C(C=C1)NC=C2C(C)CN Z3486846214 [1,1,0,0,0,0|2,0,0]=4
24  B18R2.120970  COC1=CC2=C(C=C1)NC=C2CC(=O)N(C)C Z408405930 [0,1,0,0,0,1|0,0,0]=2
25  B18R2.564753  CC(C)OC1=CC2=C(C=C1)NC=C2CN(C)C Z1739208776 [0,2,0,0,0,0|0,0,0]=2
26  B16R3.49150  COC1=CC2=C(C=C1)NC3=C2CCC3 Z1198174205 [1,0,0,1,0,0|1,0,0]=3
27  B18R3.174331  COC1=CC2=C(C=C1)NC3=C2CC(=O)CC3 Z1259157723 [0,1,0,1,0,0|2,0,0]=4
28  B18R3.174331  COC1=CC2=C(C=C1)NC3=C2CC(CC3)C Z1259160715 [0,1,0,1,0,0|1,0,0]=3
29  B18R3.174331  COC1=CC2=C(C=C1)NC3=C2CC(CC3)N Z1259158328 [0,1,0,1,0,0|2,0,0]=4
30  B14R1.4  COC1=CC=C(C=C1)SCCN(C)C Z149353776 [0,0,1,0,1,0|1,0,1]=4
31  B14R1.2340  COC1=CC(=C(C=C1)Br)C(=O)N(C)C Z32013284 [0,0,1,0,1,0|2,0,0]=4
32  B14R2.5816  CC(=O)C1=CNC2=C1C=C(C=C2)C Z1138836442 [1,0,0,0,1,0|2,0,0]=4
33  B16R2.15551  CN(C)CCC1=CNC2=C1C=C(C=C2)Br Z4439411857 [1,0,0,0,0,1|1,0,0]=3
34  B16R2.15551  CN(C)CCC1=CNC2=C1C=C(C=C2)N Z4606621023 [1,0,0,0,0,1|1,0,0]=3
35  B16R2.36851  COC1=C2C(=CNC2=CC=C1)CN(C)C Z1509145431 [0,0,0,0,1,1|0,0,0]=2
36  B18R2.120971  COC1=CC2=C(C=C1)NC=C2CCNC(=O)C Z1191880499 [0,0,0,0,0,2|2,0,0]=4