0  B31R4.12524354  COC1=C(C=C2C(=O)C(=CC3CCN(CC3)CC4=CC=CC=C4)CC2=C1)OC MCULE-1481051344 [0,0,0,0,0,0|0,0,2]=2
1  B31R4.12524354  COC1=C(C=C2C(=O)C(CC2=C1)C=C3C=CN(CC3)CC4=CC=CC=C4)OC MCULE-1215754194 [0,0,0,0,0,0|0,0,4]=4
2  B31R4.12524354  COC1=CC2=C(C=C1OC)C(=O)/C(=C/C3=CCN(CC3)CC4=CC=CC=C4)/C2 MCULE-6216716492 [0,0,0,0,0,0|0,0,4]=4
3  B31R4.12524354  COC1=CC2=C(C=C1OC)C(=O)/C(=C/C3CCN(CC3)CC4=CC=CC=C4)/C2 MCULE-3384787041 [0,0,0,0,0,0|0,0,2]=2
4  B31R4.12524354  COC1=CC2=C(C=C1OC)C(=O)/C(=C\C3CCN(CC3)CC4=CC=CC=C4)/C2 MCULE-1146092347 [0,0,0,0,0,0|0,0,2]=2
5  B31R4.12524354  COC1=CC2=C(C=C1OC)C(=O)/C(=C\C3CCN(CC3)CC4=CC=CC=C4)/C2 MCULE-8474535421 [0,0,0,0,0,0|0,0,2]=2
6  B31R4.12524354  COC1=CC2=C(C=C1OC)C(=O)C(=CC3=CCN(CC3)CC4=CC=CC=C4)C2 MCULE-6270129370 [0,0,0,0,0,0|0,0,4]=4
7  B31R4.12524354  COC1=CC2=C(C=C1OC)C(=O)C(=CC3CCN(CC3)CC4=CC=CC=C4)C2 MCULE-9164576534 [0,0,0,0,0,0|0,0,2]=2
8  B31R4.12524354  COC1=CC2=C(C=C1OC)C(=O)C(C2)CC3CCN(CC3)CC4=CC=CC=C4 MCULE-3130252198 [0,0,0,0,0,0|0,0,0]=0
9  B31R4.12524354  COC1=CC2=C(C=C1OC)C(=O)C(C2)CC3CCN(CC3)CC4=CC=CC=C4 MCULE-5214537955 [0,0,0,0,0,0|0,0,0]=0
10  B31R4.12524354  COC1=CC2=C(C=C1OC)C(=O)[C@@H](C2)CC3CCN(CC3)CC4=CC=CC=C4 MCULE-7257608192 [0,0,0,0,0,0|0,0,0]=0
11  B31R4.12524354  COC1=CC2=C(C=C1OC)C(=O)[C@H](C2)CC3CCN(CC3)CC4=CC=CC=C4 MCULE-4329312459 [0,0,0,0,0,0|0,0,0]=0
12  B30R4.979787  COC1=CC2=C(C=C1OC)CC(=C2)CC3CCN(CC3)CC4=CC=CC=C4 MCULE-3459058590 [1,0,0,0,0,0|0,0,1]=2
13  B30R4.979787  COC1=CC2=C(C=C1OC)CC(C2)CC3CCN(CC3)CC4=CC=CC=C4 MCULE-1382866872 [1,0,0,0,0,0|0,0,1]=2
14  B30R4.979787  COC1=CC2=C(C=C1OC)CC(C2)CC3CCN(CC3)CC4=CC=CC=C4 MCULE-6009761620 [1,0,0,0,0,0|0,0,1]=2
15  B30R4.70174663  COC1=C(C=C2C(=O)C(CC2=C1)CC3CCN(CC3)CC4=CC=CC=C4)O MCULE-6890985817 [1,0,0,0,0,0|0,0,0]=1
16  B32R4.95163780  COC1=CC2=C(C=C1OC)C(=O)C(C2)CC3CC[N+](CC3)([O-])CC4=CC=CC=C4 MCULE-7540236952 [0,1,0,0,0,0|0,0,1]=2
17  B29R3.2829616  COC1=CC=C(C=C1OC)CC(C)NC2CCN(CC2)CC3=CC=CC=C3 MCULE-4928573794 [1,0,1,0,0,0|1,0,1]=4