0 B33R4.347440762 CCOC(=O)NC1=CC2=C(C=C1)SC3=C(N2C(=O)CCN4CCOCC4)C=CC=C3 MCULE-2907779244 [0,0,0,0,0,0|0,0,0]=0 1 B33R4.347440762 CCOC(=O)NC1=CC2=C(C=C1)SC3=C(N2C(=O)CC[NH+]4CCOCC4)C=CC=C3 MCULE-2107794795 [0,0,0,0,0,0|0,0,1]=1 2 B32R4.387173974 COC(=O)NC1=CC=C2SC3=C(C=CC=C3)N(C2=C1)C(=O)CCN4CCOCC4 MCULE-1840044487 [1,0,0,0,0,0|0,0,0]=1 3 B32R4.387173974 COC(=O)NC1=CC=C2SC3=C(C=CC=C3)N(C2=C1)C(=O)CCN4CCOCC4 MCULE-9959429835 [1,0,0,0,0,0|0,0,0]=1 4 B34R4.601845802 CCOC(=O)NC1=CC2=C(C=C1)SC3=C(N2C(=O)CCN4CCN(CC4)C)C=CC=C3 MCULE-9030948249 [0,1,0,0,0,0|1,0,0]=2 5 B34R4.601845802 CCOC(=O)NC1=CC2=C(C=C1)SC3=C(N2C(=O)CC[NH+]4CC[NH+](CC4)C)C=CC=C3 MCULE-5147734216 [0,1,0,0,0,0|1,0,1]=3 6 B34R4.764864880 CCOC(=O)NC1=CC=C2C(=C1)N(C3=C(S2=O)C=CC=C3)C(=O)CCN4CCOCC4 MCULE-9045360657 [0,1,0,0,0,0|0,0,1]=2 7 B34R4.764864880 CCOC(=O)NC1=CC=C2C(=C1)N(C3=C(S2=O)C=CC=C3)C(=O)CC[NH+]4CCOCC4 MCULE-8341946029 [0,1,0,0,0,0|0,0,2]=3 8 B34R4.764282830 CCOC(=O)NC1=CC2=C(C=C1)CCC3=C(N2C(=O)CCN4CCCCC4)C=CC=C3 MCULE-3854652075 [0,0,0,0,0,1|2,0,0]=3 9 B34R4.764282830 CCOC(=O)NC1=CC2=C(C=C1)CCC3=C(N2C(=O)CCN4CCOCC4)C=CC=C3 MCULE-7623338383 [0,0,0,0,0,1|1,0,0]=2 10 B34R4.764282830 CCOC(=O)NC1=CC2=C(C=C1)CCC3=C(N2C(=O)CCN4CCOCC4)C=CC=C3 MCULE-9726814601 [0,0,0,0,0,1|1,0,0]=2 11 B34R4.764282830 CCOC(=O)NC1=CC2=C(C=C1)CCC3=C(N2C(=O)CC[NH+]4CCCCC4)C=CC=C3 MCULE-9881204005 [0,0,0,0,0,1|2,0,1]=4 12 B31R3.836948412 CCOC(=O)NC1=CC2=C(C=C1)SC3=C(N2C(=O)CCN(CC)CC)C=CC=C3 MCULE-3464979114 [1,0,1,0,0,0|0,0,0]=2 13 B31R3.836948412 CCOC(=O)NC1=CC2=C(C=C1)SC3=C(N2C(=O)CC[NH+](CC)CC)C=CC=C3 MCULE-6710604792 [1,0,1,0,0,0|0,0,1]=3 14 B33R4.78234004 CCOC(=O)NC1=CC2=C(C=C1)SC3=C(N2C(=O)CN4CCN(CC4)C)C=CC=C3 MCULE-5189553219 [0,1,0,0,1,0|1,0,0]=3 15 B33R4.78234004 CCOC(=O)NC1=CC2=C(C=C1)SC3=C(N2C(=O)CN4CCN(CC4)C)C=CC=C3 MCULE-8635416834 [0,1,0,0,1,0|1,0,0]=3 16 B35R4.708738188 CC(C)OC(=O)NC1=CC2=C(C=C1)CCC3=C(N2C(=O)CCN4CCCCC4)C=CC=C3 MCULE-6956092642 [0,1,0,0,0,1|2,0,0]=4 17 B35R4.708738188 CC(C)OC(=O)NC1=CC2=C(C=C1)CCC3=C(N2C(=O)CCN4CCOCC4)C=CC=C3 MCULE-2142826328 [0,1,0,0,0,1|1,0,0]=3 18 B35R4.708738188 CC(C)OC(=O)NC1=CC2=C(C=C1)CCC3=C(N2C(=O)CCN4CCOCC4)C=CC=C3 MCULE-2413403995 [0,1,0,0,0,1|1,0,0]=3 19 B33R4.1038565605 COC(=O)NC1=CC2=C(C=C1)CCC3=C(N2C(=O)CCN4CCCCC4)C=CC=C3 MCULE-1854620091 [1,0,0,0,0,1|2,0,0]=4 20 B33R4.1038565605 COC(=O)NC1=CC2=C(C=C1)CCC3=C(N2C(=O)CCN4CCOCC4)C=CC=C3 MCULE-6477693106 [1,0,0,0,0,1|1,0,0]=3 21 B33R4.1038565605 COC(=O)NC1=CC2=C(C=C1)CCC3=C(N2C(=O)CCN4CCOCC4)C=CC=C3 MCULE-7837213323 [1,0,0,0,0,1|1,0,0]=3 22 B33R4.105110082 CCOC(=O)NC1=CC2=C(C=C1)CCC3=C(N2C(=O)CN4CCOCC4)C=CC=C3 MCULE-7142162663 [0,0,0,0,1,1|1,0,0]=3 23 B33R4.105110082 CCOC(=O)NC1=CC2=C(C=C1)CCC3=C(N2C(=O)CN4CCOCC4)C=CC=C3 MCULE-8604285977 [0,0,0,0,1,1|1,0,0]=3 24 B33R4.105110082 CCOC(=O)NC1=CC=C2CCC3=C(C=CC=C3)N(C2=C1)C(=O)CN4CCCCC4 MCULE-3193614260 [0,0,0,0,1,1|2,0,0]=4 25 B33R4.570402 CCOC(=O)NC1=CC2=C(C=C1)N(C3=CC=CC=C3S2)C(=O)CCN4CCOCC4 MCULE-9230371940 [0,0,0,0,1,1|0,0,0]=2