0 B15R2.24775 CCCN1C(=O)NC(=O)C2=C1NC=N2 MCULE-6400520069 [0,0,0,0,0,0|0,0,2]=2 1 B15R2.24775 CCCN1C(=O)NC(=S)C2=C1CCC2 MCULE-4929597485 [0,0,0,0,0,0|2,1,1]=4 2 B15R2.24775 O=C1N=C(C2=C(N1CCO)N=NN2)O MCULE-3069412495 [0,0,0,0,0,0|2,0,2]=4 3 B15R2.24775 O=C1NC(=O)N(C2=NON=C12)CCO MCULE-4957295615 [0,0,0,0,0,0|2,0,1]=3 4 B15R2.24775 O=C1NC(=O)N(C2=N[Se]N=C12)CCO MCULE-4910233121 [0,0,0,0,0,0|2,0,1]=3 5 B14R2.3994 CCN1C(=O)NC(=O)C2=C1N=CN2 MCULE-8731112778 [1,0,0,0,0,0|0,0,0]=1 6 B16R2.44545 CCCN1C(=O)OC(=O)C2=CC=CC=C12 MCULE-3487729058 [0,0,0,0,0,1|3,0,0]=4 7 B16R2.44545 CCCN1C(=O)OC(=O)C2=CC=CN=C12 MCULE-4744451288 [0,0,0,0,0,1|2,0,0]=3 8 B13R1.2789 CCCN1C(=O)NC(=C(C1=O)N)N MCULE-6154901392 [1,0,1,0,0,0|2,0,0]=4 9 B13R1.3378 CCN1C(=O)NC(=O)C(=C1N)NC MCULE-3835948854 [1,0,1,0,0,0|0,0,2]=4 10 B13R2.5393 CN1C(=O)NC(=O)C2=C1NC=N2 MCULE-1015315695 [2,0,0,0,0,0|0,0,2]=4 11 B13R2.5393 CN1C(=O)NC(=O)C2=NON=C12 MCULE-9808758320 [2,0,0,0,0,0|1,0,1]=4 12 B13R2.5393 CN1C(=S)NC(=O)C2=C1N=CN2 MCULE-7449045067 [2,0,0,0,0,0|0,1,0]=3 13 B15R1.21698 CCCCN1C(=O)NC(=O)C(=C1N)NC MCULE-8120883897 [0,1,1,0,0,0|0,0,2]=4 14 B17R2.138581 COCCN1C(=O)OC(=O)C2=CC=CN=C12 MCULE-3330521871 [0,1,0,0,0,1|2,0,0]=4 15 B17R2.138581 O=C1NC(=O)N(C2=C1C=CC=C2)CCCO MCULE-4481988249 [0,1,0,0,0,1|2,0,0]=4 16 B17R2.821829 CCCN1C(=O)OC(=O)C2=CC=C(N=C12)C MCULE-8571996861 [0,1,0,0,0,1|2,0,0]=4 17 B17R2.180910 CC(C)CN1C(=O)N(C(=O)C2=C1NC=N2)C MCULE-3854999514 [0,2,0,0,0,0|0,0,2]=4 18 B17R2.330747 CCCCN1C(=O)NC(=O)C2=C1N=C(S2)N MCULE-1364665147 [0,2,0,0,0,0|1,0,0]=3 19 B15R1.593 CCCNC(=O)NNC(=O)C1=CC=CO1 MCULE-9353508891 [0,0,1,0,0,1|2,0,0]=4 20 B15R1.593 CCCNC(=O)NNC(=O)C1=CC=CS1 MCULE-9139139845 [0,0,1,0,0,1|2,0,0]=4 21 B15R2.10698 CCCN1C(=O)C(=O)C2=CC=CC=C12 MCULE-1980464560 [0,0,0,0,1,1|2,0,0]=4 22 B12R1.98 CCN1C(=O)NC(=O)C(=C1N)Br MCULE-4981022781 [2,0,1,0,0,0|1,0,0]=4 23 B12R1.1095 CCCN1C(=O)NC(=O)C=C1N MCULE-1764109783 [2,0,1,0,0,0|0,0,0]=3 24 B12R1.1095 CCCN1C(=O)NC(=O)C=C1[O-] MCULE-4692418754 [2,0,1,0,0,0|1,0,0]=4 25 B12R1.1095 CCCN1C(=S)NC(=O)C=C1N MCULE-6006999209 [2,0,1,0,0,0|0,1,0]=4 26 B12R1.1095 NC1=CC(=O)NC(=O)N1CCO MCULE-7441177776 [2,0,1,0,0,0|1,0,0]=4 27 B12R2.246 O=C1NC(=O)C2=C(N1)C=CN2 MCULE-6069519505 [3,0,0,0,0,0|1,0,0]=4 28 B12R2.246 O=C1NC(=O)C2=C(N1)N=CS2 MCULE-7384114601 [3,0,0,0,0,0|1,0,0]=4 29 B12R2.246 O=C1NC(=S)NC2=C1NC=N2 MCULE-3793470910 [3,0,0,0,0,0|0,1,0]=4 30 B14R2.5591 CN1C(=O)C2=C(C=CN2)N(C1=O)C MCULE-1550535329 [2,1,0,0,0,0|1,0,0]=4 31 B14R2.5591 CN1C(=O)C2=C(N=CN2)N(C1=O)C MCULE-9145836114 [2,1,0,0,0,0|0,0,0]=3 32 B14R2.5745 CN1C=NC2=C1C(=O)NC(=O)N2C MCULE-3914097400 [2,1,0,0,0,0|0,0,0]=3 33 B14R2.5745 CN1C=NC2=C1C(=O)[N-]C(=O)N2C MCULE-7241932856 [2,1,0,0,0,0|0,0,1]=4 34 B18R2.157050 COCCCN1C(=O)N(C(=O)C2=C1N=CN2)C MCULE-5083359308 [0,3,0,0,0,0|0,0,0]=3 35 B18R2.343293 CN(C)CCN1C(=O)NC(=O)C2=C1N=CN2C MCULE-3138385621 [0,3,0,0,0,0|0,0,0]=3 36 B18R2.157305 CCCCCN1C(=O)NC(=O)C2=C1N=C(N2)Cl MCULE-4833929912 [0,3,0,0,0,0|0,0,0]=3 37 B16R1.700 CCCNC(=O)NNC(=O)C1=CC=NC=C1 MCULE-5635753155 [0,0,1,0,0,2|1,0,0]=4