0 B20R3.1607238 CN[C@@H]1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)N MCULE-1356375549 [0,0,0,0,0,0|0,0,0]=0 1 B20R3.1607238 CN[C@@H]1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)N MCULE-2661886287 [0,0,0,0,0,0|0,0,0]=0 2 B20R3.1607238 CN[C@@H]1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)N MCULE-5269650818 [0,0,0,0,0,0|0,0,0]=0 3 B20R3.1607238 CN[C@@H]1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)N MCULE-6412483210 [0,0,0,0,0,0|0,0,0]=0 4 B19R3.1556507 CNC1CCC2=C(C1)C3=C(N2)C=CC(=C3)C#N MCULE-4526502229 [1,0,0,0,0,0|0,0,2]=3 5 B19R3.2455619 CC1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)O MCULE-5092581074 [1,0,0,0,0,0|1,0,0]=2 6 B19R3.2455619 CN1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)O MCULE-9876535056 [1,0,0,0,0,0|2,0,0]=3 7 B19R3.2455619 C[NH+]1CCC2=C(C1)C3=CC(=CC=C3N2)C(=O)O MCULE-5776393693 [1,0,0,0,0,0|2,0,0]=3 8 B19R3.2455619 NC1CCC2=C(C1)C3=CC(=CC=C3N2)C(=O)O MCULE-6119798874 [1,0,0,0,0,0|1,0,0]=2 9 B19R3.2455619 NC1CCC2=C(C1)C3=CC(=CC=C3N2)C(=O)O MCULE-7041612647 [1,0,0,0,0,0|1,0,0]=2 10 B21R3.7915758 CC(=O)N1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)O MCULE-5069821958 [0,1,0,0,0,0|3,0,0]=4 11 B18R3.174331 CCN1CCC2=C(C1)C3=CC(=CC=C3N2)N MCULE-6158301539 [2,0,0,0,0,0|2,0,0]=4 12 B18R3.174331 COC1=CC2=C(C=C1)NC3=C2CC(CC3)N MCULE-1371552838 [2,0,0,0,0,0|2,0,0]=4 13 B18R3.174331 N#CC1=CC2=C(C=C1)NC3=C2CC(CC3)N MCULE-4415852881 [2,0,0,0,0,0|0,0,2]=4 14 B18R3.115616 CC(=O)C1=CC=C2NC3=C(C2=C1)CCCC3 MCULE-1842515202 [2,0,0,0,0,0|1,0,0]=3 15 B18R3.115616 NC(=O)C1=CC2=C(C=C1)NC3=C2CCCC3 MCULE-5070682781 [2,0,0,0,0,0|0,0,0]=2 16 B18R3.115616 O=C(O)C1=CC2=C(C=C1)NC3=C2CCCC3 MCULE-8218060596 [2,0,0,0,0,0|1,0,0]=3 17 B18R3.115616 O=C(O)C1=CC2=C(C=C1)NC3=C2CNCC3 MCULE-1836564693 [2,0,0,0,0,0|2,0,0]=4 18 B18R3.115616 O=C(O)C1=CC2=C(C=C1)NC3=C2CNCC3 MCULE-6502868014 [2,0,0,0,0,0|2,0,0]=4 19 B18R3.115616 O=C(O)C1=CC2=C(C=C1)NC3=C2CSCC3 MCULE-1978373141 [2,0,0,0,0,0|2,0,0]=4 20 B18R3.115616 O=N(=O)C1=CC2=C(C=C1)NC3=C2CCCC3 MCULE-6825886813 [2,0,0,0,0,0|2,0,0]=4 21 B20R3.5920328 CN1CCC2=C(C1)C3=CC(=CC=C3N2)C(=O)NN MCULE-3107466715 [1,1,0,0,0,0|1,0,0]=3 22 B20R3.5920328 COC(=O)C1=CC2=C(C=C1)NC3=C2CC(CC3)C MCULE-4691647822 [1,1,0,0,0,0|1,0,0]=3 23 B20R3.5920328 COC(=O)C1=CC2=C(C=C1)NC3=C2CN(CC3)C MCULE-8008530798 [1,1,0,0,0,0|2,0,0]=4 24 B20R3.5920328 COC(=O)C1=CC=C2NC3=C(C2=C1)CN(CC3)C MCULE-6485396747 [1,1,0,0,0,0|2,0,0]=4 25 B22R3.12374550 CC(C)(C)C1CCC2=C(C1)C3=C(N2)C=CC(=C3)C(=O)O MCULE-3324930310 [0,2,0,0,0,0|2,0,0]=4 26 B20R3.5098397 O=C(O)C1=CC=C2NC3=C(C2=C1)CCCCCC3 MCULE-7606047478 [0,0,1,1,0,0|2,0,0]=4