0 B24R3.415242 C=C(C)CNC1=NC(=C(S1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-9982468424 [0,0,0,0,0,0|3,1,0]=4 1 B24R3.415242 C=C(C)CSC1=NC(=C(N1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-7223461032 [0,0,0,0,0,0|4,0,0]=4 2 B24R3.415242 CC(=O)CSC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-5326554363 [0,0,0,0,0,0|2,0,0]=2 3 B24R3.415242 NC(=O)CSC1=NC(=C(N1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-6053597145 [0,0,0,0,0,0|3,0,0]=3 4 B24R3.415242 NC(=O)CSC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-5131997841 [0,0,0,0,0,0|2,0,0]=2 5 B24R3.415242 O=C(O)CCC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-7099031811 [0,0,0,0,0,0|0,0,0]=0 6 B24R3.415242 O=C(O)CSC1=NC(=C(N1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-9024670164 [0,0,0,0,0,0|2,0,0]=2 7 B24R3.415242 O=C(O)CSC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-8311484809 [0,0,0,0,0,0|1,0,0]=1 8 B24R3.415242 O=C(O)CSC1=[NH+]C(=C(N1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-3538378679 [0,0,0,0,0,0|2,0,1]=3 9 B23R3.65179 C=CCNC1=NC(=C(S1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-4003814415 [1,0,0,0,0,0|2,1,0]=4 10 B23R3.65179 C=CCSC1=NC(=C(N1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-1768848807 [1,0,0,0,0,0|3,0,0]=4 11 B23R3.65179 C=CCSC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-7326527410 [1,0,0,0,0,0|2,0,0]=3 12 B23R3.65179 N#CCSC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-7356374855 [1,0,0,0,0,0|2,0,1]=4 13 B23R3.65179 OCCNC1=NC(=C(S1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-6812537829 [1,0,0,0,0,0|1,1,1]=4 14 B25R3.135537 COC(=O)CSC1=NC(=C(N1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-8000295115 [0,1,0,0,0,0|2,0,0]=3 15 B25R3.135537 COC(=O)CSC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-3363762112 [0,1,0,0,0,0|1,0,0]=2 16 B25R3.135537 N/C(=N\O)/CSC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-4113557209 [0,1,0,0,0,0|2,0,0]=3 17 B25R3.135537 NNC(=O)CSC1=NC(=C(N1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-8225264332 [0,1,0,0,0,0|3,0,0]=4 18 B25R3.2066118 CC(SC1=NC(=C(N1)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O MCULE-4453817239 [0,1,0,0,0,0|2,0,0]=3 19 B23R2.470525 O=C(O)CCCOC(C(=O)C1=CC=CC=C1)C2=CC=CC=C2 MCULE-4821343712 [0,0,1,0,0,0|1,0,2]=4 20 B23R3.73485 CC(=O)NC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-7216271909 [0,0,0,0,1,0|2,0,0]=3 21 B23R3.73485 CC(=O)NC1=NC(=C(S1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-9701372054 [0,0,0,0,1,0|2,1,0]=4 22 B23R3.73485 O=C(O)CC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-4711068791 [0,0,0,0,1,0|0,0,0]=1 23 B25R3.27422 NC(=O)CSC1=NC(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-2875770101 [0,0,0,0,0,1|3,0,0]=4 24 B25R3.27422 O=C(O)CSC1=NC(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-9378075450 [0,0,0,0,0,1|2,0,0]=3 25 B25R3.27440 CC(=O)CSC1=NC(=C(N=N1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-9989838515 [0,0,0,0,0,1|3,0,0]=4 26 B25R3.27440 NC(=O)CSC1=NN=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-1928821694 [0,0,0,0,0,1|3,0,0]=4 27 B25R3.27440 O=C(O)CSC1=NN=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-9541810799 [0,0,0,0,0,1|2,0,0]=3 28 B25R3.27440 O=C(O)CSC1=NN=C(C(N1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-3047672016 [0,0,0,0,0,1|2,0,1]=4 29 B25R3.3953635 CC(=O)CCSC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-2122850915 [0,0,0,0,0,1|1,0,0]=2 30 B25R3.3953635 CC(=O)CCSC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-8460768655 [0,0,0,0,0,1|1,0,0]=2 31 B25R3.3953635 O=C(O)CCSC1=NC(=C(N1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-9742431854 [0,0,0,0,0,1|1,0,0]=2 32 B24R2.3812884 O=C(O)CCC(=O)OC(C(=O)C1=CC=CC=C1)C2=CC=CC=C2 MCULE-9368900095 [0,1,1,0,0,0|1,0,1]=4 33 B24R3.78645 CN(CCO)C1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-3013977996 [1,1,0,0,0,0|1,0,1]=4 34 B26R3.1446 COC(=O)CSC1=NN=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-4178675948 [0,1,0,0,0,1|2,0,0]=4 35 B26R3.5058727 CCOC(=O)CSC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-6827626378 [0,2,0,0,0,0|1,0,0]=3 36 B26R3.4877981 CCC(SC1=NC(=C(N1)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)O MCULE-7740944975 [0,2,0,0,0,0|2,0,0]=4 37 B24R4.44530 O=C1CSC2=NC(=C(N12)C3=CC=CC=C3)C4=CC=CC=C4 MCULE-4546058213 [1,0,0,1,0,0|2,0,0]=4 38 B22R2.50919 O=C(O)CCC(=O)OC(C1=CC=CC=C1)C2=CC=CC=C2 MCULE-7314731871 [0,0,1,0,1,0|1,0,1]=4 39 B22R2.359630 O=C(O)CCOC(C(=O)C1=CC=CC=C1)C2=CC=CC=C2 MCULE-8395311385 [0,0,1,0,1,0|1,0,1]=4 40 B22R3.35697 O=C(O)C1=NC(=C(O1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-8951454453 [0,0,0,0,2,0|0,0,0]=2 41 B22R3.35697 O=C(O)C1=NN(C(=C1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-3248271073 [0,0,0,0,2,0|2,0,0]=4 42 B22R3.35697 O=C(O)C1=NN(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3 MCULE-2982102599 [0,0,0,0,2,0|2,0,0]=4 43 B24R3.23344 O=C(O)CCC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3 MCULE-7054529165 [0,0,0,0,1,1|2,0,0]=4 44 B24R3.1231410 O=C(O)CCN1C=NC(=C1C2=CC=CC=C2)C3=CC=CC=C3 MCULE-1287545997 [0,0,0,0,1,1|1,0,0]=3 45 B24R3.1231410 O=C(O)CCN1C=NC(=C1C2=CC=CC=C2)C3=CC=CC=C3 MCULE-8557307826 [0,0,0,0,1,1|1,0,0]=3 46 B24R3.1231410 O=C(O)CSC1=NN=C(N1C2=CC=CC=C2)C3=CC=CC=C3 MCULE-2901406575 [0,0,0,0,1,1|2,0,0]=4