0 B30R3.4282069244 C1(C(=O)N2C1SCC(=C2C(=O)O)COC)NC(=O)C(=NOC)C3=CSC(=N3)N MCULE-6307798029 [0,0,0,0,0,0|0,0,0]=0 1 B30R3.4282069244 C12SCC(=C(N1C(=O)C2NC(=O)C(=NOC)C3=CSC(=N3)N)C(=O)[O-])COC MCULE-5088636454 [0,0,0,0,0,0|0,0,1]=1 2 B30R3.4282069244 [C@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)/C(=N\OC)/C3=CSC(=N3)N)C(=O)O)COC MCULE-2393773621 [0,0,0,0,0,0|0,0,0]=0 3 B30R3.4282069244 [C@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)C(=NOC)C3=CSC(=N3)N)C(=O)O)COC MCULE-8627886894 [0,0,0,0,0,0|0,0,0]=0 4 B30R3.4282069244 [C@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)C(=NOC)C3=CSC(=N3)N)C(=O)[O-])COC MCULE-6953705876 [0,0,0,0,0,0|0,0,1]=1 5 B29R3.3651310000 C1(C(=O)N2C1SCC(=C2C(=O)O)COC)NC(=O)C(=NO)C3=CSC(=N3)N MCULE-5250109391 [1,0,0,0,0,0|0,0,0]=1 6 B29R3.3651310000 COCC1=C(N2C(=O)[C@H]([C@H]2SC1)NC(=O)/C(=N\O)/C3=CSC(=N3)N)C(=O)O MCULE-8811182586 [1,0,0,0,0,0|0,0,0]=1 7 B29R3.4644384341 CO/N=C(\C(=O)N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)O)CO)/C3=CSC(=N3)N MCULE-2523210814 [1,0,0,0,0,0|0,0,0]=1 8 B29R3.4644384341 CO/N=C(\C(=O)N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)O)CS)/C3=CSC(=N3)N MCULE-9510140789 [1,0,0,0,0,0|0,1,0]=2 9 B29R3.4644384341 CON=C(C(=O)NC1C(=O)N2C1SCC(=C2C(=O)O)CS)C3=CSC(=N3)N MCULE-8455816297 [1,0,0,0,0,0|0,1,0]=2 10 B29R3.4644384341 CON=C(C(=O)N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)O)CS)C3=CSC(=N3)N MCULE-9786755873 [1,0,0,0,0,0|0,1,0]=2 11 B28R3.864569571 CO/N=C(\C(=O)N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)O)CO)/C3=CC=CO3 MCULE-8979567508 [2,0,0,0,0,0|2,0,0]=4 12 B28R3.864569571 CON=C(C(=O)N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)O)CO)C3=CC=CO3 MCULE-2275963684 [2,0,0,0,0,0|2,0,0]=4 13 B28R3.1315629502 C=CC1=C(N2C(=O)C(C2SC1)NC(=O)C(=NO)C3=CSC(=N3)N)C(=O)O MCULE-1693056906 [2,0,0,0,0,0|0,0,2]=4 14 B28R3.1315629502 C=CC1=C(N2C(=O)[C@H](C2SC1)NC(=O)C(=NO)C3=CSC(=N3)N)C(=O)O MCULE-6718563017 [2,0,0,0,0,0|0,0,2]=4 15 B28R3.1315629502 [C@H]1(C(=O)N2[C@@H]1SCC(=C2C(=O)O)C=C)NC(=O)C(=NO)C3=CSC(=N3)N MCULE-9827721537 [2,0,0,0,0,0|0,0,2]=4 16 B28R3.1315629502 [C@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)/C(=N\O)/C3=CSC(=N3)N)C(=O)O)C=C MCULE-1327946265 [2,0,0,0,0,0|0,0,2]=4 17 B28R3.1315629502 [C@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)C(=NO)C3=CSC(=N3)N)C(=O)O)C=C MCULE-9396433990 [2,0,0,0,0,0|0,0,2]=4 18 B28R3.841008141 CON=C(C(=O)NC1C(=O)N2C1SCC(=C2C(=O)O)C)C3=CSC(=N3)N MCULE-8150295612 [2,0,0,0,0,0|0,0,0]=2 19 B28R3.841008141 CON=C(C(=O)NC1C(=O)N2C1SCC(=C2C(=O)[O-])C)C3=CSC(=N3)N MCULE-8087460063 [2,0,0,0,0,0|0,0,1]=3 20 B28R3.841008141 [C@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)/C(=N/OC)/C3=CSC(=N3)N)C(=O)O)C MCULE-6342781059 [2,0,0,0,0,0|0,0,0]=2 21 B28R3.841008141 [C@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)/C(=N\OC)/C3=CSC(=N3)N)C(=O)O)C MCULE-6991347339 [2,0,0,0,0,0|0,0,0]=2 22 B28R3.841008141 [C@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)C(=NOC)C3=CSC(=N3)N)C(=O)O)C MCULE-1739170303 [2,0,0,0,0,0|0,0,0]=2 23 B28R3.841008141 [C@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)C(=NOC)C3=CSC(=N3)N)C(=O)O)C MCULE-5284733480 [2,0,0,0,0,0|0,0,0]=2 24 B28R3.841008141 [C@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)C(=NOC)C3=CSC(=N3)N)C(=O)O)C MCULE-6067601589 [2,0,0,0,0,0|0,0,0]=2 25 B32R3.6692986965 CO/N=C(/C(=O)N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)O)COC(=O)C)\C3=CSC(=N3)N MCULE-6008190974 [0,2,0,0,0,0|0,0,0]=2 26 B32R3.6692986965 CO/N=C(\C(=O)NC1C(=O)N2C1SCC(=C2C(=O)[O-])COC(=O)C)/C3=CSC(=N3)N MCULE-4180244735 [0,2,0,0,0,0|0,0,1]=3 27 B32R3.6692986965 CO/N=C(\C(=O)NC1C(=O)N2C1SCC(=C2C(=O)[O-])COC(=O)C)/C3=CSC(=N3)N MCULE-6528399228 [0,2,0,0,0,0|0,0,1]=3 28 B32R3.6692986965 CO/N=C(\C(=O)N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)[O-])COC(=O)C)/C3=CSC(=N3)N MCULE-7804985908 [0,2,0,0,0,0|0,0,1]=3 29 B32R3.6692986965 CON=C(C(=O)NC1C(=O)N2C1SCC(=C2C(=O)O)COC(=O)C)C3=CSC(=C3)N MCULE-1882937115 [0,2,0,0,0,0|1,0,0]=3 30 B32R3.6692986965 CON=C(C(=O)NC1C(=O)N2C1SCC(=C2C(=O)O)COC(=O)C)C3=CSC(=N3)N MCULE-5908920538 [0,2,0,0,0,0|0,0,0]=2 31 B32R3.6692986965 CON=C(C(=O)NC1C(=O)N2C1SCC(=C2C(=O)O)COC(=O)O)C3=CSC(=N3)N MCULE-1408232521 [0,2,0,0,0,0|0,0,1]=3 32 B32R3.6692986965 CON=C(C(=O)NC1C(=O)N2C1SCC(=C2C(=O)[O-])COC(=O)C)C3=CSC(=N3)N MCULE-9988072641 [0,2,0,0,0,0|0,0,1]=3 33 B32R3.6692986965 CON=C(C(=O)N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)O)COC(=O)C)C3=CSC(=N3)N MCULE-3275962021 [0,2,0,0,0,0|0,0,0]=2 34 B32R3.6692986965 CON=C(C(=O)N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)[O-])COC(=O)C)C3=CSC(=N3)N MCULE-1917453238 [0,2,0,0,0,0|0,0,1]=3 35 B32R3.6692986965 CON=C(C(=O)N[C@@H]1C(=O)N2[C@@H]1SCC(=C2C(=O)[O-])COC(=O)C)C3=CSC(=N3)N MCULE-9703281987 [0,2,0,0,0,0|0,0,1]=3 36 B32R3.6692986965 CON=C(C(=O)N[C@H]1C(=O)N2C1SCC(=C2C(=O)[O-])COC(=O)C)C3=CSC(=N3)N MCULE-5788654755 [0,2,0,0,0,0|0,0,1]=3 37 B32R3.6692986965 CON=C(C(=O)N[C@H]1C(=O)N2C1SCC(=C2C(=O)[O-])COC(=O)C)C3=CSC(=N3)N MCULE-7739580183 [0,2,0,0,0,0|0,0,1]=3 38 B32R3.6692986965 [C@@H]12SCC(=C(N1C(=O)[C@@H]2NC(=O)C(=NOC)C3=CSC(=N3)N)C(=O)[O-])COC(=O)C MCULE-3732116869 [0,2,0,0,0,0|0,0,1]=3 39 B32R3.6692986965 [C@@H]12SCC(=C(N1C(=O)[C@@H]2NC(=O)C(=NOC)C3=CSC(=N3)N)C(=O)[O-])COC(=O)C MCULE-4637643135 [0,2,0,0,0,0|0,0,1]=3 40 B32R3.6692986965 [C@H]1(C(=O)N2[C@@H]1SCC(=C2C(=O)O)COC(=O)C)NC(=O)C(=NOC)C3=CN=C(S3)N MCULE-6102136191 [0,2,0,0,0,0|2,0,0]=4 41 B32R3.6692986965 [C@H]1(C(=O)N2[C@@H]1SCC(=C2C(=O)O)COC(=O)C)NC(=O)C(=NOC)C3=CSC(=N3)N MCULE-5307502173 [0,2,0,0,0,0|0,0,0]=2 42 B32R3.6692986965 [C@H]1(C(=O)N2[C@@H]1SCC(=C2C(=O)[O-])COC(=O)C)NC(=O)C(=NOC)C3=CSC(=N3)N MCULE-4152259267 [0,2,0,0,0,0|0,0,1]=3 43 B32R3.6692986965 [C@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)/C(=N\OC)/C3=CSC(=N3)N)C(=O)O)COC(=O)C MCULE-2744018669 [0,2,0,0,0,0|0,0,0]=2 44 B32R3.6692986965 [C@H]12SCC(=C(N1C(=O)[C@H]2NC(=O)C(=NOC)C3=CSC(=N3)N)C(=O)[O-])COC(=O)C MCULE-9938562165 [0,2,0,0,0,0|0,0,1]=3