SANC00416 Cis-3,4-dihydrohamacanthin b




Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MCULE-4640574182 0.82 C1(C(NCCNC(=O)CC2C3C=CC=CC=3NC=2)=O)C2=CC=CC=C2NC=1
MolPort-005-911-010 0.82 O=C(CC1=CNC2=CC=CC=C12)NCCNC(=O)C1=CNC2=CC=CC=C12
MolPort-022-925-846 0.81 CN1C=C(C2NCCNC2=O)C2=CC=CC=C12
MCULE-8092868461 0.81 C1(C2NCCNC2=O)C2C=CC=CC=2N(C)C=1
MCULE-5895631112 0.81 O=C(N1CCN(CC2=CN=CC=C2)CC1)CC1C2=C(C=CC=C2)NC=1
MolPort-009-155-212 0.81 O=C(CC1=CNC2=CC=CC=C12)N1CCN(CC2=CC=CN=C2)CC1
MCULE-2818326075 0.80 N1(CC(C1)N(CC(C)C)CC1=CC=CN=C1)C(=O)CC1C2C=CC=CC=2NC=1
MCULE-3637159598 0.80 N([C@@H](C1=CC=CC=C1)C(NCCC1C2C=CC=CC=2NC=1)=O)C(=O)C1C=CC=NC=1
MolPort-044-307-233 0.80 CC(C)CN(CC1=CC=CN=C1)C1CN(C1)C(=O)CC1=CNC2=CC=CC=C12
MolPort-027-564-503 0.80 O=C(NCCC1=CNC2=CC=CC=C12)[C@@H](NC(=O)C1=CN=CC=C1)C1=CC=CC=C1
MolPort-001-729-433 0.79 BrC1=CC=C2NC=C(C(=O)C(=O)N3CCN(CC4=CC=CC=C4)CC3)C2=C1
MCULE-3314416522 0.79 C1(=CNC2=CC=C(Br)C=C12)C(=O)C(=O)N1CCN(CC1)CC1=CC=CC=C1
MCULE-5293221653 0.79 C1(C(C(O)=O)N2CCN(CC2)C(C)=O)C2=CC=C(C=C2NC=1)Br
MCULE-6636955991 0.79 C1(C(C(O)=O)N2CCN(CC2)C=O)C2=CC=C(C=C2NC=1)Br
MolPort-008-319-732 0.79 CC(=O)N1CCN(CC1)C(C(O)=O)C1=CNC2=CC(Br)=CC=C12
MolPort-005-931-434 0.79 OC(=O)C(N1CCN(CC1)C=O)C1=CNC2=CC(Br)=CC=C12
MolPort-008-349-479 0.78 CN1CCN(CC1)C(=O)CN1CCN(CC1)C(C(O)=O)C1=CNC2=CC(Br)=CC=C12
MolPort-006-820-708 0.78 CN(C)CCNC(=O)CN1CCN(CC1)C(C(O)=O)C1=CNC2=CC(Br)=CC=C12
MCULE-7856838735 0.78 C1(C(C(O)=O)N2CCN(CC2)CC(NCCN(C)C)=O)C2=CC=C(C=C2NC=1)Br
MCULE-1847361433 0.78 C1(C(C(O)=O)N2CCN(CC2)CC(=O)N2CCN(CC2)C)C2=CC=C(C=C2NC=1)Br
MCULE-6414508399 0.78 CN1C=C(C(N2CCN(C(CC3C4=C(C=CC=C4)NC=3)=O)CC2)=O)C=C1
MCULE-2301703418 0.78 N1C2C=CC=CC=2C(CCNC(=O)C(C2C=CC=NC=2)N2CCCC2)=C1
MCULE-7684921681 0.78 C1(NCCNC1=O)(C(F)(F)F)C1C2C=CC=CC=2NC=1
MolPort-037-216-187 0.78 CN1C=CC(=C1)C(=O)N1CCN(CC1)C(=O)CC1=CNC2=CC=CC=C12
MolPort-028-574-989 0.78 O=C(NCCC1=CNC2=CC=CC=C12)C(N1CCCC1)C1=CN=CC=C1
MolPort-002-717-919 0.78 FC(F)(F)C1(NCCNC1=O)C1=CNC2=CC=CC=C12
MolPort-019-682-194 0.77 CCC(=O)NC(C(=O)NCCC1=CNC2=CC=CC=C12)C1=CC=CC=C1
MCULE-8673727201 0.77 CCC(NC(C1=CC=CC=C1)C(NCCC1C2=C(C=CC=C2)NC=1)=O)=O
MCULE-8910054679 0.77 C1(C2C=CC=CC=2NC=1)C(=O)C(=O)N1CCN(CC1)CC1C=CC=CC=1
MCULE-8257080127 0.77 CN(C(CNC(CC1C2=C(C=CC=C2Br)NC=1)=O)(C)C)C
MCULE-5186795640 0.77 BrC1=CC(C2C(=O)NCCN2CC2=CNC=C2)=CC=C1
MCULE-7753408582 0.77 C1(C(NCCNC(=O)CC2C3C=CC=CC=3NC=2)=O)C2=CC=CC=C2N(C)C=1
MCULE-6444273566 0.77 C1(C2=CC=CC=C2NC=1)CC(=O)N1CCN(CC1)CC1=CC=CC=C1
MCULE-6900705879 0.77 CN(C(C1=CC=CC=C1)CNC(CC1C2=C(C=CC=C2)NC=1)=O)C
MolPort-001-729-552 0.77 O=C(N1CCN(CC2=CC=CC=C2)CC1)C(=O)C1=CNC2=CC=CC=C12
MolPort-039-230-880 0.77 BrC1=CC=CC(=C1)C1N(CC2=CNC=C2)CCNC1=O
MolPort-029-927-328 0.77 CN(C)C(C)(C)CNC(=O)CC1=CNC2=CC=CC(Br)=C12
MolPort-006-814-614 0.77 CN1C=C(C(=O)NCCNC(=O)CC2=CNC3=CC=CC=C23)C2=CC=CC=C12
MolPort-000-844-009 0.77 O=C(CC1=CNC2=CC=CC=C12)N1CCN(CC2=CC=CC=C2)CC1
MolPort-009-512-666 0.77 CN(C)C(CNC(=O)CC1=CNC2=CC=CC=C12)C1=CC=CC=C1
MolPort-039-080-111 0.76 BrC1=CC=CC=C1C1N(CC2=CNC=C2)CCNC1=O
MCULE-4361283886 0.76 BrC1=C(C2C(=O)NCCN2CC2=CNC=C2)C=CC=C1
MCULE-4924582993 0.76 N(CCC1C2C=CC=CC=2NC=1)(C(C)(C)C(=O)NCC1=CC=CN=C1)C(C1=CC=CC=C1)=O
MCULE-3175050451 0.76 C(C(=O)N(CC(C)C)CC(N(CC1C=CC(Cl)=CC=1)CCC1=CNC2=C1C=CC=C2)=O)C1C=CC=CC=1
MCULE-9280318756 0.76 C1(C(C(O)=O)N2CCN(CC2)CCCN(C)C)C2=CC=C(C=C2NC=1)Br
MolPort-042-664-296 0.76 CC(C)(N(CCC1=CNC2=CC=CC=C12)C(=O)C1=CC=CC=C1)C(=O)NCC1=CC=CN=C1
MolPort-006-478-790 0.76 CC(C)CN(CC(=O)N(CCC1=CNC2=CC=CC=C12)CC1=CC=C(Cl)C=C1)C(=O)CC1=CC=CC=C1
MolPort-008-320-827 0.76 CN(C)CCCN1CCN(CC1)C(C(O)=O)C1=CNC2=CC(Br)=CC=C12
MolPort-009-570-074 0.75 CCN(CC1=CC=CC=C1)C(=O)CNC(=O)CC1=CNC2=CC=CC=C12
MolPort-009-096-709 0.75 CC(NC(=O)CC1=CNC2=CC=CC=C12)C(=O)NCC1=CC=CC=C1
MolPort-023-199-774 0.75 CN(C)C(CNC(=O)C1=C(Br)C=CC=C1)C1=CN(C)C2=CC=CC=C12
MolPort-030-064-243 0.75 CC1=C2NC=C(CCNC(=O)C(N3CCCC3)C3=CN=CC=C3)C2=CC=C1
MolPort-006-478-854 0.75 CC(C)CN(CC(=O)N(CCC1=CNC2=CC=CC=C12)CC1=CC=C(C=C1)C(C)(C)C)C(=O)CC1=CC=CC=C1
MolPort-006-478-837 0.75 CCCN(CC(=O)N(CCC1=CNC2=CC=CC=C12)CC1=CC=C(C=C1)C(C)(C)C)C(=O)CC1=CC=CC=C1
MCULE-2087750746 0.75 CCN(C(CNC(CC1C2=C(C=CC=C2)NC=1)=O)=O)CC1=CC=CC=C1
MCULE-7948452929 0.75 CC(C(NCC1=CC=CC=C1)=O)NC(CC1C2=C(C=CC=C2)NC=1)=O
MCULE-6409305150 0.75 C(C(=O)N(CC(C)C)CC(N(CC1=CC=C(C=C1)C(C)(C)C)CCC1C2=CC=CC=C2NC=1)=O)C1C=CC=CC=1
MCULE-9921805505 0.75 C(C(=O)N(CCC)CC(N(CC1=CC=C(C=C1)C(C)(C)C)CCC1C2=CC=CC=C2NC=1)=O)C1C=CC=CC=1
MCULE-2961197879 0.75 C1(C(N(C)C)CNC(=O)C2=CC=CC=C2Br)C2=CC=CC=C2N(C)C=1
MCULE-7134266667 0.75 N1C=C(C2C=CC=C(C)C1=2)CCNC(=O)C(C1C=CC=NC=1)N1CCCC1
MCULE-2871417541 0.75 CC(C(N(C)C)=O)NC(CC1C2C=C(Br)C=CC=2NC=1)=O
MCULE-2613349266 0.75 C1(C(C(O)=O)N2CCN(CC2)CCC#N)C2=CC=C(C=C2NC=1)Br
MCULE-2321665635 0.75 C1(C(C(O)=O)N2CCN(CC2)C)C2=CC=C(C=C2NC=1)Br
MCULE-8475394945 0.75 C1(C(C(O)=O)N2CCN(CC2)CC2=CC=CC3=CC=CC=C23)C2=CC=C(C=C2NC=1)Br
MCULE-4156465070 0.75 C1(CN2CCN(CC2)C(=O)CC2C=CC=CC=2)C2C=CC=CC=2NC=1
MCULE-5949311450 0.75 C(=O)(C1=CC=CN=C1)NC(C)C(NCCC1=CNC2=CC=C(Cl)C=C12)=O
MCULE-9100850131 0.75 C(=O)(C1=CC=CN=C1)N[C@H](C)C(NCCC1=CNC2=CC=C(Cl)C=C12)=O
MCULE-9752669994 0.75 O=C(N1CCN(CC2=CN=CC=C2)CC1)CC1=C2C(C=CC=N2)=CC=C1
MCULE-7016456843 0.75 O=C(N1CCN(C(C2=CC=CC=C2)=O)CC1)CC1C2=C(C=CC=C2)NC=1
MolPort-006-809-542 0.75 OC(=O)C(N1CCN(CCC#N)CC1)C1=CNC2=CC(Br)=CC=C12
MolPort-006-819-418 0.75 OC(=O)C(N1CCN(CC2=CC=CC3=CC=CC=C23)CC1)C1=CNC2=CC(Br)=CC=C12
MolPort-005-929-961 0.75 CN1CCN(CC1)C(C(O)=O)C1=CNC2=CC(Br)=CC=C12
MolPort-002-771-140 0.75 O=C(CC1=CC=CC=C1)N1CCN(CC2=CNC3=CC=CC=C23)CC1
MolPort-008-321-317 0.75 C[C@@H](NC(=O)C1=CN=CC=C1)C(=O)NCCC1=CNC2=CC=C(Cl)C=C12
MolPort-004-191-899 0.75 O=C(CC1=CNC2=CC=CC=C12)N1CCN(CC1)C(=O)C1=CC=CC=C1
MolPort-019-653-415 0.75 O=C(CC1=CC=CC2=CC=CN=C12)N1CCN(CC2=CC=CN=C2)CC1
MolPort-001-729-550 0.74 O=C(N1CCN(CC1)C(C1=CC=CC=C1)C1=CC=CC=C1)C(=O)C1=CNC2=CC=CC=C12
MolPort-008-349-593 0.74 CC(=C)CN1CCN(CC1)C(C(O)=O)C1=CNC2=CC(Br)=CC=C12
MolPort-007-722-481 0.74 O=C(NCCC1=CNC2=CC=CC=C12)C(=O)NCC(N1CCN(CC1)C1=CC=CC=C1)C1=CN=CC=C1
MolPort-006-478-905 0.74 CC(C)N(CC(=O)N(CCC1=CNC2=CC=CC=C12)CC1=CC=C(C=C1)C(C)(C)C)C(=O)CC1=CC=CC=C1
MolPort-009-178-918 0.74 CC1=C(CC(=O)N2CCN(CC3=CC=CN=C3)CC2)C2=CC=CC=C2N1
MolPort-004-237-614 0.74 CC(C)CNC(=O)CN1CCN(CC1)C(=O)CC1=CNC2=CC=CC=C12
MCULE-9287903420 0.74 C1(C(C(O)=O)N2CCN(CC2)CC(C)=C)C2=CC=C(C=C2NC=1)Br
MCULE-9006745961 0.74 N1(CCN(CC1)C1C=CC=CC=1)C(C1=CC=CN=C1)CNC(=O)C(NCCC1C2=CC=CC=C2NC=1)=O
MCULE-5884141474 0.74 C1(C2C=CC=CC=2NC=1)C(=O)C(=O)N1CCN(CC1)C(C1C=CC=CC=1)C1C=CC=CC=1
MCULE-4981991695 0.74 C(C(=O)N(C(C)C)CC(N(CC1=CC=C(C=C1)C(C)(C)C)CCC1C2=CC=CC=C2NC=1)=O)C1C=CC=CC=1
MCULE-1747682413 0.74 CC1=C(CC(N2CCN(CC3=CN=CC=C3)CC2)=O)C2=C(C=CC=C2)N1
MCULE-7567658189 0.74 CC(CNC(CN1CCN(C(CC2C3=C(C=CC=C3)NC=2)=O)CC1)=O)C
MCULE-1412515621 0.74 C1(C2=CC=CC=C2NC=1)CC(=O)N1CCN(CC1)C(C1C=CC=CC=1)C1C=CC=CC=1
MCULE-2104495958 0.74 N(CCC1C2C=CC=CC=2NC=1)(C(C)(C)C(=O)NC(C)(C)C)C(C1C=CC=CC=1)=O
MCULE-6670310703 0.74 C1(C(=O)N(CCC)CC(N(CC2=CC=C(C)C=C2)CCC2C3C=CC=CC=3NC=2)=O)=CC=C(C=C1)Br
MCULE-6147786764 0.74 CC(NCCN(C(CC1C2=C(C=CC=C2)NC=1)=O)CC1=CC=CC=C1)=O
MCULE-7414363412 0.74 CC(C1C2=C(C=CC=C2)N(C)C=1)C(N1CCN(C(C2=CN=CC=C2)=O)CC1)=O
MCULE-2546890227 0.74 OC1=CC=C(CN2CCN(C(CC3C4C=CC=CC=4NC=3)=O)CC2)C=C1
MCULE-1004084470 0.74 O=C(NC1CC1)CN1CCN(C(CC2C3=C(C=CC=C3)NC=2)=O)CC1
MolPort-000-849-422 0.74 O=C(CC1=CNC2=CC=CC=C12)N1CCN(CC1)C(C1=CC=CC=C1)C1=CC=CC=C1
MolPort-042-664-297 0.74 CC(C)(C)NC(=O)C(C)(C)N(CCC1=CNC2=CC=CC=C12)C(=O)C1=CC=CC=C1
MolPort-006-444-347 0.74 CCCN(CC(=O)N(CCC1=CNC2=CC=CC=C12)CC1=CC=C(C)C=C1)C(=O)C1=CC=C(Br)C=C1
MolPort-023-155-346 0.74 CC(=O)NCCN(CC1=CC=CC=C1)C(=O)CC1=CNC2=CC=CC=C12
MolPort-044-580-111 0.74 CC(C(=O)N1CCN(CC1)C(=O)C1=CC=CN=C1)C1=CN(C)C2=CC=CC=C12
MolPort-005-589-065 0.73 O=C(CN1CCN(CC1)C(=O)CC1=CNC2=CC=CC=C12)NC1CC1
MolPort-006-478-865 0.73 CC(C)CN(CC(=O)N(CCC1=CNC2=CC=CC=C12)CC1=CC=C(C=C1)C(C)(C)C)C(=O)C1=CC(Br)=CC=C1
MolPort-006-478-847 0.73 CCCN(CC(=O)N(CCC1=CNC2=CC=CC=C12)CC1=CC=C(C=C1)C(C)(C)C)C(=O)C1=CC(Br)=CC=C1
MolPort-003-150-817 0.73 CN1CCN(CC1)C(CNC(=O)C(=O)NCCC1=CNC2=CC=CC=C12)C1=CC=C(C)C=C1
MolPort-000-842-944 0.73 O=C(CC1=CC=CC=C1)N1CCN(CC1)C(=O)C1=CNC2=CC=CC=C12
MolPort-009-326-536 0.73 CC(C)(C(=O)N1CCN(CC1)C(=O)C1=CNC2=CC=CC=C12)C1=CC=CC=C1
MolPort-005-539-160 0.73 CN(C)C(=O)C(NCCC1=CNC2=CC=CC=C12)C1=CC=CC=C1
MolPort-005-662-358 0.73 O=C(CN1CCN(CC2=CC=CC3=CC=CC=C23)CC1)NCCC1=CNC2=CC=CC=C12
MolPort-008-315-521 0.73 CC(=O)N1CCN(CC1)C(C(O)=O)C1=CNC2=CC=C(Br)C=C12
MolPort-008-350-143 0.73 OC(=O)C(N1CCN(CC1)C=O)C1=CNC2=CC=C(Br)C=C12
MolPort-009-232-917 0.73 CCCNC(=O)C(C)NC(=O)CC1=CNC2=CC=CC=C12
MolPort-006-478-788 0.73 CCC(=O)N(CC(C)C)CC(=O)N(CCC1=CNC2=CC=CC=C12)CC1=CC=C(Cl)C=C1
MolPort-006-478-792 0.73 CC(C)CN(CC(=O)N(CCC1=CNC2=CC=CC=C12)CC1=CC=C(Cl)C=C1)C(=O)C(C)C
MolPort-008-349-288 0.73 OC(=O)C(N1CCN(CC2=CC=CN=C2)CC1)C1=CNC2=CC(Br)=CC=C12
MCULE-5653025914 0.73 C1(C(=O)N(CC(C)C)CC(N(CC2=CC=C(C=C2)C(C)(C)C)CCC2C3=CC=CC=C3NC=2)=O)C=CC=C(Br)C=1
MCULE-2481609158 0.73 C1(C(=O)N(CCC)CC(N(CC2=CC=C(C=C2)C(C)(C)C)CCC2C3=CC=CC=C3NC=2)=O)C=CC=C(Br)C=1
MCULE-2986636906 0.73 N1(CCN(CC1)C)C(C1=CC=C(C=C1)C)CNC(=O)C(NCCC1C2=CC=CC=C2NC=1)=O
MCULE-1669583820 0.73 C1(C2C=CC=CC=2NC=1)C(=O)N1CCN(CC1)C(=O)CC1=CC=CC=C1
MCULE-5661861233 0.73 CC(C1=CC=CC=C1)(C(N1CCN(C(C2C3=C(C=CC=C3)NC=2)=O)CC1)=O)C
MCULE-6834021719 0.73 C1(C(C(O)=O)N2CCN(CC2)C=O)=CNC2=CC=C(Br)C=C12
MCULE-6534952723 0.73 C1(C(C(O)=O)N2CCN(CC2)C(C)=O)=CNC2=CC=C(Br)C=C12
MCULE-7726249747 0.73 CCCNC(C(NC(CC1C2=C(C=CC=C2)NC=1)=O)C)=O
MCULE-7736808200 0.73 CN(C(C(C1=CC=CC=C1)NCCC1C2=C(C=CC=C2)NC=1)=O)C
MCULE-7961175015 0.73 O=C(NCCC1C2=C(C=CC=C2)NC=1)CN1CCN(CC2=C3C(C=CC=C3)=CC=C2)CC1
MCULE-6044116611 0.73 C(C(=O)N(CC(C)C)CC(N(CC1C=CC(Cl)=CC=1)CCC1=CNC2=C1C=CC=C2)=O)C
MCULE-3387160018 0.73 C(C(=O)N(CC(C)C)CC(N(CC1C=CC(Cl)=CC=1)CCC1=CNC2=C1C=CC=C2)=O)(C)C
MCULE-7786117474 0.73 C1(C(C(O)=O)N2CCN(CC2)CC2=CC=CN=C2)C2=CC=C(C=C2NC=1)Br
MCULE-3479711819 0.73 C(=O)(NC1CCCCC1)C(C1C=CC=NC=1)N(CCC1C=CC=C(C)C=1)C(=O)CC1C2C=CC=CC=2NC=1
MCULE-8651744671 0.73 C(C(=O)N(CC(C)C)CC(N(CC1=CC=C(C=C1)C(C)(C)C)CCC1C2=CC=CC=C2NC=1)=O)C
MCULE-9078768418 0.73 C(C(=O)N(CCC)CC(N(CC1=CC=C(C=C1)C(C)(C)C)CCC1C2=CC=CC=C2NC=1)=O)(C)C
MCULE-2293406344 0.73 C(C(=O)N(CC(C)C)CC(N(CC1=CC=C(C=C1)C(C)(C)C)CCC1C2=CC=CC=C2NC=1)=O)(C)C
MCULE-4641321950 0.73 C(C(=O)N(CCC)CC(N(CC1=CC=C(C=C1)C(C)(C)C)CCC1C2=CC=CC=C2NC=1)=O)C
MCULE-5590245211 0.73 C1(C(=O)N(C(C)C)CC(N(CC2=CC=C(C=C2)C(C)(C)C)CCC2C3=CC=CC=C3NC=2)=O)C=CC=C(Br)C=1
MCULE-2011418096 0.73 C1(C(C(O)=O)N2CCN(CC2)C(C2C=CC=CC=2)C2C=CC=CC=2)C2=CC=C(C=C2NC=1)Br
MCULE-9352430789 0.73 C1(C(=O)N(C2CC2)CC(N(CC2C=CC(Cl)=CC=2)CCC2=CNC3=C2C=CC=C3)=O)C=CC=C(Br)C=1
MolPort-006-478-834 0.73 CCCN(CC(=O)N(CCC1=CNC2=CC=CC=C12)CC1=CC=C(C=C1)C(C)(C)C)C(=O)CC
MolPort-006-478-850 0.73 CCC(=O)N(CC(C)C)CC(=O)N(CCC1=CNC2=CC=CC=C12)CC1=CC=C(C=C1)C(C)(C)C
MolPort-006-478-856 0.73 CC(C)CN(CC(=O)N(CCC1=CNC2=CC=CC=C12)CC1=CC=C(C=C1)C(C)(C)C)C(=O)C(C)C
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