SANC00381 Cissacapine




Analog ID Similarity score SMILES

Selection options

Mcule | MolPort | All | None
MCULE-9623052715 0.82 N1(C)C(CC2C=CC(OC)=C(OCC3C=CC=CC=3)C=2)C2C(OC)=C(OCC3C=CC=CC=3)C(OC)=CC=2CC1
MCULE-2205423638 0.81 C12OC3=CC(=CC4CCN(C)[C@@H](CC5=CC=C(C=C5)OC5=C(C=CC(=C5)C[C@@H]5N(C)CCC(C=C(OC)C=1OC)=C25)OC)C3=4)OC
MolPort-005-938-503 0.80 COC1=C2OC3=C4C(CC5=CC=C(O)C(OC6=CC=C(CC7N(C)CCC(=C1)C7=C2)C=C6)=C5)N(C)CCC4=CC(OC)=C3OC
MolPort-000-763-034 0.80 COC1=CC=C2C[C@@H]3N(C)CCC4=CC(OC)=C(OC)C(OC5=C(OC)C=C6CCN(C)[C@@H](CC7=CC=C(OC1=C2)C=C7)C6=C5)=C34
MolPort-042-676-320 0.80 COC1=CC=C2CC3N(C)CCC4=C3C(OC3=CC5=C(CCN(C)C5CC5=CC=C(OC1=C2)C=C5)C=C3OC)=C(O)C(OC)=C4
MolPort-000-775-751 0.80 COC1=CC=C2CC3N(C)CCC4=CC(OC)=C(OC)C(OC5=CC6=C(C=C5OC)C(CC5=CC=C(OC1=C2)C=C5)N(C)CC6)=C34
MolPort-000-772-054 0.80 COC1=C2OC3=C4C(CC5=CC=C(OC6=CC(CC7N(C)CCC(=C1)C7=C2)=CC=C6O)C=C5)N(C)CCC4=CC(OC)=C3OC
MolPort-001-728-226 0.80 COC1=CC=C2C[C@H]3N(C)CCC4=CC(OC)=C(OC)C(OC5=CC6=C(C=C5OC)[C@H](CC5=CC=C(OC1=C2)C=C5)N(C)CC6)=C34
MolPort-001-728-239 0.80 COC1=C2OC3=C4[C@@H](CC5=CC=C(O)C(OC6=CC=C(C[C@@H]7N(C)CCC(=C1)C7=C2)C=C6)=C5)N(C)CCC4=CC(OC)=C3OC
MolPort-020-005-723 0.80 COC1=CC2=C3C=C1OC1=C4[C@H](CC5=CC(OC6=CC=C(C[C@@H]3N(C)CC2)C=C6)=C(OC)C=C5)N(C)CCC4=CC(OC)=C1O
MolPort-020-005-708 0.80 COC1=CC2=C3C=C1OC1=C4[C@@H](CC5=CC(OC6=CC=C(C[C@@H]3N(C)CC2)C=C6)=C(OC)C=C5)N(C)CCC4=CC(OC)=C1O
MolPort-001-728-135 0.80 COC1=CC=C2C[C@H]3N(C)CCC4=CC(OC)=C(OC)C(OC5=C(OC)C=C6CCN(C)[C@@H](CC7=CC=C(OC1=C2)C=C7)C6=C5)=C34
MolPort-001-728-118 0.80 COC1=C2OC3=C4[C@H](CC5=CC=C(OC6=CC(C[C@H]7N(C)CCC(=C1)C7=C2)=CC=C6O)C=C5)N(C)CCC4=CC(OC)=C3OC
MolPort-044-193-374 0.80 COC1=C2OC3=CC=C(CC4N(C)CCC5=CC(OC)=C(OC6=C7C(CC(C=C1)=C2)N(C)CCC7=CC(OC)=C6OC)C=C45)C=C3
MCULE-5037968497 0.80 C12CCN(C)[C@@]3([H])CC4C=C(OC5C=CC(=CC=5)C[C@]5([H])N(C)CCC6=CC(OC)=C(OC(=C(O)C(OC)=C1)C=23)C=C65)C(OC)=CC=4
MCULE-4873661091 0.80 C12CCN(C)[C@]3([H])CC4C=C(OC5C=CC(=CC=5)C[C@]5([H])N(C)CCC6=CC(OC)=C(OC(=C(O)C(OC)=C1)C=23)C=C65)C(OC)=CC=4
MCULE-6247921386 0.80 C12CCN(C)[C@]3([H])CC4C=C(OC5C=CC(=CC=5)C[C@]5([H])N(C)CCC6=CC(OC)=C(OC(=C(OC)C(OC)=C1)C=23)C=C65)C(O)=CC=4
MCULE-8373478754 0.80 C12C(OC)=C(OC)C=C3CCN(C)C([H])(CC4C=CC(=C(OC5=CC=C(C=C5)CC5([H])N(CCC6=C5C=C(C(OC)=C6)O1)C)C=4)OC)C=23
MCULE-2321012187 0.80 C12=C(OC)C(OC)=CC3CCN(C)[C@@]([H])(CC4=CC=C(C=C4)OC4C(O)=CC=C(C[C@@]5([H])N(CCC6C5=CC(=C(OC)C=6)O1)C)C=4)C2=3
MCULE-1397105564 0.80 C12C(OC)=C(OC)C=C3CCN(C)C(CC4=CC=C(C(OC5C=CC(=CC=5)CC5N(C)CCC6C=C(C(OC)=CC=65)O1)=C4)OC)C=23
MCULE-2548279289 0.80 C12C(OC)=C(OC)C=C3CCN(C)[C@@]([H])(CC4C=CC(=C(OC5=CC=C(C=C5)C[C@]5([H])N(CCC6=C5C=C(C(OC)=C6)O1)C)C=4)OC)C=23
MCULE-8890424200 0.80 C12C(OC)=C(OC)C=C3CCN(C)[C@]([H])(CC4C=CC(=C(OC5=CC=C(C=C5)C[C@]5([H])N(CCC6=C5C=C(C(OC)=C6)O1)C)C=4)OC)C=23
MCULE-1926626409 0.80 C12C(OC)=C(OC)C=C3CCN(C)[C@]([H])(CC4=CC=C(C(OC5C=CC(=CC=5)C[C@@]5(N(C)CCC6C=C(C(OC)=CC=65)O1)[H])=C4)OC)C=23
MCULE-7779971171 0.80 C12CCN(C)[C@@]3([H])CC4C=C(OC5C=CC(=CC=5)C[C@]5([H])N(C)CCC6=CC(OC)=C(OC(=C(OC)C(OC)=C1)C=23)C=C65)C(OC)=CC=4
MCULE-6327057075 0.80 C12=C(OC)C(OC)=CC3CCN(C)C(CC4=CC=C(C=C4)OC4C(O)=CC=C(CC5N(CCC6C5=CC(=C(OC)C=6)O1)C)C=4)C2=3
MCULE-1680809407 0.80 C1CC2C=C(OC)C(OC)=C3OC4C(OC)=CC5CCN(C)C(CC6C=CC(OC7=CC(=CC=C7O)CC(C=23)N1C)=CC=6)C=5C=4
MCULE-5816428628 0.80 C12[C@@H]3N(CCC=1C=C(OC)C(OC)=C2OC1C(OC)=CC2CCN(C)[C@@H](CC4C=CC(=CC=4)OC4=C(O)C=CC(=C4)C3)C=2C=1)C
MCULE-6334861355 0.80 C12CCN(C)[C@]3([H])CC4C=C(OC5C=CC(=CC=5)C[C@]5([H])N(C)CCC6=CC(OC)=C(OC(=C(OC)C(OC)=C1)C=23)C=C65)C(OC)=CC=4
MCULE-7264526897 0.80 O1C2=C(C=C3CCN(C)[C@H](CC4=CC=C(C=C4)OC4C(=CC=C(C=4)C[C@H]4C5=C1C(=C(C=C5CCN4C)OC)OC)OC)C3=C2)OC
MCULE-6586418456 0.80 C1(OCC2C=CC=CC=2)C(OCC2C=CC=CC=2)=C(OC)C2C(NCCC=2C=1)CC1C=C(OC)C(OCC2C=CC=CC=2)=CC=1
MCULE-9574668792 0.80 C12=C3CCN(C)[C@@H]1CC1C=CC(OC)=C(OC4C=CC(=CC=4)C[C@@H]4N(CCC5C=C(OC)C(=CC=54)OC2=C(O)C(=C3)OC)C)C=1
MCULE-4969671593 0.80 C12=C3CCN(C)[C@@H]1CC1=CC=C(OC4C5=C(CCN(C)[C@@H]5CC5=CC=C(C=C5)OC2=C(OC)C(=C3)OC)C=C(OC)C=4OC)C=C1
MCULE-3883554658 0.80 C12=C3CCN(C)[C@]1([H])CC1C=CC(=CC=1)OC1=C(OC)C(=CC4CCN(C)[C@](C1=4)([H])CC1=CC=C(C=C1)OC2=C(C(OC)=C3)OC)OC
MCULE-7825125488 0.80 [H]Cl.C12=C(OC)C(OC)=CC3CCN(C)C(CC4C=CC(=C(OC5=CC=C(C=C5)CC5N(CCC6=C5C=C(C(OC)=C6)O1)C)C=4)O)C2=3
MCULE-9167644339 0.80 C12[C@@H]3N(CCC=1C=C(OC)C(OC)=C2OC1C(OC)=CC2CCN(C)[C@@H](CC4C=CC(=CC=4)OC4=C(O)C=CC(=C4)C3)C=2C=1)C.Cl
MCULE-8424323281 0.80 Cl.Cl.O(C1C(=CC2CCN(C)[C@]3([H])CC4=CC=C(O)C(OC5C=CC(=CC=5)C[C@]5([H])N(C)CCC6C=C(OC)C(=CC=65)OC=1C=23)=C4)OC)C
MCULE-3891271395 0.80 C12OC3=CC4=C5C=C3OC=1C(=CC1CCNC([H])(CC3C=CC(=CC=3)OC3C(OC)=CC=C(CC4([H])N(CC5)C)C=3)C2=1)OC
MCULE-4382321272 0.80 Cl.C1(OCC2C=CC=CC=2)C(OCC2C=CC=CC=2)=C(OC)C2C(NCCC=2C=1)CC1C=C(OC)C(OCC2C=CC=CC=2)=CC=1
MCULE-6699394396 0.80 Cl.C12CCN(C)[C@]3([H])CC4C=C(OC5C=CC(=CC=5)C[C@]5([H])N(C)CCC6=CC(OC)=C(OC(=C(OC)C(OC)=C1)C=23)C=C65)C(O)=CC=4
MCULE-3287612708 0.80 Cl.Cl.C1CC2C=C(OC)C(OC)=C3OC4C(OC)=CC5CCN(C)C(CC6C=CC(OC7=CC(=CC=C7O)CC(C=23)N1C)=CC=6)C=5C=4
MolPort-029-886-746 0.80 Cl.COC1=CC2=C3C=C1OC1=C4[C@@H](CC5=CC(OC6=CC=C(C[C@@H]3N(C)CC2)C=C6)=C(O)C=C5)N(C)CCC4=CC(OC)=C1OC
MolPort-042-676-315 0.80 Cl.Cl.COC1=C2OC3=C4C(CC5=CC(OC6=CC=C(CC7N(C)CCC(=C1)C7=C2)C=C6)=C(O)C=C5)N(C)CCC4=CC(OC)=C3OC
MolPort-003-936-410 0.80 Cl.Cl.COC1=C2OC3=C4[C@@H](CC5=CC=C(O)C(OC6=CC=C(C[C@@H]7N(C)CCC(=C1)C7=C2)C=C6)=C5)N(C)CCC4=CC(OC)=C3OC
MCULE-3241136280 0.79 C12=C3CCN(C)[C@]1([H])CC1C=CC(O)=C(OC4C(OC)=CC5CCN(C)[C@@]([H])(C=5C=4)CC4C=CC(=CC=4)OC2=C(O)C(=C3)OC)C=1
MCULE-2868110081 0.79 C12C3CCN(C)[C@]1([H])CC1C=CC(=C(C=1)OC1C(OC)=CC4=C([C@@]([H])(N(C)CC4)CC4C=CC(=CC=4)OC=2C(=C(OC)C=3)O)C=1)O
MolPort-003-983-880 0.79 [Cl-].[Cl-].COC1=CC2=C3[C@@H](CC4=CC(OC5=CC6=C(CC[NH+](C)C6CC6=CC=C(OC3=C1O)C=C6)C=C5OC)=C(O)C=C4)[N+](C)(C)CC2
MolPort-006-069-226 0.79 Cl.[Cl-].COC1=CC2=C3C=C1OC1=C(O)C=CC(C[C@@H]4C5=C(OC6=CC=C(C[C@@H]3N(C)CC2)C=C6)C(O)=C(OC)C=C5CC[N+]4(C)C)=C1
MolPort-009-758-370 0.79 O.O.O.O.O.[Cl-].[Cl-].COC1=C(O)C2=C3[C@@H](CC4=CC=C(O)C(OC5=C(OC)C=C6CC[N+](C)(C)[C@H](CC7=CC=C(O2)C=C7)C6=C5)=C4)[N+](C)(C)CCC3=C1
MolPort-003-929-942 0.79 O.O.O.O.O.Cl.[Cl-].COC1=C(O)C2=C3[C@@H](CC4=CC=C(O)C(OC5=C(OC)C=C6CCN(C)[C@@H](CC7=CC=C(O2)C=C7)C6=C5)=C4)[N+](C)(C)CCC3=C1
MolPort-000-703-191 0.79 O.O.O.O.O.[Cl-].[Cl-].COC1=C(O)C2=C3[C@@H](CC4=CC=C(O)C(OC5=C(OC)C=C6CC[N+](C)(C)[C@@H](CC7=CC=C(O2)C=C7)C6=C5)=C4)[N+](C)(C)CCC3=C1
MCULE-4953433217 0.78 C12C3CC4C=CC(=CC=4)OC4C(OC)=CC=C(C=4)CC4C5=C(CC[NH+]4C)C=C(OC)C(=C5)OC1=C(C(OC)=C(O)C=2CCN3C)OC
MCULE-4999135010 0.78 C12[C@]3([H])CC4C=CC(=CC=4)OC4C(OC)=CC=C(C=4)C[C@]4([H])N(CCC5=C4C=C(C(OC)=C5)OC1=C(C(OC)=C(O)C=2CCN3C)OC)C
MCULE-8495160382 0.78 C1(COC2C=CC(=CC=2OC2C=CC(C[C@@H]3N(C)CCC4C=C(OC)C(OC)=CC3=4)=CC=2)C[C@@H]2C3=CC(=C(OC)C=C3CCN2C)OC)=CC=CC=C1
MolPort-001-728-101 0.77 O.COC1=CC=C2C[C@@H]3N(C)CCC4=C(OC)C(OC)=C(OC)C(OC5=C(OC)C=C6CCN(C)[C@H](CC7=CC=C(OC1=C2)C=C7)C6=C5)=C34
MolPort-001-728-214 0.77 COC1=CC=C2C[C@@H]3N(C)CCC4=C(OC)C(OC)=C(OC)C(OC5=CC6=C(CCN[C@H]6CC6=CC=C(OC1=C2)C=C6)C=C5OC)=C34
MolPort-001-728-117 0.77 COC1=CC=C2C[C@@H]3N(C)CCC4=C(OC)C(OC)=C(OC)C(OC5=C(OC)C=C6CCN(C)[C@@H](CC7=CC=C(OC1=C2)C=C7)C6=C5)=C34
MolPort-000-730-052 0.77 [I-].COC1=CC=C2CC3[NH+](C)CCC4=CC(OC)=C(OC5=C6C(CC7=CC=C(OC1=C2)C=C7)N(C)CCC6=C(O)C(OC)=C5OC)C=C34
MolPort-000-778-541 0.77 O.COC1=CC=C2CC3N(C)CCC4=C(OC)C(OC)=C(OC)C(OC5=C(OC)C=C6CCN(C)C(CC7=CC=C(OC1=C2)C=C7)C6=C5)=C34
MolPort-009-758-224 0.77 I.COC1=CC=C2C[C@@H]3N(C)CCC4=CC(OC)=C(OC5=C6[C@H](CC7=CC=C(OC1=C2)C=C7)N(C)CCC6=C(O)C(OC)=C5OC)C=C34
MolPort-001-728-228 0.77 COC1=CC=C2C[C@H]3N(C)CCC4=C(OC)C(OC)=C(OC)C(OC5=CC6=C(CCN[C@H]6CC6=CC=C(OC1=C2)C=C6)C=C5OC)=C34
MolPort-000-771-002 0.77 COC1=CC=C2CC3N(C)CCC4=C(OC)C(OC)=C(OC)C(OC5=C(OC)C=C6CCN(C)C(CC7=CC=C(OC1=C2)C=C7)C6=C5)=C34
MCULE-5042838561 0.77 C1(OC2=C(OC)C=C3C(C(CC)N(CC3)C)=C2)C(O)=C(OC)C=C2CCN(C)C(CC)C=12
MCULE-7911972279 0.77 C12C3CC4=CC=C(C(OC5=CC=C(C=C5)CC5NCCC6=C5C=C(C(OC)=C6)OC=1C(=C(OC)C(OC)=C2CCN3C)OC)=C4)OC.Cl.Cl
MCULE-2079398858 0.77 C12C3CC4C=CC(=C(OC5=CC=C(C=C5)CC5N(CCC6=C5C=C(C(OC)=C6)OC=1C(=C(OC)C(OC)=C2CCN3C)OC)C)C=4)OC.Cl.Cl
MCULE-8393685162 0.77 C1(OC2=C(OC)C=C3C(C(CC)N(CC3)C)=C2)C(O)=C(OC)C=C2CCN(C)C(CC)C=12.Cl.Cl
MCULE-3936362222 0.77 C12C3CC4C=CC(=CC=4)OC4C(OC)=CC=C(C=4)CC4C5=C(CC[NH+]4C)C=C(OC)C(=C5)OC1=C(C(OC)=C(O)C=2CCN3C)OC.[I-]
MCULE-5019588064 0.77 C12[C@]3([H])CC4=CC=C(C(OC5C=CC(=CC=5)C[C@]5([H])NCCC6=C5C=C(C(OC)=C6)OC=1C(=C(OC)C(OC)=C2CCN3C)OC)=C4)OC
MCULE-3804794622 0.77 C12[C@]3([H])CC4=CC=C(C(OC5=CC=C(C=C5)C[C@]5([H])N(CCC6=C5C=C(C(OC)=C6)OC=1C(=C(OC)C(OC)=C2CCN3C)OC)C)=C4)OC
MCULE-8676512526 0.77 C12C3CC4=CC=C(C(OC5=CC=C(C=C5)CC5N(CCC6C5=CC(=C(OC)C=6)OC1=C(C(OC)=C(OC)C=2CCN3C)OC)C)=C4)OC
MCULE-7431600466 0.77 I.C12[C@]3([H])CC4C=CC(=CC=4)OC4C(OC)=CC=C(C=4)C[C@]4([H])N(CCC5=C4C=C(C(OC)=C5)OC1=C(C(OC)=C(O)C=2CCN3C)OC)C
MCULE-8268993318 0.77 C12C3CC4=CC=C(C(OC5=CC=C(C=C5)CC5NCCC6=C5C=C(C(OC)=C6)OC=1C(=C(OC)C(OC)=C2CCN3C)OC)=C4)OC
MCULE-3283642436 0.77 C12C3CC4C=C(O)C(=C(OC5=CC=C(C=C5)CC5N(CCC6=C5C=C(C(OC)=C6)OC1=C(C(OC)=C(OC)C=2CCN3C)OC)C)C=4)OC
MolPort-044-544-144 0.77 Cl.Cl.COC1=CC=C2CC3N(C)CCC4=C(OC)C(OC)=C(OC)C(OC5=C(OC)C=C6CCN(C)C(CC7=CC=C(OC1=C2)C=C7)C6=C5)=C34
MolPort-044-543-954 0.77 Cl.Cl.COC1=CC=C2CC3N(C)CCC4=C(OC)C(OC)=C(OC)C(OC5=CC6=C(CCNC6CC6=CC=C(OC1=C2)C=C6)C=C5OC)=C34
MCULE-8092338781 0.74 C12C(CC(C)C)N(C)CCC1=CC(OC)=C(O)C=2OC1C(OC)=CC2=C(C(CC(C)C)N(CC2)C)C=1O
MCULE-3783274106 0.74 C1(OC2C(OC)=CC3=C(C(CC(C)C)N(CC3)C)C=2O)=C(OC2C(O)=C(OC)C=C3C=2C(CC(C)C)N(CC3)C)C(OC)=CC2=C1C(CC(C)C)N(CC2)C
MCULE-4404393518 0.74 N1(C)CCC2C(C1CC(C)C)=C(C(=C(OC)C=2)OC1C2C(CC(C)C)N(C)CCC=2C=C(OC)C=1O)OC1C(OC)=CC2CCN(C)C(CC(C)C)C=2C=1
MolPort-035-705-716 0.74 COC1=CC=C2C[C@H]3N(C)CCC4=CC(OC)=C(OC)C(OC5=CC6=C(CC[N+](C)([O-])[C@H]6CC6=CC=C(OC1=C2)C=C6)C=C5OC)=C34
MolPort-044-193-471 0.73 COC1=C2OC3=CC=C(CC4N(C)CCC5=CC6=C(OCO6)C(OC6=C(OC)C=C7CCN(C)C(CC(C=C1)=C2)C7=C6)=C45)C=C3
MolPort-035-395-783 0.73 COC1=C2OC3=CC=C(C[C@@H]4N(C)CCC5=C4C(OC4=C(OC)C=C6CCN(C)C(CC(C=C1)=C2)C6=C4)=C1OCOC1=C5)C=C3
MolPort-000-775-465 0.73 COC1=CC=C2C[C@H]3N(C)CCC4=CC(OC)=C(OC5=C6[C@H](CC7=CC=C(OC1=C2)C=C7)N(C)CCC6=CC1=C5OCO1)C=C34
MCULE-4243165865 0.73 C12C3OCOC=3C=C3CCN(C)[C@@]([H])(CC4=CC=C(C=C4)OC4=C(OC)C=CC(C[C@@]5([H])N(CCC6C5=CC(=C(OC)C=6)O1)C)=C4)C=23
MCULE-9714795096 0.73 C12C3OCOC=3C=C3CCN(C)C([H])(CC4=CC=C(C=C4)OC4=C(OC)C=CC(CC5([H])N(CCC6C5=CC(=C(OC)C=6)O1)C)=C4)C=23
MCULE-3635473685 0.73 COC1C2OC3C4[C@](N(CCC=4C=C4OCOC=34)C)([H])CC3C=CC(OC4=CC=C(C[C@]5(N(CCC(=C5C=2)C=1)C)[H])C=C4OC)=CC=3
MCULE-1139668351 0.73 C12CCN(C)[C@]3([H])CC4C=C(OC5C=CC(=CC=5)C[C@]5([H])N(C)CCC6=CC7OCOC=7C(OC(C(OC)=C1)=CC=23)=C65)C(OC)=CC=4
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