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Murcko scaffold

1H,2H,3H,4H,5H,6H-Azepino(4,5-b)indole scaffold

37 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
14
Chemicals
37
With full pages
5
Scaffold SMILES

c1ccc2c3c([nH]c2c1)CCNCC3

A Bemis-Murcko scaffold is what remains of a molecule when every side chain is removed: the rings and the chains that link them. Chemicals that share a scaffold often belong to the same compound series, which helps when you look for analogues, alternative suppliers or related building blocks.

Substructure search with this scaffoldOpen the 1H,2H,3H,4H,5H,6H-Azepino(4,5-b)indole page
Murcko scaffold c1ccc2c3c([nH]c2c1)CCNCC3

Computed from the structures of the chemicals listed here. Stereo and charges are removed before the scaffold is taken.

Chemicals with this scaffold

Open one to see its structure, properties and suppliers.

Showing 1 to 37 of 37 chemicals

Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-3-methyl- chemical structure, C13H16N2, CAS 7546-66-9
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-3-methyl-
CAS 7546-66-9C13H16N2
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride chemical structure, C13H17ClN2O, CAS 15918-69-1
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-, monohydrochloride
CAS 15918-69-1C13H17ClN2O
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-6-methyl-, monohydrochloride chemical structure, C14H19ClN2O, CAS 15918-70-4
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-6-methyl-, monohydrochloride
CAS 15918-70-4C14H19ClN2O
9-Methoxy-6-methyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole chemical structure, C14H18N2O, CAS 15918-86-2
9-Methoxy-6-methyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole
CAS 15918-86-2C14H18N2O
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-8-methoxy-, monohydrochloride chemical structure, C13H17ClN2O, CAS 15918-71-5
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-8-methoxy-, monohydrochloride
CAS 15918-71-5C13H17ClN2O
8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole chemical structure, C13H16N2O, CAS 15918-87-3
8-Methoxy-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole
CAS 15918-87-3C13H16N2O
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-7-methyl-, monohydrochloride chemical structure, C13H17ClN2, CAS 15918-73-7
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-7-methyl-, monohydrochloride
CAS 15918-73-7C13H17ClN2
Azepino(4,5-b)indole, 6-ethyl-1,2,3,4,5,6-hexahydro-, monohydrochloride chemical structure, C14H19ClN2, CAS 15918-74-8
Azepino(4,5-b)indole, 6-ethyl-1,2,3,4,5,6-hexahydro-, monohydrochloride
CAS 15918-74-8C14H19ClN2
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-3,6-dimethyl-, monohydrochloride chemical structure, C14H19ClN2, CAS 15918-75-9
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-3,6-dimethyl-, monohydrochloride
CAS 15918-75-9C14H19ClN2
9-Fluoro-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole chemical structure, C12H13FN2, CAS 15918-85-1
9-Fluoro-1,2,3,4,5,6-hexahydroazepino(4,5-b)indole
CAS 15918-85-1C12H13FN2
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methyl- chemical structure, C13H16N2, CAS 15918-89-5
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methyl-
CAS 15918-89-5C13H16N2
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-3,6-dimethyl-, monohydrochloride chemical structure, C15H21ClN2O, CAS 15923-06-5
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-9-methoxy-3,6-dimethyl-, monohydrochloride
CAS 15923-06-5C15H21ClN2O
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-, hydrochloride (1:1) chemical structure, C12H15ClN2, CAS 15923-41-8
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-, hydrochloride (1:1)
CAS 15923-41-8C12H15ClN2
1H,2H,3H,4H,5H,6H-Azepino(4,5-b)indole chemical structure, C12H14N2, CAS 7546-78-3
1H,2H,3H,4H,5H,6H-Azepino(4,5-b)indole
CAS 7546-78-3C12H14N2
Pnu-22394 chemical structure, C13H16N2, CAS 15923-78-1
Pnu-22394
CAS 15923-78-1C13H16N2
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-10-methoxy-6-methyl-, hydrochloride (1:1) chemical structure, C14H19ClN2O, CAS 15923-43-0
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-10-methoxy-6-methyl-, hydrochloride (1:1)
CAS 15923-43-0C14H19ClN2O
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-10-methoxy-, monohydrochloride chemical structure, C13H17ClN2O, CAS 15923-44-1
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-10-methoxy-, monohydrochloride
CAS 15923-44-1C13H17ClN2O
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-6-(3-dimethylaminopropyl)-3-methyl- chemical structure, C18H27N3, CAS 37683-53-7
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-6-(3-dimethylaminopropyl)-3-methyl-
CAS 37683-53-7C18H27N3
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-6-(3-dimethylaminopropyl)-3,9-dimethyl- chemical structure, C19H29N3, CAS 37683-54-8
Azepino(4,5-b)indole, 1,2,3,4,5,6-hexahydro-6-(3-dimethylaminopropyl)-3,9-dimethyl-
CAS 37683-54-8C19H29N3
9-Methoxy-3-methyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole chemical structure, C14H18N2O, CAS 802581-10-8
9-Methoxy-3-methyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole
CAS 802581-10-8C14H18N2O
Methyl 1,2,3,4,5,6-hexahydroazepino(4,5-b)indole-5-carboxylate chemical structure, C14H16N2O2, CAS 66859-22-1
Methyl 1,2,3,4,5,6-hexahydroazepino(4,5-b)indole-5-carboxylate
CAS 66859-22-1C14H16N2O2
Pnu-22394 hydrochloride chemical structure, C13H17ClN2, CAS 15923-42-9
Pnu-22394 hydrochloride
CAS 15923-42-9C13H17ClN2
Methyl 3-methyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole-5-carboxylate chemical structure, C15H18N2O2, CAS 2973762-95-5
Methyl 3-methyl-1,2,3,4,5,6-hexahydroazepino[4,5-b]indole-5-carboxylate
CAS 2973762-95-5C15H18N2O2
1,4,5,6-Tetrahydro-7-nitro-azepino[4,5-b]indole-3(2H)-carboxylic acid 1,1-dimethylethyl ester chemical structure, C17H21N3O4, CAS 313369-48-1
1,4,5,6-Tetrahydro-7-nitro-azepino[4,5-b]indole-3(2H)-carboxylic acid 1,1-dimethylethyl ester
CAS 313369-48-1C17H21N3O4