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Murcko scaffold

Ring system with 4 rings and 20 atoms

21 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
20
Chemicals
21
With full pages
7
Scaffold SMILES

c1ccc(C2=NNCCc3cc4c(cc32)OCO4)cc1

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 scaffold
Murcko scaffold c1ccc(C2=NNCCc3cc4c(cc32)OCO4)cc1

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 21 of 21 chemicals

Gyki 52895 chemical structure, C17H17N3O2, CAS 869360-93-0
Gyki 52895
CAS 869360-93-0C17H17N3O2
Gyki-53405 chemical structure, C19H19N3O3, CAS 143691-37-6
Gyki-53405
CAS 143691-37-6C19H19N3O3
7H-1,3-Dioxolo(4,5-h)(2,3)benzodiazepine-7-carboxamide, 5-(4-aminophenyl)-8,9-dihydro-N,8-dimethyl-, hydrochloride (1:1) chemical structure, C19H21ClN4O3, CAS 143692-48-2
7H-1,3-Dioxolo(4,5-h)(2,3)benzodiazepine-7-carboxamide, 5-(4-aminophenyl)-8,9-dihydro-N,8-dimethyl-, hydrochloride (1:1)
CAS 143692-48-2C19H21ClN4O3
Gyki-53655 chemical structure, C19H20N4O3, CAS 143692-18-6
Gyki-53655
CAS 143692-18-6C19H20N4O3
Talampanel chemical structure, C19H19N3O3, CAS 161832-65-1
Talampanel
CAS 161832-65-1C19H19N3O3
Acetamide, N-acetyl-N-(4-(7-acetyl-8,9-dihydro-8-methyl-7H-1,3-dioxolo(4,5-h)(2,3)benzodiazepin-5-yl)phenyl)- chemical structure, C23H23N3O5, CAS 143691-58-1
Acetamide, N-acetyl-N-(4-(7-acetyl-8,9-dihydro-8-methyl-7H-1,3-dioxolo(4,5-h)(2,3)benzodiazepin-5-yl)phenyl)-
CAS 143691-58-1C23H23N3O5
Propanamide, N-(4-(8,9-dihydro-8-methyl-7-(1-oxopropyl)-7H-1,3-dioxolo(4,5-h)(2,3)benzodiazepin-5-yl)phenyl)- chemical structure, C23H25N3O4, CAS 143691-63-8
Propanamide, N-(4-(8,9-dihydro-8-methyl-7-(1-oxopropyl)-7H-1,3-dioxolo(4,5-h)(2,3)benzodiazepin-5-yl)phenyl)-
CAS 143691-63-8C23H25N3O4
7H-1,3-Dioxolo(4,5-h)(2,3)benzodiazepine, 8,9-dihydro-7-acetyl-5-(4-(formylamino)phenyl)-8-methyl- chemical structure, C20H19N3O4, CAS 143691-64-9
7H-1,3-Dioxolo(4,5-h)(2,3)benzodiazepine, 8,9-dihydro-7-acetyl-5-(4-(formylamino)phenyl)-8-methyl-
CAS 143691-64-9C20H19N3O4
Propanamide, N-(4-(7-acetyl-8,9-dihydro-8-methyl-7H-1,3-dioxolo(4,5-h)(2,3)benzodiazepin-5-yl)phenyl)- chemical structure, C22H23N3O4, CAS 143691-66-1
Propanamide, N-(4-(7-acetyl-8,9-dihydro-8-methyl-7H-1,3-dioxolo(4,5-h)(2,3)benzodiazepin-5-yl)phenyl)-
CAS 143691-66-1C22H23N3O4
Acetamide, N-(4-(7-acetyl-8,9-dihydro-8-methyl-7H-1,3-dioxolo(4,5-h)(2,3)benzodiazepin-5-yl)phenyl)-2-methoxy- chemical structure, C22H23N3O5, CAS 143691-70-7
Acetamide, N-(4-(7-acetyl-8,9-dihydro-8-methyl-7H-1,3-dioxolo(4,5-h)(2,3)benzodiazepin-5-yl)phenyl)-2-methoxy-
CAS 143691-70-7C22H23N3O5
Acetamide, N-(4-(7-acetyl-8,9-dihydro-8-methyl-7H-1,3-dioxolo(4,5-h)(2,3)benzodiazepin-5-yl)phenyl)-2,2,2-trifluoro- chemical structure, C21H18F3N3O4, CAS 143691-80-9
Acetamide, N-(4-(7-acetyl-8,9-dihydro-8-methyl-7H-1,3-dioxolo(4,5-h)(2,3)benzodiazepin-5-yl)phenyl)-2,2,2-trifluoro-
CAS 143691-80-9C21H18F3N3O4
7H-1,3-Dioxolo(4,5-h)(2,3)benzodiazepine-7-carboxamide, 8,9-dihydro-5-(4-((aminoacetyl)amino)phenyl)-N,8-dimethyl- chemical structure, C21H23N5O4, CAS 143692-37-9
7H-1,3-Dioxolo(4,5-h)(2,3)benzodiazepine-7-carboxamide, 8,9-dihydro-5-(4-((aminoacetyl)amino)phenyl)-N,8-dimethyl-
CAS 143692-37-9C21H23N5O4
7H-1,3-Dioxolo(4,5-h)(2,3)benzodiazepine, 8,9-dihydro-7-acetyl-5-(4-aminophenyl)-8-methyl-, monohydrochloride chemical structure, C19H20ClN3O3, CAS 143692-40-4
7H-1,3-Dioxolo(4,5-h)(2,3)benzodiazepine, 8,9-dihydro-7-acetyl-5-(4-aminophenyl)-8-methyl-, monohydrochloride
CAS 143692-40-4C19H20ClN3O3
Acetamide, N-(4-(7-acetyl-8,9-dihydro-8-methyl-7H-1,3-dioxolo(4,5-h)(2,3)benzodiazepin-5-yl)phenyl)- chemical structure, C21H21N3O4, CAS 143692-53-9
Acetamide, N-(4-(7-acetyl-8,9-dihydro-8-methyl-7H-1,3-dioxolo(4,5-h)(2,3)benzodiazepin-5-yl)phenyl)-
CAS 143692-53-9C21H21N3O4
Gyki 53784 chemical structure, C19H20N4O3, CAS 161832-71-9
Gyki 53784
CAS 161832-71-9C19H20N4O3
Acetamide, N-(4-(7-acetyl-8,9-dihydro-8-methyl-7H-1,3-dioxolo(4,5-h)(2,3)benzodiazepin-5-yl)phenyl)-2-amino-, monohydrochloride chemical structure, C21H23ClN4O4, CAS 173087-59-7
Acetamide, N-(4-(7-acetyl-8,9-dihydro-8-methyl-7H-1,3-dioxolo(4,5-h)(2,3)benzodiazepin-5-yl)phenyl)-2-amino-, monohydrochloride
CAS 173087-59-7C21H23ClN4O4
Egis-8332 chemical structure, C20H18N4O3, CAS 220725-87-1
Egis-8332
CAS 220725-87-1C20H18N4O3
7H-1,3-Dioxolo(4,5-H)(2,3)benzodiazepine-7-carboxamide, 5-(4-aminophenyl)-8,9-dihydro-N,8-dimethyl-, (8S)- chemical structure, C19H20N4O3, CAS 161832-69-5
7H-1,3-Dioxolo(4,5-H)(2,3)benzodiazepine-7-carboxamide, 5-(4-aminophenyl)-8,9-dihydro-N,8-dimethyl-, (8S)-
CAS 161832-69-5C19H20N4O3
Talampanel, (S)- chemical structure, C19H19N3O3, CAS 161832-67-3
Talampanel, (S)-
CAS 161832-67-3C19H19N3O3
1-[5-(4-Aminophenyl)-8,9-dihydro-8-methyl-7H-1,3-dioxolo[4,5-h][2,3]benzodiazepin-7-yl]-2,2,2-trifluoroethanone chemical structure, C19H16F3N3O3, CAS 143691-38-7
1-[5-(4-Aminophenyl)-8,9-dihydro-8-methyl-7H-1,3-dioxolo[4,5-h][2,3]benzodiazepin-7-yl]-2,2,2-trifluoroethanone
CAS 143691-38-7C19H16F3N3O3
AMPA receptor antagonist-2 chemical structure, C18H17N3O4, CAS 732277-05-3
AMPA receptor antagonist-2
CAS 732277-05-3C18H17N3O4