CompoundList
Sign in
Murcko scaffold

Ring system with 6 rings and 29 atoms

6 chemicals on CompoundList share this ring system.

Rings
6
Scaffold atoms
29
Chemicals
6
With full pages
3
Scaffold SMILES

O=C1NC(=O)C(c2c3n(c4ccccc24)CCCC3)=C1c1c[nH]c2ccccc12

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 O=C1NC(=O)C(c2c3n(c4ccccc24)CCCC3)=C1c1c[nH]c2ccccc12

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 6 of 6 chemicals

Ro 31-8425 chemical structure, C26H24N4O2, CAS 131848-97-0
Ro 31-8425
CAS 131848-97-0C26H24N4O2
Ro 31-8830 chemical structure, C28H28N4O2, CAS 131848-98-1
Ro 31-8830
CAS 131848-98-1C28H28N4O2
(S)-3-(8-((Dimethylamino)methyl)-6,7,8,9-tetrahydropyrido(1,2-a)indol-10-yl)-4-(1-methyl-1H-indol-3-yl)-1H-pyrrol-2,5-dione chemical structure, C28H28N4O2, CAS 151342-35-7
(S)-3-(8-((Dimethylamino)methyl)-6,7,8,9-tetrahydropyrido(1,2-a)indol-10-yl)-4-(1-methyl-1H-indol-3-yl)-1H-pyrrol-2,5-dione
CAS 151342-35-7C28H28N4O2
3-(8-(Hydroxymethyl)-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl)-4-(1-methyl-1H-indol-3-yl)-1H-pyrrole-2,5-dione chemical structure, C26H23N3O3, CAS 131848-12-9
3-(8-(Hydroxymethyl)-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl)-4-(1-methyl-1H-indol-3-yl)-1H-pyrrole-2,5-dione
CAS 131848-12-9C26H23N3O3
Bisindolylmaleimide X hydrochloride chemical structure, C26H25ClN4O2, CAS 145317-11-9
Bisindolylmaleimide X hydrochloride
CAS 145317-11-9C26H25ClN4O2
(S)-3-(8-(Dimethylaminomethyl)-6,7,8,9-tetrahydropyrido(1,2-a)indol-10-yl)-4-(1-methyl-3-indolyl)-1H-pyrrole-2,5-dione hydrochloride chemical structure, C28H29ClN4O2, CAS 1781828-85-0
(S)-3-(8-(Dimethylaminomethyl)-6,7,8,9-tetrahydropyrido(1,2-a)indol-10-yl)-4-(1-methyl-3-indolyl)-1H-pyrrole-2,5-dione hydrochloride
CAS 1781828-85-0C28H29ClN4O2