CompoundList
Sign in
Murcko scaffold

Ring system with 3 rings and 21 atoms

6 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
21
Chemicals
6
With full pages
2
Scaffold SMILES

O=C(Cc1ccccc1)N1CCCCC1CN1CCCC1

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=C(Cc1ccccc1)N1CCCCC1CN1CCCC1

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

Brl 53117 chemical structure, C20H28Cl2N2O2, CAS 157000-71-0
Brl 53117
CAS 157000-71-0C20H28Cl2N2O2
2-(3,4-Dichlorophenyl)-1-[(2S)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanone chemical structure, C18H24Cl2N2O, CAS 130497-34-6
2-(3,4-Dichlorophenyl)-1-[(2S)-2-(pyrrolidin-1-ylmethyl)piperidin-1-yl]ethanone
CAS 130497-34-6C18H24Cl2N2O
BRL 52537 hydrochloride chemical structure, C18H25Cl3N2O, CAS 112282-24-3
BRL 52537 hydrochloride
CAS 112282-24-3C18H25Cl3N2O
ZT 52656A hydrochloride chemical structure, C19H26ClF3N2O, CAS 115730-24-0
ZT 52656A hydrochloride
CAS 115730-24-0C19H26ClF3N2O
4-Methoxycarbonyl-2-(1-pyrrolidinylmethyl)-1-[(3,4-dichlorophenyl)acetyl]-piperidine chemical structure, C20H26Cl2N2O3, CAS 261904-04-5
4-Methoxycarbonyl-2-(1-pyrrolidinylmethyl)-1-[(3,4-dichlorophenyl)acetyl]-piperidine
CAS 261904-04-5C20H26Cl2N2O3
1-[2-(3,4-Dichloro-phenyl)-acetyl]-6-pyrrolidin-1-ylmethyl-piperidine-2-carboxylic acid methyl ester chemical structure, C20H26Cl2N2O3, CAS 125104-88-3
1-[2-(3,4-Dichloro-phenyl)-acetyl]-6-pyrrolidin-1-ylmethyl-piperidine-2-carboxylic acid methyl ester
CAS 125104-88-3C20H26Cl2N2O3