CompoundList
Sign in
Murcko scaffold

Ring system with 4 rings and 19 atoms

4 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
19
Chemicals
4
With full pages
1
Scaffold SMILES

c1ccc2c(c1)CCN1CCNc3ccccc3C21

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 c1ccc2c(c1)CCN1CCNc3ccccc3C21

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 4 of 4 chemicals

2-Chloro-5,6,7,9,10,14B-hexahydro-5-methylisoquino(2,1-D)(1,4)benzodiazepine chemical structure, C18H19ClN2, CAS 17617-11-7
2-Chloro-5,6,7,9,10,14B-hexahydro-5-methylisoquino(2,1-D)(1,4)benzodiazepine
CAS 17617-11-7C18H19ClN2
Isoquino(2,1-d)(1,4)benzodiazepine, 5,6,7,9,10,14b-hexahydro-5-methyl- chemical structure, C18H20N2, CAS 19007-31-9
Isoquino(2,1-d)(1,4)benzodiazepine, 5,6,7,9,10,14b-hexahydro-5-methyl-
CAS 19007-31-9C18H20N2
Isoquino(2,1-d)(1,4)benzodiazepine, 5,6,7,9,10,14b-hexahydro-2-chloro- chemical structure, C17H17ClN2, CAS 19007-32-0
Isoquino(2,1-d)(1,4)benzodiazepine, 5,6,7,9,10,14b-hexahydro-2-chloro-
CAS 19007-32-0C17H17ClN2
Isoquino(2,1-d)(1,4)benzodiazepine, 5,6,7,9,10,14b-hexahydro-2-chloro-5,10-dimethyl- chemical structure, C19H21ClN2, CAS 19007-33-1
Isoquino(2,1-d)(1,4)benzodiazepine, 5,6,7,9,10,14b-hexahydro-2-chloro-5,10-dimethyl-
CAS 19007-33-1C19H21ClN2