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Murcko scaffold

Ring system with 4 rings and 23 atoms

6 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
23
Chemicals
6
With full pages
4
Scaffold SMILES

c1ccc(-c2nccc(N3CCc4ccccc4CC3)n2)nc1

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(-c2nccc(N3CCc4ccccc4CC3)n2)nc1

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

Gsk-J1 chemical structure, C22H23N5O2, CAS 1373422-53-7
Gsk-J1
CAS 1373422-53-7C22H23N5O2
Ethyl 3-((2-(4-(3-(methylamino)propyl)pyridin-2-yl)-6-(1,2,4,5-tetrahydro-3H-benzo[d]azepin-3-yl)pyrimidin-4-yl)amino)propanoate chemical structure, C28H36N6O2, CAS 1373424-27-1
Ethyl 3-((2-(4-(3-(methylamino)propyl)pyridin-2-yl)-6-(1,2,4,5-tetrahydro-3H-benzo[d]azepin-3-yl)pyrimidin-4-yl)amino)propanoate
CAS 1373424-27-1C28H36N6O2
GSK-J4 hydrochloride chemical structure, C24H28ClN5O2, CAS 1797983-09-5
GSK-J4 hydrochloride
CAS 1797983-09-5C24H28ClN5O2
Gsk-J4 chemical structure, C24H27N5O2, CAS 1373423-53-0
Gsk-J4
CAS 1373423-53-0C24H27N5O2
GSK-J1 (lithium salt) chemical structure, C22H22LiN5O2, CAS 2309668-29-7
GSK-J1 (lithium salt)
CAS 2309668-29-7C22H22LiN5O2
GSK-J1SodiumSalt chemical structure, C22H22N5NaO2, CAS 1797832-71-3
GSK-J1SodiumSalt
CAS 1797832-71-3C22H22N5NaO2