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Murcko scaffold

Ring system with 4 rings and 22 atoms

5 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
22
Chemicals
5
With full pages
2
Scaffold SMILES

c1cncc(N2CCc3ncnc(NC4CCNC4)c3C2)c1

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 c1cncc(N2CCc3ncnc(NC4CCNC4)c3C2)c1

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 5 of 5 chemicals

(S)-3-[6-(6-Methoxy-5-trifluoromethyl-pyridin-3-yl)-5,6,7,8-tetrahydro-pyrido[4,3-d]pyrimidin-4-ylamino]-pyrrolidine-1-carboxylic acid tert-butyl ester chemical structure, C23H29F3N6O3, CAS 1354691-73-8
(S)-3-[6-(6-Methoxy-5-trifluoromethyl-pyridin-3-yl)-5,6,7,8-tetrahydro-pyrido[4,3-d]pyrimidin-4-ylamino]-pyrrolidine-1-carboxylic acid tert-butyl ester
CAS 1354691-73-8C23H29F3N6O3
Leniolisib chemical structure, C21H25F3N6O2, CAS 1354690-24-6
Leniolisib
CAS 1354690-24-6C21H25F3N6O2
(S)-6-(6-Methoxy-5-(trifluoromethyl)pyridin-3-yl)-N-(pyrrolidin-3-yl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-amine bis(2,2,2-trifluoroacetate) chemical structure, C22H23F9N6O5, CAS 1354692-01-5
(S)-6-(6-Methoxy-5-(trifluoromethyl)pyridin-3-yl)-N-(pyrrolidin-3-yl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4-amine bis(2,2,2-trifluoroacetate)
CAS 1354692-01-5C22H23F9N6O5
Leniolisib phosphate chemical structure, C21H28F3N6O6P, CAS 1354691-97-6
Leniolisib phosphate
CAS 1354691-97-6C21H28F3N6O6P
(S)-6-(6-Methoxy-5-(trifluoromethyl)pyridin-3-yl)-N-(pyrrolidin-3-yl)-5,6,7,8-tetrahydropyrido[4,3-D]pyrimidin-4-amine hcl chemical structure, C18H22ClF3N6O, CAS 2225878-53-3
(S)-6-(6-Methoxy-5-(trifluoromethyl)pyridin-3-yl)-N-(pyrrolidin-3-yl)-5,6,7,8-tetrahydropyrido[4,3-D]pyrimidin-4-amine hcl
CAS 2225878-53-3C18H22ClF3N6O