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Murcko scaffold

Ring system with 4 rings and 22 atoms

7 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
22
Chemicals
7
With full pages
1
Scaffold SMILES

c1ccc(-c2nc(NC3CCNC3)c3ccccc3n2)cc1

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(-c2nc(NC3CCNC3)c3ccccc3n2)cc1

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 7 of 7 chemicals

Cct-241533 chemical structure, C23H27FN4O4, CAS 1262849-73-9
Cct-241533
CAS 1262849-73-9C23H27FN4O4
2-{4-[(3s)-Pyrrolidin-3-Ylamino]quinazolin-2-Yl}phenol chemical structure, C18H18N4O, CAS 1146159-38-7
2-{4-[(3s)-Pyrrolidin-3-Ylamino]quinazolin-2-Yl}phenol
CAS 1146159-38-7C18H18N4O
(s)-4-Chloro-2-(4-(pyrrolidin-3-ylamino)quinazolin-2-yl)phenol chemical structure, C18H17ClN4O, CAS 1146160-13-5
(s)-4-Chloro-2-(4-(pyrrolidin-3-ylamino)quinazolin-2-yl)phenol
CAS 1146160-13-5C18H17ClN4O
1-(tert-Butyl) 3-ethyl (3R,4S)-4-((2-(5-fluoro-2-hydroxyphenyl)-6,7-dimethoxyquinazolin-4-yl)amino)pyrrolidine-1,3-dicarboxylate chemical structure, C28H33FN4O7, CAS 1262849-80-8
1-(tert-Butyl) 3-ethyl (3R,4S)-4-((2-(5-fluoro-2-hydroxyphenyl)-6,7-dimethoxyquinazolin-4-yl)amino)pyrrolidine-1,3-dicarboxylate
CAS 1262849-80-8C28H33FN4O7
CCT241533 hydrochloride chemical structure, C23H28ClFN4O4, CAS 1431697-96-9
CCT241533 hydrochloride
CAS 1431697-96-9C23H28ClFN4O4
Phenol, 2-[4-[(3S)-3-pyrrolidinylamino]-2-quinazolinyl]- chemical structure, C18H18N4O
Phenol, 2-[4-[(3S)-3-pyrrolidinylamino]-2-quinazolinyl]-
C18H18N4O
CCT241533 (dihydrochloride) chemical structure, C23H29Cl2FN4O4, CAS 1962925-28-5
CCT241533 (dihydrochloride)
CAS 1962925-28-5C23H29Cl2FN4O4