CompoundList
Sign in
Murcko scaffold

Ring system with 3 rings and 18 atoms

48 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
18
Chemicals
48
With full pages
10
Scaffold SMILES

c1ccc(NCc2ccc3ncncc3c2)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(NCc2ccc3ncncc3c2)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 48 of 48 chemicals

Trimetrexate chemical structure, C19H23N5O3, CAS 52128-35-5
Trimetrexate
CAS 52128-35-5C19H23N5O3
Quinaspar chemical structure, C20H20N6O5, CAS 18921-65-8
Quinaspar
CAS 18921-65-8C20H20N6O5
N-(4-(((2,4-Diamino-5-chloro-6-quinazolinyl)methyl)amino)benzoyl)-L-aspartic acid chemical structure, C20H19ClN6O5, CAS 18921-73-8
N-(4-(((2,4-Diamino-5-chloro-6-quinazolinyl)methyl)amino)benzoyl)-L-aspartic acid
CAS 18921-73-8C20H19ClN6O5
Trimetrexate glucuronate chemical structure, C25H33N5O10, CAS 82952-64-5
Trimetrexate glucuronate
CAS 82952-64-5C25H33N5O10
N-(4-(((2,4-Diamino-5-methyl-6-quinazolinyl)methyl)amino)benzoyl)-L-aspartic acid disodium salt chemical structure, C21H20N6Na2O5, CAS 18921-69-2
N-(4-(((2,4-Diamino-5-methyl-6-quinazolinyl)methyl)amino)benzoyl)-L-aspartic acid disodium salt
CAS 18921-69-2C21H20N6Na2O5
CB 3703 chemical structure, C22H24N6O5, CAS 32093-09-7
CB 3703
CAS 32093-09-7C22H24N6O5
N-(4-(((2,4-Diamino-6-quinazolinyl)methyl)amino)benzoyl)-L-glutamic acid chemical structure, C21H22N6O5, CAS 18921-68-1
N-(4-(((2,4-Diamino-6-quinazolinyl)methyl)amino)benzoyl)-L-glutamic acid
CAS 18921-68-1C21H22N6O5
3-[(4-{[(2,4-Diaminoquinazolin-6-yl)methyl]amino}benzoyl)amino]pentanedioic acid chemical structure, C21H22N6O5, CAS 69827-70-9
3-[(4-{[(2,4-Diaminoquinazolin-6-yl)methyl]amino}benzoyl)amino]pentanedioic acid
CAS 69827-70-9C21H22N6O5
2-{4-[(2,4-Diamino-quinazolin-6-ylmethyl)-methyl-amino]-benzoylamino}-pentanedioic acid chemical structure, C22H24N6O5, CAS 27244-49-1
2-{4-[(2,4-Diamino-quinazolin-6-ylmethyl)-methyl-amino]-benzoylamino}-pentanedioic acid
CAS 27244-49-1C22H24N6O5
2-[[3-[(2,4-Diaminoquinazolin-6-yl)methylamino]benzoyl]amino]pentanedioic acid chemical structure, C21H22N6O5, CAS 29746-12-1
2-[[3-[(2,4-Diaminoquinazolin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
CAS 29746-12-1C21H22N6O5
2-[[4-[(2,4-Diamino-5-chloroquinazolin-6-yl)methylamino]benzoyl]amino]pentanedioic acid chemical structure, C21H21ClN6O5, CAS 20242-62-0
2-[[4-[(2,4-Diamino-5-chloroquinazolin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
CAS 20242-62-0C21H21ClN6O5
Pentanedioic acid, 3-((4-(((2,4-diamino-5-methyl-6-quinazolinyl)methyl)amino)benzoyl)amino)- chemical structure, C22H24N6O5, CAS 69827-75-4
Pentanedioic acid, 3-((4-(((2,4-diamino-5-methyl-6-quinazolinyl)methyl)amino)benzoyl)amino)-
CAS 69827-75-4C22H24N6O5
Lymphosarcin chemical structure, C15H12Cl3N5, CAS 59318-71-7
Lymphosarcin
CAS 59318-71-7C15H12Cl3N5
6-[(3,4-Dichloroanilino)methyl]-5-methylquinazoline-2,4-diamine chemical structure, C16H15Cl2N5, CAS 52128-33-3
6-[(3,4-Dichloroanilino)methyl]-5-methylquinazoline-2,4-diamine
CAS 52128-33-3C16H15Cl2N5
N-[(2,4-Diaminoquinazolin-6-yl)methyl]-N-(3,4-dichlorophenyl)nitrous amide chemical structure, C15H12Cl2N6O, CAS 52128-21-9
N-[(2,4-Diaminoquinazolin-6-yl)methyl]-N-(3,4-dichlorophenyl)nitrous amide
CAS 52128-21-9C15H12Cl2N6O
6-[(3,4-Dichloro-N-methylanilino)methyl]quinazoline-2,4-diamine chemical structure, C16H15Cl2N5, CAS 69827-77-6
6-[(3,4-Dichloro-N-methylanilino)methyl]quinazoline-2,4-diamine
CAS 69827-77-6C16H15Cl2N5
N-[(2,4-Diaminoquinazolin-6-yl)methyl]-N-(3,4-dichlorophenyl)acetamide chemical structure, C17H15Cl2N5O, CAS 52128-26-4
N-[(2,4-Diaminoquinazolin-6-yl)methyl]-N-(3,4-dichlorophenyl)acetamide
CAS 52128-26-4C17H15Cl2N5O
N-[(2,4-Diamino-5-methylquinazolin-6-yl)methyl]-N-(3,4-dichlorophenyl)nitrous amide chemical structure, C16H14Cl2N6O, CAS 52128-38-8
N-[(2,4-Diamino-5-methylquinazolin-6-yl)methyl]-N-(3,4-dichlorophenyl)nitrous amide
CAS 52128-38-8C16H14Cl2N6O
6-[(4-Chloroanilino)methyl]quinazoline-2,4-diamine chemical structure, C15H14ClN5, CAS 52128-05-9
6-[(4-Chloroanilino)methyl]quinazoline-2,4-diamine
CAS 52128-05-9C15H14ClN5
6-[(3-Bromoanilino)methyl]quinazoline-2,4-diamine chemical structure, C15H14BrN5, CAS 52128-17-3
6-[(3-Bromoanilino)methyl]quinazoline-2,4-diamine
CAS 52128-17-3C15H14BrN5
6-[(3-Bromoanilino)methyl]-5-methylquinazoline-2,4-diamine chemical structure, C16H16BrN5, CAS 52128-31-1
6-[(3-Bromoanilino)methyl]-5-methylquinazoline-2,4-diamine
CAS 52128-31-1C16H16BrN5
6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine chemical structure, C16H13ClF3N5, CAS 52128-19-5
6-{[4-Chloro-3-(trifluoromethyl)anilino]methyl}quinazoline-2,4-diamine
CAS 52128-19-5C16H13ClF3N5
6-[(3,4,5-Trimethoxyanilino)methyl]quinazoline-2,4-diamine chemical structure, C18H21N5O3, CAS 52128-09-3
6-[(3,4,5-Trimethoxyanilino)methyl]quinazoline-2,4-diamine
CAS 52128-09-3C18H21N5O3
2-[[4-[(2,4-Diaminoquinazolin-6-yl)methyl-formylamino]benzoyl]amino]pentanedioic acid chemical structure, C22H22N6O6, CAS 61075-41-0
2-[[4-[(2,4-Diaminoquinazolin-6-yl)methyl-formylamino]benzoyl]amino]pentanedioic acid
CAS 61075-41-0C22H22N6O6