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Murcko scaffold

Ring system with 3 rings and 18 atoms

18 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
18
Chemicals
18
With full pages
9
Scaffold SMILES

c1ccc(NCc2cnc3ncncc3c2)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(NCc2cnc3ncncc3c2)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 18 of 18 chemicals

SoRI 8895 chemical structure, C17H20N6O2, CAS 159210-76-1
SoRI 8895
CAS 159210-76-1C17H20N6O2
SoRI 8897 chemical structure, C17H17F3N6O, CAS 174654-98-9
SoRI 8897
CAS 174654-98-9C17H17F3N6O
SoRI 8890 chemical structure, C17H20N6O2, CAS 163629-16-1
SoRI 8890
CAS 163629-16-1C17H20N6O2
5-Deazaaminopterin chemical structure, C20H21N7O5, CAS 80360-09-4
5-Deazaaminopterin
CAS 80360-09-4C20H21N7O5
10-Propargyl-5-deazaaminopterin analog of folic acid chemical structure, C23H23N7O5, CAS 135423-84-6
10-Propargyl-5-deazaaminopterin analog of folic acid
CAS 135423-84-6C23H23N7O5
10-Propargyl-5-methyl-5-deazaaminopterin analog of folic acid chemical structure, C24H25N7O5, CAS 135423-85-7
10-Propargyl-5-methyl-5-deazaaminopterin analog of folic acid
CAS 135423-85-7C24H25N7O5
2-[[4-[(2,4-Diaminopyrido[2,3-d]pyrimidin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid chemical structure, C21H23N7O5, CAS 80360-10-7
2-[[4-[(2,4-Diaminopyrido[2,3-d]pyrimidin-6-yl)methyl-methylamino]benzoyl]amino]pentanedioic acid
CAS 80360-10-7C21H23N7O5
Diethyl 2-[[4-[(2,4-diaminopyrido[2,3-d]pyrimidin-6-yl)methylamino]benzoyl]amino]pentanedioate chemical structure, C24H29N7O5, CAS 80360-08-3
Diethyl 2-[[4-[(2,4-diaminopyrido[2,3-d]pyrimidin-6-yl)methylamino]benzoyl]amino]pentanedioate
CAS 80360-08-3C24H29N7O5
2,4-Diamino-5-methyl-6-[(3,4,5-trimethoxy-N-methylanilino)methyl]pyrido[2,3-D]pyrimidine chemical structure, C19H24N6O3, CAS 145936-40-9
2,4-Diamino-5-methyl-6-[(3,4,5-trimethoxy-N-methylanilino)methyl]pyrido[2,3-D]pyrimidine
CAS 145936-40-9C19H24N6O3
6-[(2,5-Dimethylanilino)methyl]-5-methyl-pyrido[2,3-d]pyrimidine-2,4-diamine chemical structure, C17H20N6, CAS 174655-01-7
6-[(2,5-Dimethylanilino)methyl]-5-methyl-pyrido[2,3-d]pyrimidine-2,4-diamine
CAS 174655-01-7C17H20N6
6-[(4-Chloro-phenylamino)-methyl]-5-methyl-pyrido[2,3-d]pyrimidine-2,4-diamine chemical structure, C15H15ClN6, CAS 174654-96-7
6-[(4-Chloro-phenylamino)-methyl]-5-methyl-pyrido[2,3-d]pyrimidine-2,4-diamine
CAS 174654-96-7C15H15ClN6
Pyrido(2,3-d)pyrimidine-2,4-diamine, 6-(((4-chlorophenyl)amino)methyl)- chemical structure, C14H13ClN6, CAS 174655-07-3
Pyrido(2,3-d)pyrimidine-2,4-diamine, 6-(((4-chlorophenyl)amino)methyl)-
CAS 174655-07-3C14H13ClN6
5-Methyl-6-phenylaminomethyl-pyrido[2,3-d]pyrimidine-2,4-diamine chemical structure, C15H16N6, CAS 175601-23-7
5-Methyl-6-phenylaminomethyl-pyrido[2,3-d]pyrimidine-2,4-diamine
CAS 175601-23-7C15H16N6
24DiAm5Me6(2MePhAm)Mepyrido[23d]pyrimidine chemical structure, C16H18N6, CAS 175601-33-9
24DiAm5Me6(2MePhAm)Mepyrido[23d]pyrimidine
CAS 175601-33-9C16H18N6
24DiAm5Me6(4-Ac-PhAm)Mepyrido[23d]pyrimidine chemical structure, C17H18N6O, CAS 175601-31-7
24DiAm5Me6(4-Ac-PhAm)Mepyrido[23d]pyrimidine
CAS 175601-31-7C17H18N6O
24DiAm5Me6(3-Ac-PhAm)Mepyrido[23d]pyrimidine chemical structure, C17H18N6O, CAS 175601-32-8
24DiAm5Me6(3-Ac-PhAm)Mepyrido[23d]pyrimidine
CAS 175601-32-8C17H18N6O
24DiAm5Me6(35diMePhAm)Mepyrido[23d]pyrimidine chemical structure, C17H20N6, CAS 175601-25-9
24DiAm5Me6(35diMePhAm)Mepyrido[23d]pyrimidine
CAS 175601-25-9C17H20N6
24DiAm5Me6(2EtOPhAm)Mepyrido[23d]pyrimidine chemical structure, C17H20N6O, CAS 215732-82-4
24DiAm5Me6(2EtOPhAm)Mepyrido[23d]pyrimidine
CAS 215732-82-4C17H20N6O