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Murcko scaffold

Ring system with 3 rings and 17 atoms

14 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
17
Chemicals
14
With full pages
3
Scaffold SMILES

c1ccc(CNc2ccnc3ccnn23)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(CNc2ccnc3ccnn23)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 14 of 14 chemicals

n-Benzyl-5-chloro-3-isopropylpyrazolo[1,5-a]pyrimidin-7-amine chemical structure, C16H17ClN4, CAS 1092443-98-5
n-Benzyl-5-chloro-3-isopropylpyrazolo[1,5-a]pyrimidin-7-amine
CAS 1092443-98-5C16H17ClN4
BS-194 chemical structure, C20H27N5O3, CAS 1092443-55-4
BS-194
CAS 1092443-55-4C20H27N5O3
N-Benzyl-5-chloropyrazolo[1,5-a]pyrimidin-7-amine chemical structure, C13H11ClN4, CAS 1091598-63-8
N-Benzyl-5-chloropyrazolo[1,5-a]pyrimidin-7-amine
CAS 1091598-63-8C13H11ClN4
tert-Butyl benzyl(5-chloro-3-isopropylpyrazolo[1,5-a]pyrimidin-7-yl)carbamate chemical structure, C21H25ClN4O2, CAS 1092444-33-1
tert-Butyl benzyl(5-chloro-3-isopropylpyrazolo[1,5-a]pyrimidin-7-yl)carbamate
CAS 1092444-33-1C21H25ClN4O2
N5-(6-aminohexyl)-N7-benzyl-3-isopropylpyrazolo[1,5-a]pyrimidine-5,7-diamine hydrochloride chemical structure, C22H33ClN6, CAS 1397219-81-6
N5-(6-aminohexyl)-N7-benzyl-3-isopropylpyrazolo[1,5-a]pyrimidine-5,7-diamine hydrochloride
CAS 1397219-81-6C22H33ClN6
BS-181 chemical structure, C22H32N6, CAS 1092443-52-1
BS-181
CAS 1092443-52-1C22H32N6
1,1-Dimethylethyl N-[3-(1-methylethyl)-5-[(1-methylethyl)amino]pyrazolo[1,5-a]pyrimidin-7-yl]-N-(phenylmethyl)carbamate chemical structure, C24H33N5O2, CAS 1092444-34-2
1,1-Dimethylethyl N-[3-(1-methylethyl)-5-[(1-methylethyl)amino]pyrazolo[1,5-a]pyrimidin-7-yl]-N-(phenylmethyl)carbamate
CAS 1092444-34-2C24H33N5O2
7-Benzylamino-3-bromopyrazolo[1,5-a]pyrimidine-6-carboxylic acid chemical structure, C14H11BrN4O2, CAS 1138513-39-9
7-Benzylamino-3-bromopyrazolo[1,5-a]pyrimidine-6-carboxylic acid
CAS 1138513-39-9C14H11BrN4O2
BS 181 dihydrochloride chemical structure, C22H34Cl2N6, CAS 1883548-83-1
BS 181 dihydrochloride
CAS 1883548-83-1C22H34Cl2N6
Ethyl 7-(benzyl(methyl)amino)-5-chloropyrazolo[1,5-a]pyrimidine-3-carboxylate chemical structure, C17H17ClN4O2, CAS 2271478-40-9
Ethyl 7-(benzyl(methyl)amino)-5-chloropyrazolo[1,5-a]pyrimidine-3-carboxylate
CAS 2271478-40-9C17H17ClN4O2
7-(Benzyl(methyl)amino)-5-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide chemical structure, C15H14ClN5O, CAS 2271471-22-6
7-(Benzyl(methyl)amino)-5-chloropyrazolo[1,5-a]pyrimidine-3-carboxamide
CAS 2271471-22-6C15H14ClN5O
(R)-PROTAC CDK9 ligand-1 chemical structure, C20H28N6O, CAS 2411021-95-7
(R)-PROTAC CDK9 ligand-1
CAS 2411021-95-7C20H28N6O
5-Chloro-N-(4-methoxybenzyl)-N-methyl-3-nitropyrazolo[1,5-a]pyrimidin-7-amine chemical structure, C15H14ClN5O3, CAS 2641638-18-6
5-Chloro-N-(4-methoxybenzyl)-N-methyl-3-nitropyrazolo[1,5-a]pyrimidin-7-amine
CAS 2641638-18-6C15H14ClN5O3
PROTAC CDK9 ligand-1 chemical structure, C20H28N6O, CAS 3031327-95-1
PROTAC CDK9 ligand-1
CAS 3031327-95-1C20H28N6O