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Murcko scaffold

Ring system with 3 rings and 20 atoms

728 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
20
Chemicals
728
With full pages
10
Scaffold SMILES

O=C(NCc1ccc(-c2cncs2)cc1)C1CCCN1

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 O=C(NCc1ccc(-c2cncs2)cc1)C1CCCN1

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 728 chemicals

(2S,4R)-1-Acetyl-4-hydroxy-N-[[4-(4-methyl-5-thiazolyl)phenyl]methyl]-2-pyrrolidinecarboxamide chemical structure, C18H21N3O3S, CAS 1448187-20-9
(2S,4R)-1-Acetyl-4-hydroxy-N-[[4-(4-methyl-5-thiazolyl)phenyl]methyl]-2-pyrrolidinecarboxamide
CAS 1448187-20-9C18H21N3O3S
N-Acetyl-3-Methyl-L-Valyl-(4r)-4-Hydroxy-N-[4-(4-Methyl-1,3-Thiazol-5-Yl)benzyl]-L-Prolinamide chemical structure, C24H32N4O4S, CAS 1448188-62-2
N-Acetyl-3-Methyl-L-Valyl-(4r)-4-Hydroxy-N-[4-(4-Methyl-1,3-Thiazol-5-Yl)benzyl]-L-Prolinamide
CAS 1448188-62-2C24H32N4O4S
(2S,4R)-4-Hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide chemical structure, C16H19N3O2S, CAS 1448189-45-4
(2S,4R)-4-Hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide
CAS 1448189-45-4C16H19N3O2S
(2R,4S)-4-Hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide chemical structure, C16H19N3O2S, CAS 1584667-52-6
(2R,4S)-4-Hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide
CAS 1584667-52-6C16H19N3O2S
(2S,4R)-tert-Butyl 4-hydroxy-2-((4-(4-methylthiazol-5-yl)benzyl)carbamoyl)pyrrolidine-1-carboxylate chemical structure, C21H27N3O4S, CAS 1448191-54-5
(2S,4R)-tert-Butyl 4-hydroxy-2-((4-(4-methylthiazol-5-yl)benzyl)carbamoyl)pyrrolidine-1-carboxylate
CAS 1448191-54-5C21H27N3O4S
(2S,4R)-4-Hydroxy-N-(2-hydroxy-4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide chemical structure, C16H19N3O3S, CAS 1448297-55-9
(2S,4R)-4-Hydroxy-N-(2-hydroxy-4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide
CAS 1448297-55-9C16H19N3O3S
(2S,4R)-1-[(2S)-2-Amino-3,3-dimethylbutanoyl]-4-hydroxy-N-{[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl}pyrrolidine-2-carboxamide chemical structure, C22H30N4O3S, CAS 1448297-52-6
(2S,4R)-1-[(2S)-2-Amino-3,3-dimethylbutanoyl]-4-hydroxy-N-{[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl}pyrrolidine-2-carboxamide
CAS 1448297-52-6C22H30N4O3S
VH032 analogue-2 chemical structure, C26H36N4O5S, CAS 1448189-66-9
VH032 analogue-2
CAS 1448189-66-9C26H36N4O5S
(2S,4R)-1-(2-Amino-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide chemical structure, C22H30N4O3S, CAS 2369022-72-8
(2S,4R)-1-(2-Amino-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide
CAS 2369022-72-8C22H30N4O3S
tert-Butyl (2S,4R)-4-hydroxy-2-((2-hydroxy-4-(4-methylthiazol-5-yl)benzyl)carbamoyl)pyrrolidine-1-carboxylate chemical structure, C21H27N3O5S, CAS 1448190-12-2
tert-Butyl (2S,4R)-4-hydroxy-2-((2-hydroxy-4-(4-methylthiazol-5-yl)benzyl)carbamoyl)pyrrolidine-1-carboxylate
CAS 1448190-12-2C21H27N3O5S
(S,R,S)-AHPC-Boc chemical structure, C27H38N4O5S, CAS 1448189-98-7
(S,R,S)-AHPC-Boc
CAS 1448189-98-7C27H38N4O5S
(2S,4R)-1-((S)-2-Amino-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide hydrochloride chemical structure, C22H31ClN4O3S, CAS 1448189-80-7
(2S,4R)-1-((S)-2-Amino-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide hydrochloride
CAS 1448189-80-7C22H31ClN4O3S
L-Prolinamide, 3-methyl-L-valyl-4-hydroxy-N-((1S)-1-(4-(4-methyl-5-thiazolyl)phenyl)ethyl)-, hydrochloride (1:1), (4R)- chemical structure, C23H33ClN4O3S, CAS 1948273-03-7
L-Prolinamide, 3-methyl-L-valyl-4-hydroxy-N-((1S)-1-(4-(4-methyl-5-thiazolyl)phenyl)ethyl)-, hydrochloride (1:1), (4R)-
CAS 1948273-03-7C23H33ClN4O3S
L-Prolinamide, 3-methyl-L-valyl-4-hydroxy-N-[(1S)-1-[4-(4-methyl-5-thiazolyl)phenyl]ethyl]-, (4R)- chemical structure, C23H32N4O3S, CAS 1948273-02-6
L-Prolinamide, 3-methyl-L-valyl-4-hydroxy-N-[(1S)-1-[4-(4-methyl-5-thiazolyl)phenyl]ethyl]-, (4R)-
CAS 1948273-02-6C23H32N4O3S
(2S,4R)-4-Hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide hydrochloride chemical structure, C16H20ClN3O2S, CAS 1448189-90-9
(2S,4R)-4-Hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide hydrochloride
CAS 1448189-90-9C16H20ClN3O2S
(4R)-1-((S)-2-Amino-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide chemical structure, C22H30N4O3S, CAS 2139264-33-6
(4R)-1-((S)-2-Amino-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide
CAS 2139264-33-6C22H30N4O3S
VH032-NH-CO-CH2-NHBoc chemical structure, C29H41N5O6S, CAS 2010986-19-1
VH032-NH-CO-CH2-NHBoc
CAS 2010986-19-1C29H41N5O6S
VHL Ligand 14 chemical structure, C25H34N4O4S, CAS 2010986-87-3
VHL Ligand 14
CAS 2010986-87-3C25H34N4O4S
(S,R,S)-Ahpc-C1-NH2 chemical structure, C24H33N5O4S, CAS 2010986-20-4
(S,R,S)-Ahpc-C1-NH2
CAS 2010986-20-4C24H33N5O4S
E3 ligase Ligand-Linker Conjugates 12 chemical structure, C30H43N7O7S, CAS 1797406-80-4
E3 ligase Ligand-Linker Conjugates 12
CAS 1797406-80-4C30H43N7O7S
E3 ligase Ligand-Linker Conjugates 3 chemical structure, C26H35N7O5S, CAS 2101200-09-1
E3 ligase Ligand-Linker Conjugates 3
CAS 2101200-09-1C26H35N7O5S
(2S,4R)-1-((S)-2-(2-(2-(2-Azidoethoxy)ethoxy)acetamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide chemical structure, C28H39N7O6S, CAS 2010159-45-0
(2S,4R)-1-((S)-2-(2-(2-(2-Azidoethoxy)ethoxy)acetamido)-3,3-dimethylbutanoyl)-4-hydroxy-N-(4-(4-methylthiazol-5-yl)benzyl)pyrrolidine-2-carboxamide
CAS 2010159-45-0C28H39N7O6S
(S,S,S)-AHPC-Boc chemical structure, C27H38N4O5S, CAS 1797406-74-6
(S,S,S)-AHPC-Boc
CAS 1797406-74-6C27H38N4O5S
VH032-Boc chemical structure, C27H38N4O5S, CAS 1799506-31-2
VH032-Boc
CAS 1799506-31-2C27H38N4O5S