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Murcko scaffold

Ring system with 3 rings and 18 atoms

17 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
18
Chemicals
17
With full pages
1
Scaffold SMILES

O=C(CCc1c[nH]c2ccccc12)N1CCCC1

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(CCc1c[nH]c2ccccc12)N1CCCC1

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 17 of 17 chemicals

Boc-DL-Leu-DL-Trp-DL-Pro-Gly-NH2 chemical structure, C29H42N6O6, CAS 72186-01-7
Boc-DL-Leu-DL-Trp-DL-Pro-Gly-NH2
CAS 72186-01-7C29H42N6O6
Methyl N-(tert-butoxycarbonyl)tryptophylprolylglycinate chemical structure, C24H32N4O6, CAS 72185-97-8
Methyl N-(tert-butoxycarbonyl)tryptophylprolylglycinate
CAS 72185-97-8C24H32N4O6
L-Tryptophyl-L-proline chemical structure, C16H19N3O3, CAS 38136-75-3
L-Tryptophyl-L-proline
CAS 38136-75-3C16H19N3O3
(2S)-2-Amino-3-(1H-indol-3-yl)-1-pyrrolidin-1-ylpropan-1-one chemical structure, C15H19N3O, CAS 327983-79-9
(2S)-2-Amino-3-(1H-indol-3-yl)-1-pyrrolidin-1-ylpropan-1-one
CAS 327983-79-9C15H19N3O
(2S)-2-Amino-3-(1H-indol-3-yl)-1-(pyrrolidin-1-yl)propan-1-one hydrochloride chemical structure, C15H20ClN3O, CAS 200865-36-7
(2S)-2-Amino-3-(1H-indol-3-yl)-1-(pyrrolidin-1-yl)propan-1-one hydrochloride
CAS 200865-36-7C15H20ClN3O
Ansrwptsii chemical structure, C51H81N15O15, CAS 1223558-36-8
Ansrwptsii
CAS 1223558-36-8C51H81N15O15
L-Tryptophyl-L-prolyl-N~5~-(diaminomethylidene)-L-ornithyl-L-threonine chemical structure, C26H38N8O6, CAS 798540-92-8
L-Tryptophyl-L-prolyl-N~5~-(diaminomethylidene)-L-ornithyl-L-threonine
CAS 798540-92-8C26H38N8O6
D-Tryptophyl-D-proline chemical structure, C16H19N3O3, CAS 821776-24-3
D-Tryptophyl-D-proline
CAS 821776-24-3C16H19N3O3
Boc-Trp(Boc)-Pro-OH chemical structure, C26H35N3O7, CAS 1432793-75-3
Boc-Trp(Boc)-Pro-OH
CAS 1432793-75-3C26H35N3O7
Kahalalide V chemical structure, C31H47N7O6, CAS 1025752-42-4
Kahalalide V
CAS 1025752-42-4C31H47N7O6
2-Ethyl-N-[(1S)-1-(1H-indol-3-ylmethyl)-2-oxo-2-(1-pyrrolidinyl)ethyl]butanamide chemical structure, C21H29N3O2, CAS 1217679-90-7
2-Ethyl-N-[(1S)-1-(1H-indol-3-ylmethyl)-2-oxo-2-(1-pyrrolidinyl)ethyl]butanamide
CAS 1217679-90-7C21H29N3O2
Human growth hormone-releasing peptide 3 chemical structure, C32H50N10O5, CAS 259230-56-3
Human growth hormone-releasing peptide 3
CAS 259230-56-3C32H50N10O5
Methyl ((S)-2-amino-4-(tert-butoxy)-4-oxobutanoyl)-L-tryptophyl-L-prolinate chemical structure, C25H34N4O6, CAS 1416568-03-0
Methyl ((S)-2-amino-4-(tert-butoxy)-4-oxobutanoyl)-L-tryptophyl-L-prolinate
CAS 1416568-03-0C25H34N4O6
Methyl ((S)-2-(2-((S)-2-(3-((acetamidomethyl)thio)propanamido)-6-guanidinohexanamido)acetamido)-4-(tert-butoxy)-4-oxobutanoyl)-L-tryptophyl-L-prolinate chemical structure, C40H60N10O10S, CAS 1416568-06-3
Methyl ((S)-2-(2-((S)-2-(3-((acetamidomethyl)thio)propanamido)-6-guanidinohexanamido)acetamido)-4-(tert-butoxy)-4-oxobutanoyl)-L-tryptophyl-L-prolinate
CAS 1416568-06-3C40H60N10O10S
Methyl L-tryptophyl-L-prolinate chemical structure, C17H21N3O3, CAS 107312-97-0
Methyl L-tryptophyl-L-prolinate
CAS 107312-97-0C17H21N3O3
((S)-2-Amino-4-(tert-butoxy)-4-oxobutanoyl)-L-tryptophyl-L-proline chemical structure, C24H32N4O6, CAS 868242-18-6
((S)-2-Amino-4-(tert-butoxy)-4-oxobutanoyl)-L-tryptophyl-L-proline
CAS 868242-18-6C24H32N4O6
L-Cysteinamide, N2-(3-mercapto-1-oxopropyl)-L-arginylglycyl-L-alpha-aspartyl-L-tryptophyl-L-prolyl- chemical structure, C34H49N11O9S2, CAS 1000270-53-0
L-Cysteinamide, N2-(3-mercapto-1-oxopropyl)-L-arginylglycyl-L-alpha-aspartyl-L-tryptophyl-L-prolyl-
CAS 1000270-53-0C34H49N11O9S2