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Murcko scaffold

Ring system with 4 rings and 23 atoms

8 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
23
Chemicals
8
With full pages
1
Scaffold SMILES

c1ccc(Nc2ncnn3ccc(CN4CCCCC4)c23)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(Nc2ncnn3ccc(CN4CCCCC4)c23)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 8 of 8 chemicals

Bms-690514 chemical structure, C19H24N6O2, CAS 859853-30-8
Bms-690514
CAS 859853-30-8C19H24N6O2
(3S,4S)-4-Amino-1-[[4-[(3-methoxyphenyl)amino]pyrrolo[2,1-f][1,2,4]triazin-5-yl]methyl]-3-piperidinol chemical structure, C19H24N6O2, CAS 859853-31-9
(3S,4S)-4-Amino-1-[[4-[(3-methoxyphenyl)amino]pyrrolo[2,1-f][1,2,4]triazin-5-yl]methyl]-3-piperidinol
CAS 859853-31-9C19H24N6O2
EVRI chemical structure, C19H24N6O2, CAS 859853-86-4
EVRI
CAS 859853-86-4C19H24N6O2
(3R,4S)-4-Amino-1-[[4-[(3-methoxyphenyl)amino]pyrrolo[2,1-f][1,2,4]triazin-5-yl]methyl]piperidin-3-ol chemical structure, C19H24N6O2, CAS 859854-53-8
(3R,4S)-4-Amino-1-[[4-[(3-methoxyphenyl)amino]pyrrolo[2,1-f][1,2,4]triazin-5-yl]methyl]piperidin-3-ol
CAS 859854-53-8C19H24N6O2
4-Amino-1-((4-(3-methoxyphenylamino)pyrrolo[1,2-f][1,2,4]triazin-5-yl)methyl)piperidin-3-ol chemical structure, C19H24N6O2, CAS 1415559-37-3
4-Amino-1-((4-(3-methoxyphenylamino)pyrrolo[1,2-f][1,2,4]triazin-5-yl)methyl)piperidin-3-ol
CAS 1415559-37-3C19H24N6O2
JT3P76Nua8 chemical structure, C19H24N6O3, CAS 859853-76-2
JT3P76Nua8
CAS 859853-76-2C19H24N6O3
1-[[4-(3-Methoxyanilino)pyrrolo[2,1-f][1,2,4]triazin-5-yl]methyl]-4-(propan-2-ylamino)piperidin-3-ol chemical structure, C22H30N6O2, CAS 2331211-98-2
1-[[4-(3-Methoxyanilino)pyrrolo[2,1-f][1,2,4]triazin-5-yl]methyl]-4-(propan-2-ylamino)piperidin-3-ol
CAS 2331211-98-2C22H30N6O2
N9XQ32Vyq7 chemical structure, C19H24N6O3, CAS 1248590-49-9
N9XQ32Vyq7
CAS 1248590-49-9C19H24N6O3