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Murcko scaffold

Ring system with 3 rings and 20 atoms

14 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
20
Chemicals
14
With full pages
3
Scaffold SMILES

c1ccc(OCC2CNCCC2c2ccccc2)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(OCC2CNCCC2c2ccccc2)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

FG 7080 chemical structure, C19H22FNO2, CAS 100332-17-0
FG 7080
CAS 100332-17-0C19H22FNO2
Nnc 09-0026 chemical structure, C25H35Cl2F3N2O, CAS 141360-03-4
Nnc 09-0026
CAS 141360-03-4C25H35Cl2F3N2O
Piperidine, 3-((4-methoxyphenoxy)methyl)-4-phenyl-, (3R,4S)- chemical structure, C19H23NO2, CAS 85441-57-2
Piperidine, 3-((4-methoxyphenoxy)methyl)-4-phenyl-, (3R,4S)-
CAS 85441-57-2C19H23NO2
Brl 36610 chemical structure, C19H22FNO3, CAS 112058-90-9
Brl 36610
CAS 112058-90-9C19H22FNO3
Piperidine, 3-((4-methoxyphenoxy)methyl)-1-methyl-4-phenyl-, hydrochloride (1:1), (3R,4S)- chemical structure, C20H26ClNO2, CAS 56222-04-9
Piperidine, 3-((4-methoxyphenoxy)methyl)-1-methyl-4-phenyl-, hydrochloride (1:1), (3R,4S)-
CAS 56222-04-9C20H26ClNO2
(+)-Femoxetine chemical structure, C20H25NO2, CAS 59859-58-4
(+)-Femoxetine
CAS 59859-58-4C20H25NO2
1-Methyl-3-(phenoxymethyl)-4-phenylpiperidine--hydrogen bromide (1/1) chemical structure, C19H24BrNO, CAS 54088-13-0
1-Methyl-3-(phenoxymethyl)-4-phenylpiperidine--hydrogen bromide (1/1)
CAS 54088-13-0C19H24BrNO
Piperidine, 3-((4-methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)-, hydrobromide, cis-(+-)- chemical structure, C21H25BrF3NO2, CAS 54088-40-3
Piperidine, 3-((4-methoxyphenoxy)methyl)-4-phenyl-1-(2,2,2-trifluoroethyl)-, hydrobromide, cis-(+-)-
CAS 54088-40-3C21H25BrF3NO2
(3S,4R)-3-[(4-Methoxyphenoxy)methyl]-1-methyl-4-phenylpiperidine chemical structure, C20H25NO2, CAS 57775-23-2
(3S,4R)-3-[(4-Methoxyphenoxy)methyl]-1-methyl-4-phenylpiperidine
CAS 57775-23-2C20H25NO2
Phenol, 5-((4-(4-fluorophenyl)-3-piperidinyl)methoxy)-2-methoxy-, (3S-trans)- chemical structure, C19H22FNO3, CAS 112058-89-6
Phenol, 5-((4-(4-fluorophenyl)-3-piperidinyl)methoxy)-2-methoxy-, (3S-trans)-
CAS 112058-89-6C19H22FNO3
1,2-Benzenediol, 4-(((3S,4R)-4-(4-fluorophenyl)-3-piperidinyl)methoxy)- chemical structure, C18H20FNO3, CAS 159126-30-4
1,2-Benzenediol, 4-(((3S,4R)-4-(4-fluorophenyl)-3-piperidinyl)methoxy)-
CAS 159126-30-4C18H20FNO3
Desmethylene Paroxetine (hydrochloride) chemical structure, C18H21ClFNO3, CAS 1394861-12-1
Desmethylene Paroxetine (hydrochloride)
CAS 1394861-12-1C18H21ClFNO3
(3S,4S)-3-[(4-Methoxyphenoxy)methyl]-1-methyl-4-phenylpiperidine chemical structure, C20H25NO2, CAS 89615-16-7
(3S,4S)-3-[(4-Methoxyphenoxy)methyl]-1-methyl-4-phenylpiperidine
CAS 89615-16-7C20H25NO2
(3S,4R)-3-(Phenoxymethyl)-4-phenylpiperidine chemical structure, C18H21NO, CAS 112058-91-0
(3S,4R)-3-(Phenoxymethyl)-4-phenylpiperidine
CAS 112058-91-0C18H21NO