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Murcko scaffold

Ring system with 3 rings and 22 atoms

10 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
22
Chemicals
10
With full pages
3
Scaffold SMILES

c1ccc(CCC2CCCC(CCc3ccccc3)N2)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(CCC2CCCC(CCc3ccccc3)N2)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 10 of 10 chemicals

2,6-Bis(p-methoxyphenethyl)-1-methylpiperidine ethanesulfonate chemical structure, C26H39NO5S, CAS 6269-18-7
2,6-Bis(p-methoxyphenethyl)-1-methylpiperidine ethanesulfonate
CAS 6269-18-7C26H39NO5S
Lobelanidine chemical structure, C22H29NO2, CAS 552-72-7
Lobelanidine
CAS 552-72-7C22H29NO2
2,6-Piperidinediethanol, 1-methyl-alpha2,alpha6-diphenyl-, hydrochloride (1:1), (alpha2R,alpha6S,2R,6S)-rel- chemical structure, C22H30ClNO2, CAS 6112-86-3
2,6-Piperidinediethanol, 1-methyl-alpha2,alpha6-diphenyl-, hydrochloride (1:1), (alpha2R,alpha6S,2R,6S)-rel-
CAS 6112-86-3C22H30ClNO2
Lobelane chemical structure, C22H29N, CAS 530-51-8
Lobelane
CAS 530-51-8C22H29N
gz-793A chemical structure, C26H38ClNO4, CAS 1356447-90-9
gz-793A
CAS 1356447-90-9C26H38ClNO4
4,4'-[(1-Methylpiperidine-2,6-diyl)di(ethane-2,1-diyl)]diphenol--hydrogen chloride (1/1) chemical structure, C22H30ClNO2, CAS 6269-17-6
4,4'-[(1-Methylpiperidine-2,6-diyl)di(ethane-2,1-diyl)]diphenol--hydrogen chloride (1/1)
CAS 6269-17-6C22H30ClNO2
Lobelanidine hydrobromide chemical structure, C22H30BrNO2, CAS 6112-87-4
Lobelanidine hydrobromide
CAS 6112-87-4C22H30BrNO2
(1S,1'S)-2,2'-((2S,6R)-1-Methylpiperidine-2,6-diyl)bis(1-phenylethan-1-ol) chemical structure, C22H29NO2, CAS 1125824-42-1
(1S,1'S)-2,2'-((2S,6R)-1-Methylpiperidine-2,6-diyl)bis(1-phenylethan-1-ol)
CAS 1125824-42-1C22H29NO2
Lobelane hydrochloride chemical structure, C22H30ClN, CAS 246244-19-9
Lobelane hydrochloride
CAS 246244-19-9C22H30ClN
2,2'-((2S,6S)-1-Methylpiperidine-2,6-diyl)bis(1-phenylethan-1-ol) chemical structure, C22H29NO2, CAS 888711-30-6
2,2'-((2S,6S)-1-Methylpiperidine-2,6-diyl)bis(1-phenylethan-1-ol)
CAS 888711-30-6C22H29NO2