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Murcko scaffold

Ring system with 3 rings and 24 atoms

23 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
24
Chemicals
23
With full pages
2
Scaffold SMILES

O=C(NCc1ccccc1)N(Cc1ccccc1)C1CCNCC1

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(NCc1ccccc1)N(Cc1ccccc1)C1CCNCC1

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 23 of 23 chemicals

Pimavanserin chemical structure, C25H34FN3O2, CAS 706779-91-1
Pimavanserin
CAS 706779-91-1C25H34FN3O2
Pimavanserin tartrate chemical structure, C54H74F2N6O10, CAS 706782-28-7
Pimavanserin tartrate
CAS 706782-28-7C54H74F2N6O10
N-Desmethyl pimavanserin chemical structure, C24H32FN3O2, CAS 639863-77-7
N-Desmethyl pimavanserin
CAS 639863-77-7C24H32FN3O2
DE(isobutyl)pimavanserin chemical structure, C21H26FN3O2, CAS 1134815-53-4
DE(isobutyl)pimavanserin
CAS 1134815-53-4C21H26FN3O2
N-(4-Fluorobenzyl)-N-(1-methylpiperidin-4-yl)-N'-[4-(2-hydroxy)isobutoxybenzyl]carbamide chemical structure, C25H34FN3O3, CAS 1134815-69-2
N-(4-Fluorobenzyl)-N-(1-methylpiperidin-4-yl)-N'-[4-(2-hydroxy)isobutoxybenzyl]carbamide
CAS 1134815-69-2C25H34FN3O3
omega-Hydroxy-pimavanserin chemical structure, C25H34FN3O3, CAS 1134815-73-8
omega-Hydroxy-pimavanserin
CAS 1134815-73-8C25H34FN3O3
Ortho-hydroxy-pimavanserin chemical structure, C25H34FN3O3, CAS 1246458-11-6
Ortho-hydroxy-pimavanserin
CAS 1246458-11-6C25H34FN3O3
exo-Dehydro-pimavanserin chemical structure, C25H32FN3O2, CAS 1246458-13-8
exo-Dehydro-pimavanserin
CAS 1246458-13-8C25H32FN3O2
exo-Dehydro N-demethylpimavanserin chemical structure, C24H30FN3O2, CAS 2211053-24-4
exo-Dehydro N-demethylpimavanserin
CAS 2211053-24-4C24H30FN3O2
o-De(isobutyl)-O-methyl pimavanserin chemical structure, C22H28FN3O2, CAS 1134815-56-7
o-De(isobutyl)-O-methyl pimavanserin
CAS 1134815-56-7C22H28FN3O2
Pimavanserin metabolite (ac-271628) chemical structure, C24H32FN3O3, CAS 1246458-26-3
Pimavanserin metabolite (ac-271628)
CAS 1246458-26-3C24H32FN3O3
Pimavanserin metabolite (ac-2713360) chemical structure, C21H26FN3O3, CAS 1246458-23-0
Pimavanserin metabolite (ac-2713360)
CAS 1246458-23-0C21H26FN3O3
Pimavanserin metabolite M43 chemical structure, C20H24FN3O2, CAS 1246458-22-9
Pimavanserin metabolite M43
CAS 1246458-22-9C20H24FN3O2
Xqq9vuc27W chemical structure, C21H26FN3O3, CAS 1246494-36-9
Xqq9vuc27W
CAS 1246494-36-9C21H26FN3O3
N-(4-Fluorobenzyl)-N-(1-methylpiperidin-4-yl)-N'-(4-hydroxybenzyl)carbamide hydrochloride, 95% chemical structure, C21H27ClFN3O2, CAS 1134815-50-1
N-(4-Fluorobenzyl)-N-(1-methylpiperidin-4-yl)-N'-(4-hydroxybenzyl)carbamide hydrochloride, 95%
CAS 1134815-50-1C21H27ClFN3O2
Pimavanserin metabolite M15 chemical structure, C25H32FN3O4, CAS 1246458-15-0
Pimavanserin metabolite M15
CAS 1246458-15-0C25H32FN3O4
Pimavanserin metabolite (ac-271366) chemical structure, C24H30FN3O4, CAS 1246458-17-2
Pimavanserin metabolite (ac-271366)
CAS 1246458-17-2C24H30FN3O4
MJ98FY4Evc chemical structure, C21H26FN3O3, CAS 1246458-21-8
MJ98FY4Evc
CAS 1246458-21-8C21H26FN3O3
Pimavanserin N-oxide chemical structure, C25H34FN3O3, CAS 1134815-71-6
Pimavanserin N-oxide
CAS 1134815-71-6C25H34FN3O3
Pimavanserin impurity 29 chemical structure, C25H34FN3O2, CAS 2703574-90-5
Pimavanserin impurity 29
CAS 2703574-90-5C25H34FN3O2
3-[(4-Butoxyphenyl)methyl]-1-[(4-fluorophenyl)methyl]-1-(1-methylpiperidin-4-yl)urea chemical structure, C25H34FN3O2, CAS 2377646-59-6
3-[(4-Butoxyphenyl)methyl]-1-[(4-fluorophenyl)methyl]-1-(1-methylpiperidin-4-yl)urea
CAS 2377646-59-6C25H34FN3O2
3-(4-(sec-Butoxy)benzyl)-1-(4-fluorobenzyl)-1-(1-methylpiperidin-4-yl)urea chemical structure, C25H34FN3O2, CAS 2377646-60-9
3-(4-(sec-Butoxy)benzyl)-1-(4-fluorobenzyl)-1-(1-methylpiperidin-4-yl)urea
CAS 2377646-60-9C25H34FN3O2
1-Benzyl-3-[(4-isobutoxyphenyl)methyl]-1-(1-methyl-4-piperidyl)urea chemical structure, C25H35N3O2, CAS 2512201-55-5
1-Benzyl-3-[(4-isobutoxyphenyl)methyl]-1-(1-methyl-4-piperidyl)urea
CAS 2512201-55-5C25H35N3O2