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
- 1
Scaffold SMILES
O=C(C1CCCN(Cc2ccccc2)C1)N1CCCCCC1
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.
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
![Azepan-1-yl-[1-[(3-methylphenyl)methyl]piperidin-3-yl]methanone chemical structure, C20H30N2O, CAS 524059-64-1](/s/XMXDCKONGLCRHL-UHFFFAOYSA-N.svg)
Azepan-1-yl-[1-[(3-methylphenyl)methyl]piperidin-3-yl]methanone
CAS 524059-64-1C20H30N2O
![Azepan-1-yl-[1-[(2,3-dimethoxyphenyl)methyl]piperidin-3-yl]methanone chemical structure, C21H32N2O3, CAS 524058-89-7](/s/WYIHWULPTDPCBO-UHFFFAOYSA-N.svg)
Azepan-1-yl-[1-[(2,3-dimethoxyphenyl)methyl]piperidin-3-yl]methanone
CAS 524058-89-7C21H32N2O3
![1-{[1-(2-Methylbenzyl)-3-piperidinyl]carbonyl}azepane chemical structure, C20H30N2O, CAS 524059-59-4](/s/XSZADWPKCACZTJ-UHFFFAOYSA-N.svg)
1-{[1-(2-Methylbenzyl)-3-piperidinyl]carbonyl}azepane
CAS 524059-59-4C20H30N2O
![Azepan-1-yl-[1-[(2-bromophenyl)methyl]piperidin-3-yl]methanone chemical structure, C19H27BrN2O, CAS 524059-87-8](/s/YYMVVDYXESRLFA-UHFFFAOYSA-N.svg)
Azepan-1-yl-[1-[(2-bromophenyl)methyl]piperidin-3-yl]methanone
CAS 524059-87-8C19H27BrN2O
![Azepan-1-yl-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]methanone chemical structure, C19H27FN2O, CAS 524059-91-4](/s/LWRYYZKCURYTQK-UHFFFAOYSA-N.svg)
Azepan-1-yl-[1-[(3-fluorophenyl)methyl]piperidin-3-yl]methanone
CAS 524059-91-4C19H27FN2O
![Azepan-1-yl-[1-[(4-methylsulfanylphenyl)methyl]piperidin-3-yl]methanone chemical structure, C20H30N2OS, CAS 524059-31-2](/s/UJMGAFPUWWQSRS-UHFFFAOYSA-N.svg)
Azepan-1-yl-[1-[(4-methylsulfanylphenyl)methyl]piperidin-3-yl]methanone
CAS 524059-31-2C20H30N2OS
![Azepan-1-yl-[1-[(3-chlorophenyl)methyl]piperidin-3-yl]methanone chemical structure, C19H27ClN2O, CAS 524058-76-2](/s/BKCYIAHMYRQOMY-UHFFFAOYSA-N.svg)
Azepan-1-yl-[1-[(3-chlorophenyl)methyl]piperidin-3-yl]methanone
CAS 524058-76-2C19H27ClN2O
![Azepan-1-yl-[1-[(5-bromo-2-methoxyphenyl)methyl]piperidin-3-yl]methanone chemical structure, C20H29BrN2O2, CAS 524058-62-6](/s/IXIFGHGIRITVND-UHFFFAOYSA-N.svg)
Azepan-1-yl-[1-[(5-bromo-2-methoxyphenyl)methyl]piperidin-3-yl]methanone
CAS 524058-62-6C20H29BrN2O2
![Azepan-1-yl-[1-[(2,3,4-trimethoxyphenyl)methyl]piperidin-3-yl]methanone chemical structure, C22H34N2O4, CAS 524059-75-4](/s/ICLJWEUKNWPSAO-UHFFFAOYSA-N.svg)
Azepan-1-yl-[1-[(2,3,4-trimethoxyphenyl)methyl]piperidin-3-yl]methanone
CAS 524059-75-4C22H34N2O4
![Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone chemical structure, C20H30N2O2, CAS 4883-75-4](/s/BXUMZSCTKAQEKH-UHFFFAOYSA-N.svg)
Azepan-1-yl[1-(4-methoxybenzyl)piperidin-3-yl]methanone
CAS 4883-75-4C20H30N2O2
Related scaffolds
Same ring framework with different atoms or bond orders
c1ccc(Nc2ncnc(CN3CCCCCC3)n2)cc16 chemicals
O=C(C1CCCN(S(=O)(=O)c2ccccc2)C1)N1CCCCCC13 chemicals
O=C(c1ccccc1)N1CCCC(C(=O)N2CCCCCC2)C13 chemicals
O=C(c1cccc(S(=O)(=O)N2CCOCC2)c1)N1CCCCCC12 chemicals
O=C(C1CCCN(Cc2cccnc2)C1)N1CCCCCC11 chemical
O=C(c1cccc(S(=O)(=O)N2CCCCCC2)c1)N1CCNCC11 chemical
O=C(C1CCCN(Cc2ccccn2)C1)N1CCCCCC11 chemical
O=C(c1cccc(S(=O)(=O)N2CCCCC2)c1)N1CCCCCC11 chemical