Murcko scaffold
Azocan-5-one scaffold
11 chemicals on CompoundList share this ring system.
- Rings
- 1
- Scaffold atoms
- 9
- Chemicals
- 11
- With full pages
- 3
Scaffold SMILES
O=C1CCCNCCC1
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 11 of 11 chemicals
Hexahydroazocine-5-one, 1-ethyl-
CAS 37727-90-5C9H17NO
1-Methylhexahydroazocin-5-one
CAS 71512-38-4C8H15NO
Methyl 5-oxoazocane-1-carboxylate
CAS 80662-81-3C9H15NO3
Azocan-5-one
CAS 1503645-43-9C7H13NO
tert-Butyl 5-oxoazocane-1-carboxylate
CAS 1309359-79-2C12H21NO3
1-tert-Butyl 4-ethyl 5-oxoazocane-1,4-dicarboxylate
CAS 1309359-82-7C15H25NO5
1-tert-Butyl 2-ethyl 5-oxoazocane-1,2-dicarboxylate
CAS 1421601-07-1C15H25NO5
tert-Butyl 4,4-difluoro-5-oxoazocane-1-carboxylate
CAS 2385587-28-8C12H19F2NO3
tert-Butyl 4-fluoro-5-oxoazocane-1-carboxylate
CAS 2551120-62-6C12H20FNO3
4-Fluoroazocan-5-one
CAS 2680882-89-5C7H12FNO
4,4-Difluoroazocan-5-one
CAS 2680706-70-9C7H11F2NO
Related scaffolds
Same ring framework with different atoms or bond orders
C1CCCCCCC150 chemicals
C1=CCCC=CCC133 chemicals
C1=CCCCCCC123 chemicals
C1CCCNCCC115 chemicals
O=C1CCCCCCC111 chemicals![Scaffold O1[SiH2]O[SiH2]O[SiH2]O[SiH2]1](/scaffold/DDJSWKLBKSLAAZ-UHFFFAOYSA-N/structure.svg)
O1[SiH2]O[SiH2]O[SiH2]O[SiH2]17 chemicals
O=C1CNCC(=O)OBO14 chemicals
C1CNCCCNC14 chemicals
C1=CC=CC=CC=C14 chemicals
C1#CCCCCCC14 chemicals![Scaffold O=[PH]1OCCCO[PH](=O)O1](/scaffold/AROSBUDNOYOWNL-UHFFFAOYSA-N/structure.svg)
O=[PH]1OCCCO[PH](=O)O12 chemicals
O=C1CCCCCCN12 chemicals