Murcko scaffold
Ring system with 3 rings and 16 atoms
13 chemicals on CompoundList share this ring system.
- Rings
- 3
- Scaffold atoms
- 16
- Chemicals
- 13
- With full pages
- 4
Scaffold SMILES
c1cc(NC2CC2)cc(N2CCNCC2)c1
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 13 of 13 chemicals
N-Cyclopropyl-5-(4-methylpiperazin-1-yl)-2-nitroaniline
CAS 347354-41-0C14H20N4O2
N-Cyclopropyl-2-nitro-5-piperazin-1-ylaniline
CAS 347353-82-6C13H18N4O2
1-[4-[3-(Cyclopropylamino)-4-nitrophenyl]piperazin-1-yl]ethanone
CAS 347354-24-9C15H20N4O3
N-Cyclopropyl-5-(4-methylsulfonylpiperazin-1-yl)-2-nitroaniline
CAS 347354-59-0C14H20N4O4S
N-Cyclopropyl-5-(4-ethylsulfonylpiperazin-1-yl)-2-nitroaniline
CAS 430454-43-6C15H22N4O4S
1-{4-[3-(Cyclopropylamino)-4-nitrophenyl]piperazin-1-yl}propan-1-one
CAS 433249-37-7C16H22N4O3
1-[4-[3-(Cyclopropylamino)-4-nitrophenyl]piperazin-1-yl]-2,2-dimethylpropan-1-one
CAS 433329-09-0C18H26N4O3
1-{4-[3-(Cyclopropylamino)-4-nitrophenyl]piperazin-1-yl}-2-methylpropan-1-one
CAS 444111-19-7C17H24N4O3
4-[3-(Cyclopropylamino)-4-nitrophenyl]-N,N-dimethylpiperazine-1-sulfonamide
CAS 509113-86-4C15H23N5O4S
N-Cyclopropyl-4-fluoro-2-nitro-5-(piperazin-1-yl)aniline
CAS 135861-05-1C13H17FN4O2
N-Cyclopropyl-4-fluoro-5-(4-methylpiperazin-1-yl)-2-nitroaniline
CAS 139495-69-5C14H19FN4O2
2-(Cyclopropylamino)-5-fluoro-4-(2-hydroxypiperazin-1-yl)benzoic acid
CAS 918800-07-4C14H18FN3O3
2-(Cyclopropylamino)-4-(4-ethylpiperazin-1-yl)-5-fluorobenzaldehyde
CAS 918659-45-7C16H22FN3O