Murcko scaffold
Ring system with 4 rings and 25 atoms
28 chemicals on CompoundList share this ring system.
- Rings
- 4
- Scaffold atoms
- 25
- Chemicals
- 28
- With full pages
- 6
Scaffold SMILES
O=C1Cc2ccccc2CCN1CCCNCC1Cc2ccccc21
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 28 of 28 chemicals
Ivabradine
CAS 155974-00-8C27H36N2O5
Ivabradine hydrochloride
CAS 148849-67-6C27H37ClN2O5
(±)-Ivabradine
CAS 148870-59-1C27H36N2O5
N-Demethylivabradine
CAS 215935-23-2C26H34N2O5
Ivabradine, (-)-
CAS 167072-91-5C27H36N2O5
Ivabradine hydrobromide
CAS 1190604-70-6C27H37BrN2O5
Ivabradine monosulfate
CAS 1202000-62-1C27H38N2O9S
Ivabradine oxalate
CAS 1086026-42-7C29H38N2O9
Ivabradine-d3 hydrochloride
CAS 1217809-61-4C27H37ClN2O5
![3-[3-[[(7S)-3,4-Dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methyl-(trideuteriomethyl)amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one chemical structure, C27H36N2O5, CAS 1217977-70-2](/s/ACRHBAYQBXXRTO-ARURGNRRSA-N.svg)
3-[3-[[(7S)-3,4-Dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methyl-(trideuteriomethyl)amino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one
CAS 1217977-70-2C27H36N2O5
Ivabradine impurity 116
CAS 1246638-03-8C26H34N2O5
![(R)-3-(3-(((3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl)methyl)(methyl)amino)propyl)-7,8-dihydroxy-1,3,4,5-tetrahydro-2H-benzo[d]azepin-2-one chemical structure, C25H32N2O5, CAS 1276733-59-5](/s/HOIZRUAMICRTIB-IBGZPJMESA-N.svg)
(R)-3-(3-(((3,4-Dimethoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl)methyl)(methyl)amino)propyl)-7,8-dihydroxy-1,3,4,5-tetrahydro-2H-benzo[d]azepin-2-one
CAS 1276733-59-5C25H32N2O5
![3-[3-[[(7S)-3,4-Dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one, hydrochloride chemical structure, C26H35ClN2O5, CAS 1246638-08-3](/s/MIIIKWNQFDQJGS-VEIFNGETSA-N.svg)
3-[3-[[(7S)-3,4-Dimethoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl]methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one, hydrochloride
CAS 1246638-08-3C26H35ClN2O5
7-Demethyl ivabradine
CAS 304462-60-0C26H34N2O5
8-Demethyl ivabradine
CAS 304464-97-9C26H34N2O5
N-Desmethyl Ivabradine D6 HCl
CAS 1346600-74-5C26H35ClN2O5
Ivabradine adipate
CAS 1352616-49-9C33H44N2O9-2
N-Demethyl ivabradine D6 hydrochloride
CAS 2070009-60-6C26H35ClN2O5
Ivabradine D6 hydrochloride
CAS 2070009-63-9C27H37ClN2O5
Ivabradine USP Rc 4-Desmethyl Ivabradine
CAS 304465-03-0C26H34N2O5
![1,3,4,5-Tetrahydro-3-[3-[[[(7S)-3-hydroxy-4-methoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl]methyl]methylamino]propyl]-7,8-dimethoxy-2H-3-benzazepin-2-one chemical structure, C26H34N2O5, CAS 304464-98-0](/s/CKPWHHKAGYLHEU-HXUWFJFHSA-N.svg)
1,3,4,5-Tetrahydro-3-[3-[[[(7S)-3-hydroxy-4-methoxybicyclo[4.2.0]octa-1,3,5-trien-7-yl]methyl]methylamino]propyl]-7,8-dimethoxy-2H-3-benzazepin-2-one
CAS 304464-98-0C26H34N2O5
Ivabradine impurity 14
CAS 2253977-80-7C27H36N2O6
![3-[3-[(3-Hydroxy-4-methoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl)methyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one chemical structure, C26H34N2O5, CAS 2247881-26-9](/s/CKPWHHKAGYLHEU-UHFFFAOYSA-N.svg)
3-[3-[(3-Hydroxy-4-methoxy-7-bicyclo[4.2.0]octa-1,3,5-trienyl)methyl-methylamino]propyl]-7,8-dimethoxy-2,5-dihydro-1H-3-benzazepin-4-one
CAS 2247881-26-9C26H34N2O5
Ivabradine hydrochloride impurity G
CAS 2511244-96-3C27H36N2O6
- Ivabradine N-oxide2511244-97-4C27H36N2O6
- ent-Ivabradine Hydrochloride148849-68-7C27H37ClN2O5
- Ivabradine hemisulfate1422274-66-5C54H74N4O14S
- 3-(3-(((3,4-Dihydroxybicyclo[4.2.0]octa-1,3,5-trien-7-yl)methyl)(methyl)amino)propyl)-7,8-dimethoxy-1,3,4,5-tetrahydro-2H-benzo[d]azepin-2-one2247881-28-1C25H32N2O5