Murcko scaffold
Ring system with 10 rings and 38 atoms
5 chemicals on CompoundList share this ring system.
- Rings
- 10
- Scaffold atoms
- 38
- Chemicals
- 5
- With full pages
- 0
Scaffold SMILES
C=C1CNC2Cc3c([nH]c4ccccc34)C(c3cccc4c5c([nH]c34)C3CC4CCC3N(CC5)C4)CC1C2
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.
![Murcko scaffold C=C1CNC2Cc3c([nH]c4ccccc34)C(c3cccc4c5c([nH]c34)C3CC4CCC3N(CC5)C4)CC1C2](/scaffold/SLPCCNRIWBVQLR-UHFFFAOYSA-N/structure.svg)
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 5 of 5 chemicals
19-(2-Oxopropyl)conodurine
CAS 64192-91-2C46H56N4O6
Ibogamine-18-carboxylic acid, 14-((3alpha)-17-methoxy-17-oxovobasan-3-yl)-, methyl ester
CAS 80981-95-9C42H50N4O4
Conodurinine
CAS 603066-10-0C42H50N4O6
![Methyl (15R,17S,18S)-17-ethyl-5-[(1S,14R,15E,18R)-15-ethylidene-18-(hydroxymethyl)-18-methoxycarbonyl-17-methyl-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraen-12-yl]-6-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene-1-carboxylate chemical structure, C44H54N4O6, CAS 1262306-81-9](/s/TVVMCEMGQJRCKS-DXHUNEAPSA-N.svg)
Methyl (15R,17S,18S)-17-ethyl-5-[(1S,14R,15E,18R)-15-ethylidene-18-(hydroxymethyl)-18-methoxycarbonyl-17-methyl-10,17-diazatetracyclo[12.3.1.03,11.04,9]octadeca-3(11),4,6,8-tetraen-12-yl]-6-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene-1-carboxylate
CAS 1262306-81-9C44H54N4O6
Orb1990773
C44H54N4O6