Murcko scaffold
Ring system with 3 rings and 21 atoms
22 chemicals on CompoundList share this ring system.
- Rings
- 3
- Scaffold atoms
- 21
- Chemicals
- 22
- With full pages
- 10
Scaffold SMILES
O=C(CC1CCCCN1)Cn1cnc2ccccc2c1=O
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 22 of 22 chemicals
![7-Bromo-6-chloro-3-[3-(3-hydroxy-2-piperidyl)-2-oxopropyl]quinazolin-4(3H)-one monohydrobromide chemical structure, C16H18Br2ClN3O3, CAS 17395-31-2](/s/SJUWEPZBTXEUMU-UHFFFAOYSA-N.svg)
7-Bromo-6-chloro-3-[3-(3-hydroxy-2-piperidyl)-2-oxopropyl]quinazolin-4(3H)-one monohydrobromide
CAS 17395-31-2C16H18Br2ClN3O3
![7-Bromo-6-chloro-3-[3-(3-hydroxypiperidin-2-yl)-2-oxopropyl]-3,4-dihydroquinazolin-4-one chemical structure, C16H17BrClN3O3, CAS 64544-01-0](/s/LVASCWIMLIKXLA-UHFFFAOYSA-N.svg)
7-Bromo-6-chloro-3-[3-(3-hydroxypiperidin-2-yl)-2-oxopropyl]-3,4-dihydroquinazolin-4-one
CAS 64544-01-0C16H17BrClN3O3
4(3H)-Quinazolinone, 6-bromo-7-chloro-3-(3-(3-hydroxy-2-piperidinyl)-2-oxopropyl)-, hydrobromide (1:1)
CAS 17518-97-7C16H18Br2ClN3O3
Febrifugine
C16H19N3O3
gamma-Dichroine
CAS 64045-99-4C16H19N3O3
Halofuginone hydrobromide, (-)-
CAS 57426-42-3C16H18Br2ClN3O3
Halofuginone, (-)-
CAS 7695-84-3C16H17BrClN3O3
Halofuginone
CAS 55837-20-2C16H17BrClN3O3
![3-{3-[(2R,3S)-3-Hydroxypiperidin-2-yl]-2-oxopropyl}quinazolin-4(3H)-one chemical structure, C16H19N3O3, CAS 24159-07-7](/s/FWVHWDSCPKXMDB-CABCVRRESA-N.svg)
3-{3-[(2R,3S)-3-Hydroxypiperidin-2-yl]-2-oxopropyl}quinazolin-4(3H)-one
CAS 24159-07-7C16H19N3O3
(+)-Isofebrifugine
C16H19N3O3
Halofuginone hydrobromide
CAS 64924-67-0C16H18Br2ClN3O3
![7-Bromo-6-chloro-3-[3-(1-allyloxycarbonyl-3-methoxy-2-piperidyl)-acetonyl]-4(3H)-quinazolinone chemical structure, C21H23BrClN3O5, CAS 17518-99-9](/s/CDJLPZVTBZLIEA-UHFFFAOYSA-N.svg)
7-Bromo-6-chloro-3-[3-(1-allyloxycarbonyl-3-methoxy-2-piperidyl)-acetonyl]-4(3H)-quinazolinone
CAS 17518-99-9C21H23BrClN3O5
Febrifugine dihydrochloride
CAS 32434-42-7C16H21Cl2N3O3
Halofuginone lactate
CAS 82186-71-8C19H23BrClN3O6
Halofuginone hydrochloride
CAS 1217623-74-9C16H18BrCl2N3O3
(S)-7-Bromo-6-chloro-3-(2-oxo-3-(piperidin-2-yl)propyl)quinazolin-4(3H)-one
CAS 1819989-15-5C16H17BrClN3O2
Antibacterial agent 124
CAS 2304448-00-6C16H17ClFN3O2
![6-Chloro-3-[3-(3-hydroxy-2-piperidinyl)-2-oxopropyl]-4(3H)-quinazolinone chemical structure, C16H18ClN3O3, CAS 17518-78-4](/s/MVIKGDORSXGOLM-UHFFFAOYSA-N.svg)
6-Chloro-3-[3-(3-hydroxy-2-piperidinyl)-2-oxopropyl]-4(3H)-quinazolinone
CAS 17518-78-4C16H18ClN3O3
(-)-Deoxyhalofebrifugine dihydrobromide
CAS 1819989-18-8C16H19Br3ClN3O2
(+)-Deoxyhalofebrifugine dihydrobromide
CAS 1819989-16-6C16H19Br3ClN3O2
(-)-Deoxyfebrifugine dihydrobromide
CAS 1820023-30-0C16H21Br2N3O2
(+)-Deoxyfebrifugine dihydrobromide
CAS 1820023-27-5C16H21Br2N3O2
Related scaffolds
Same ring framework with different atoms or bond orders
O=C(CC1Nc2ccccc2NC1=O)Nc1ccccc153 chemicals
O=C(CC1Sc2ccccc2NC1=O)Nc1ccccc153 chemicals
O=C(Cn1cnc2ccccc2c1=O)Nc1ccccc149 chemicals![Scaffold O=C(NCc1ccccc1)c1cc2ccccc2[nH]c1=O](/scaffold/NFZNYXLYBOKFMQ-UHFFFAOYSA-N/structure.svg)
O=C(NCc1ccccc1)c1cc2ccccc2[nH]c1=O28 chemicals
O=C(COc1ccc2ccc(=O)oc2c1)c1ccccc119 chemicals
O=C(CN1CCc2ccccc2C1)Nc1ccccc117 chemicals
O=C(COc1ccccc1)N1CCc2ccccc2C116 chemicals
O=C(NCc1ccccc1)c1cc2ccccc2oc1=O15 chemicals
O=C(Cn1ccc2ccccc2c1=O)Nc1ccccc112 chemicals
O=C(Cn1ncc2ccccc2c1=O)Nc1ccccc111 chemicals
O=C(Cn1nc2c(cc1=O)CCCC2)Nc1ccccc111 chemicals
O=C(OCn1nnc2ccccc2c1=O)c1ccccc111 chemicals