Murcko scaffold
5-Deazaflavin scaffold
47 chemicals on CompoundList share this ring system.
- Rings
- 3
- Scaffold atoms
- 16
- Chemicals
- 47
- With full pages
- 8
Scaffold SMILES
O=c1nc2[nH]c3ccccc3cc-2c(=O)[nH]1
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 O=c1nc2[nH]c3ccccc3cc-2c(=O)[nH]1](/scaffold/KWHWFTSHDPJOTG-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 47 of 47 chemicals
5-Deaza-fmn
CAS 36408-16-9C18H22N3O9P
3,10-Dimethyl-5-deazaisoalloxazine
CAS 38559-35-2C13H11N3O2
Benzo(g)pyrido(2,3d)pyrimidin-2,4-dione,3,7,8,10-tetramethyl-
CAS 70239-57-5C15H15N3O2
Purimido(4,5-b)quinoline-2,4(3H,10H)-dione, 10-ethyl-8-methoxy-
CAS 80547-91-7C14H13N3O3
5-Deazariboflavin
CAS 19342-73-5C18H21N3O6
7-Hydroxy-10-methyl-5-deazaisoalloxazine
CAS 73077-67-5C12H9N3O3
![10-Methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione chemical structure, C12H9N3O2, CAS 27132-53-2](/s/VPPVXLHZEZARQZ-UHFFFAOYSA-N.svg)
10-Methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
CAS 27132-53-2C12H9N3O2
![10-(2-Hydroxyethyl)pyrimido[4,5-b]quinoline-2,4(3H,10H)-dione chemical structure, C13H11N3O3, CAS 27132-56-5](/s/HJQPCTOFNISCCQ-UHFFFAOYSA-N.svg)
10-(2-Hydroxyethyl)pyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
CAS 27132-56-5C13H11N3O3
![10-Ethyl-3,7-dimethylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione chemical structure, C15H15N3O2, CAS 61696-27-3](/s/JLUJBLQLSPPMGR-UHFFFAOYSA-N.svg)
10-Ethyl-3,7-dimethylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
CAS 61696-27-3C15H15N3O2
![10-Ethyl-3-methylpyrimido[4,5-b]quinoline-2,4-dione chemical structure, C14H13N3O2, CAS 59997-14-7](/s/XPADYKHELBQXCD-UHFFFAOYSA-N.svg)
10-Ethyl-3-methylpyrimido[4,5-b]quinoline-2,4-dione
CAS 59997-14-7C14H13N3O2
![3-Methyl-10-propylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione chemical structure, C15H15N3O2, CAS 59997-15-8](/s/XXMXQNOVPUMNTE-UHFFFAOYSA-N.svg)
3-Methyl-10-propylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
CAS 59997-15-8C15H15N3O2
![10-Butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione chemical structure, C16H17N3O2, CAS 59997-16-9](/s/WZHOKCUFDKOZGY-UHFFFAOYSA-N.svg)
10-Butyl-3-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
CAS 59997-16-9C16H17N3O2
![10-Ethylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione chemical structure, C13H11N3O2, CAS 59997-17-0](/s/NUGYOMQUKLUCHW-UHFFFAOYSA-N.svg)
10-Ethylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
CAS 59997-17-0C13H11N3O2
![10-Propylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione chemical structure, C14H13N3O2, CAS 59997-18-1](/s/BWYGYIPYACXJED-UHFFFAOYSA-N.svg)
10-Propylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
CAS 59997-18-1C14H13N3O2
![10-Butylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione chemical structure, C15H15N3O2, CAS 59997-19-2](/s/RBQQKCAJWKVRDN-UHFFFAOYSA-N.svg)
10-Butylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione
CAS 59997-19-2C15H15N3O2
![3,7,8-Trimethyl-10-(2,3,4,5-tetrahydroxypentyl)pyrimido[4,5-b]quinoline-2,4-dione chemical structure, C19H23N3O6, CAS 59997-21-6](/s/CXISDLYLQBQSEI-UHFFFAOYSA-N.svg)
3,7,8-Trimethyl-10-(2,3,4,5-tetrahydroxypentyl)pyrimido[4,5-b]quinoline-2,4-dione
CAS 59997-21-6C19H23N3O6
![7-Fluoro-1,3-dimethylpyrimido[4,5-b]quinoline-2,4-dione chemical structure, C13H10FN3O2, CAS 181648-79-3](/s/FCRGWZNNBKIHKT-UHFFFAOYSA-N.svg)
7-Fluoro-1,3-dimethylpyrimido[4,5-b]quinoline-2,4-dione
CAS 181648-79-3C13H10FN3O2
![7-Methoxy-1,3-dimethylpyrimido[4,5-b]quinoline-2,4-dione chemical structure, C14H13N3O3, CAS 64664-00-2](/s/SWZPGQRUTSKGBI-UHFFFAOYSA-N.svg)
7-Methoxy-1,3-dimethylpyrimido[4,5-b]quinoline-2,4-dione
CAS 64664-00-2C14H13N3O3
![1,3-Dimethyl-1,2,3,4-tetrahydropyrimido[4,5-b]quinoline-2,4-dione chemical structure, C13H11N3O2, CAS 39260-04-3](/s/VTCRFEUVBWRSMI-UHFFFAOYSA-N.svg)
1,3-Dimethyl-1,2,3,4-tetrahydropyrimido[4,5-b]quinoline-2,4-dione
CAS 39260-04-3C13H11N3O2
![1,3,7-Trimethylpyrimido[4,5-b]quinoline-2,4-dione chemical structure, C14H13N3O2, CAS 77603-15-7](/s/VEAHLOKWQPAIHN-UHFFFAOYSA-N.svg)
1,3,7-Trimethylpyrimido[4,5-b]quinoline-2,4-dione
CAS 77603-15-7C14H13N3O2
![1,3,8-Trimethylpyrimido[4,5-b]quinoline-2,4-dione chemical structure, C14H13N3O2, CAS 73029-28-4](/s/SSVJNZOAOCJXRV-UHFFFAOYSA-N.svg)
1,3,8-Trimethylpyrimido[4,5-b]quinoline-2,4-dione
CAS 73029-28-4C14H13N3O2
![8-Chloro-1,3-dimethyl-1,2,3,4-tetrahydropyrimido[4,5-b]quinoline-2,4-dione chemical structure, C13H10ClN3O2, CAS 73029-30-8](/s/CCTLAZHHHXZZNB-UHFFFAOYSA-N.svg)
8-Chloro-1,3-dimethyl-1,2,3,4-tetrahydropyrimido[4,5-b]quinoline-2,4-dione
CAS 73029-30-8C13H10ClN3O2
![8-Methoxy-1,3-dimethylpyrimido[4,5-b]quinoline-2,4-dione chemical structure, C14H13N3O3, CAS 73029-29-5](/s/WUGKYUYANCHPLR-UHFFFAOYSA-N.svg)
8-Methoxy-1,3-dimethylpyrimido[4,5-b]quinoline-2,4-dione
CAS 73029-29-5C14H13N3O3
![1,3,7,8-Tetramethylpyrimido[4,5-b]quinoline-2,4-dione chemical structure, C15H15N3O2, CAS 83983-46-4](/s/YFXOUTYVPCSYTR-UHFFFAOYSA-N.svg)
1,3,7,8-Tetramethylpyrimido[4,5-b]quinoline-2,4-dione
CAS 83983-46-4C15H15N3O2
- 7-Ethyl-1,3-dimethylpyrimido[4,5-b]quinoline-2,4-dione181648-78-2C15H15N3O2
- 7,8-Dimethyl-1H-pyrimido[4,5-b]quinoline-2,4-dione27132-52-1C13H11N3O2
- 6 suppliers5-Deazaflavin26908-38-3C11H7N3O2
- 7-Methyl-2,4-dioxo-1H-pyrimido[4,5-b]quinoline-5-carboxylic acid26908-29-2C13H9N3O4
- 2,4-Dioxo-1,2,3,4-tetrahydropyrimido[4,5-b]quinoline-5-carboxylic acid500300-26-5C12H7N3O4
- 7-Methyl-2,4-dioxo-1H-pyrimido[4,5-b]quinoline-5-carboxamide26908-31-6C13H10N4O3
- 5-Amino-7-methyl-1H-pyrimido[4,5-b]quinoline-2,4-dione26908-33-8C12H10N4O2
- 7-Bromo-2,4-dioxo-1H-pyrimido[4,5-b]quinoline-5-carboxylic acid26908-30-5C12H6BrN3O4
- 7-Bromo-2,4-dioxo-1H-pyrimido[4,5-b]quinoline-5-carboxamide26908-32-7C12H7BrN4O3
- 5-Deazalumiflavin61696-29-5C14H13N3O2
- 10-Dodecyl-6-nitro-2H,3H,4H,10H-pyrimido[4,5-b]quinoline-2,4-dione171819-92-4C23H30N4O4
- 5-Chloro-3,10-dimethylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione80885-82-1C13H10ClN3O2
- Pyrimido[4,5-b]quinoline-2,4(1H,3H)-dione, 1,3-diethyl-144535-28-4C15H15N3O2
- 3-Methyl-10-octylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione81528-05-4C20H25N3O2
- 8-Fluoro-3,10-dimethylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione78752-76-8C13H10FN3O2
- 10-Butyl-7-nitropyrimido[4,5-b]quinoline-2,4(3H,10H)-dione84459-34-7C15H14N4O4
- 7-Bromopyrimido[4,5-b]quinoline-2,4(1H,3H)-dione26908-39-4C11H6BrN3O2
- 10-Ethyl-7-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione61696-28-4C14H13N3O2
- 5-Chloro-10-methylpyrimido[4,5-b]quinoline-2,4(3H,10H)-dione137347-70-7C12H8ClN3O2
- 10-Methyl-2,4-dioxo-2,3,4,10-tetrahydropyrimido[4,5-b]quinolin-7-yl acetate105688-15-1C14H11N3O4
- 9-Hydroxy-7,8-dimethylpyrimido[4,5-b]quinoline-2,4(1H,3H)-dione112899-87-3C13H11N3O3
- 5-(3-(Dimethylamino)propylamino)-3,10-dimethylpyrimido4,5-b]quinoline-2,4(3H,10H)-dione hydrochloride960045-51-6C17H22ClN5O2
- [(2S,3S,4S)-2,3,4-Triacetyloxy-5-(7,8-dimethyl-2,4-dioxopyrimido[4,5-b]quinolin-10-yl)pentyl] acetate59389-72-9C26H29N3O10
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