CompoundList
Murcko scaffold

Ring system with 4 rings and 24 atoms

18 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
24
Chemicals
18
With full pages
3
Scaffold SMILES

O=c1[nH]c(-c2ccccc2)nc2cn(-c3ccccc3)c(=O)nc12

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=c1[nH]c(-c2ccccc2)nc2cn(-c3ccccc3)c(=O)nc12

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 18 of 18 chemicals

6-(4-Chlorophenyl)-4-imino-3-phenyl-1,3,4,7-tetrahydropyrimido[5,4-d]pyrimidine-2,8-dione chemical structure, C18H12ClN5O2, CAS 865658-75-9
6-(4-Chlorophenyl)-4-imino-3-phenyl-1,3,4,7-tetrahydropyrimido[5,4-d]pyrimidine-2,8-dione
CAS 865658-75-9C18H12ClN5O2
4-Imino-3,6-diphenyl-1,3,4,7-tetrahydropyrimido[5,4-d]pyrimidine-2,8-dione chemical structure, C18H13N5O2, CAS 66482-88-0
4-Imino-3,6-diphenyl-1,3,4,7-tetrahydropyrimido[5,4-d]pyrimidine-2,8-dione
CAS 66482-88-0C18H13N5O2
6-(4,5-Dimethoxy-2-nitrophenyl)-3-(4-chlorophenyl)-4-imino-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione chemical structure, C20H15ClN6O6, CAS 1274904-23-2
6-(4,5-Dimethoxy-2-nitrophenyl)-3-(4-chlorophenyl)-4-imino-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione
CAS 1274904-23-2C20H15ClN6O6
6-(2-Hydroxy-3-methoxyphenyl)-4-imino-3-(3-(trifluoromethyl)phenyl)-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione chemical structure, C20H14F3N5O4, CAS 1119391-74-0
6-(2-Hydroxy-3-methoxyphenyl)-4-imino-3-(3-(trifluoromethyl)phenyl)-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione
CAS 1119391-74-0C20H14F3N5O4
6-(2,4-Dichlorophenyl)-4-imino-3-phenyl-1,3,4,7-tetrahydropyrimido[5,4-d]pyrimidine-2,8-dione chemical structure, C18H11Cl2N5O2, CAS 866019-00-3
6-(2,4-Dichlorophenyl)-4-imino-3-phenyl-1,3,4,7-tetrahydropyrimido[5,4-d]pyrimidine-2,8-dione
CAS 866019-00-3C18H11Cl2N5O2
6-(4-(Dimethylamino)phenyl)-4-imino-3-(3-(trifluoromethyl)phenyl)-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione chemical structure, C21H17F3N6O2, CAS 1119391-72-8
6-(4-(Dimethylamino)phenyl)-4-imino-3-(3-(trifluoromethyl)phenyl)-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione
CAS 1119391-72-8C21H17F3N6O2
3-(4-Chlorophenyl)-4-imino-6-(2-nitrophenyl)-1,3,4,7-tetrahydropyrimido[5,4-d]pyrimidine-2,8-dione chemical structure, C18H11ClN6O4, CAS 1020252-00-9
3-(4-Chlorophenyl)-4-imino-6-(2-nitrophenyl)-1,3,4,7-tetrahydropyrimido[5,4-d]pyrimidine-2,8-dione
CAS 1020252-00-9C18H11ClN6O4
6-(2-Chloro-5-nitrophenyl)-3-(4-chlorophenyl)-4-imino-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione chemical structure, C18H10Cl2N6O4, CAS 1274903-28-4
6-(2-Chloro-5-nitrophenyl)-3-(4-chlorophenyl)-4-imino-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione
CAS 1274903-28-4C18H10Cl2N6O4
3-(4-Chlorophenyl)-4-imino-6-(4-methoxyphenyl)-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione chemical structure, C19H14ClN5O3, CAS 379707-94-5
3-(4-Chlorophenyl)-4-imino-6-(4-methoxyphenyl)-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione
CAS 379707-94-5C19H14ClN5O3
6-(2-Chlorophenyl)-4-imino-3-phenyl-1,3,4,7-tetrahydropyrimido[5,4-d]pyrimidine-2,8-dione chemical structure, C18H12ClN5O2, CAS 866019-01-4
6-(2-Chlorophenyl)-4-imino-3-phenyl-1,3,4,7-tetrahydropyrimido[5,4-d]pyrimidine-2,8-dione
CAS 866019-01-4C18H12ClN5O2
4-Imino-3-(3-(trifluoromethyl)phenyl)-6-(3,4,5-trimethoxyphenyl)-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione chemical structure, C22H18F3N5O5, CAS 1119391-73-9
4-Imino-3-(3-(trifluoromethyl)phenyl)-6-(3,4,5-trimethoxyphenyl)-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione
CAS 1119391-73-9C22H18F3N5O5
6-(4-Fluorophenyl)-4-imino-3-phenyl-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione chemical structure, C18H12FN5O2, CAS 1119391-90-0
6-(4-Fluorophenyl)-4-imino-3-phenyl-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione
CAS 1119391-90-0C18H12FN5O2
6-(3,4-Dimethoxyphenyl)-4-imino-3-(3-(trifluoromethyl)phenyl)-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione chemical structure, C21H16F3N5O4, CAS 379708-00-6
6-(3,4-Dimethoxyphenyl)-4-imino-3-(3-(trifluoromethyl)phenyl)-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione
CAS 379708-00-6C21H16F3N5O4
6-(6-Chloro-2-fluorophenyl)-4-imino-3-phenyl-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione chemical structure, C18H11ClFN5O2, CAS 1119392-00-5
6-(6-Chloro-2-fluorophenyl)-4-imino-3-phenyl-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione
CAS 1119392-00-5C18H11ClFN5O2
3-(4-Chlorophenyl)-6-(2-hydroxy-3-methoxyphenyl)-4-imino-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione chemical structure, C19H14ClN5O4, CAS 379707-96-7
3-(4-Chlorophenyl)-6-(2-hydroxy-3-methoxyphenyl)-4-imino-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione
CAS 379707-96-7C19H14ClN5O4
4-Imino-6-(4-(isopropyl)phenyl)-3-phenyl-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione chemical structure, C21H19N5O2, CAS 1119391-98-8
4-Imino-6-(4-(isopropyl)phenyl)-3-phenyl-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione
CAS 1119391-98-8C21H19N5O2
3-(4-Chlorophenyl)-4-imino-6-(3,4,5-trimethoxyphenyl)-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione chemical structure, C21H18ClN5O5, CAS 1119391-58-0
3-(4-Chlorophenyl)-4-imino-6-(3,4,5-trimethoxyphenyl)-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione
CAS 1119391-58-0C21H18ClN5O5
4-Imino-6-(2-methoxyphenyl)-3-phenyl-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione chemical structure, C19H15N5O3, CAS 499197-57-8
4-Imino-6-(2-methoxyphenyl)-3-phenyl-1,3,7-trihydro-5,7-diazaquinazoline-2,8-dione
CAS 499197-57-8C19H15N5O3