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Murcko scaffold

Ring system with 4 rings and 20 atoms

10 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
20
Chemicals
10
With full pages
2
Scaffold SMILES

O=C1NCCn2c(-c3ccccc3)nc3cccc1c32

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.

Substructure search with this scaffold
Murcko scaffold O=C1NCCn2c(-c3ccccc3)nc3cccc1c32

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 10 of 10 chemicals

AG-14361 chemical structure, C19H20N4O, CAS 328543-09-5
AG-14361
CAS 328543-09-5C19H20N4O
4-(6-Oxo-6,7,8,9-tetrahydro-2,7,9a-triazabenzo[cd]azulen-1-yl)benzaldehyde chemical structure, C17H13N3O2, CAS 328543-07-3
4-(6-Oxo-6,7,8,9-tetrahydro-2,7,9a-triazabenzo[cd]azulen-1-yl)benzaldehyde
CAS 328543-07-3C17H13N3O2
5,6-Dihydro-2-[4-(1-hydroxyethyl)phenyl]imidazo[4,5,1-jk][1,4]benzodiazepin-7(4H)-one chemical structure, C18H17N3O2, CAS 328547-26-8
5,6-Dihydro-2-[4-(1-hydroxyethyl)phenyl]imidazo[4,5,1-jk][1,4]benzodiazepin-7(4H)-one
CAS 328547-26-8C18H17N3O2
Fluorine F 18 fluorthanatrace chemical structure, C18H16FN3O2, CAS 1567375-87-4
Fluorine F 18 fluorthanatrace
CAS 1567375-87-4C18H16FN3O2
Parp1-IN-29 chemical structure, C18H16FN3O2, CAS 1567375-93-2
Parp1-IN-29
CAS 1567375-93-2C18H16FN3O2
Imidazo[4,5,1-jk][1,4]benzodiazepin-7(4H)-one, 2-[4-(2-bromoethoxy)phenyl]-5,6-dihydro- chemical structure, C18H16BrN3O2, CAS 1567375-95-4
Imidazo[4,5,1-jk][1,4]benzodiazepin-7(4H)-one, 2-[4-(2-bromoethoxy)phenyl]-5,6-dihydro-
CAS 1567375-95-4C18H16BrN3O2
Imidazo[4,5,1-jk][1,4]benzodiazepin-7(4H)-one, 5,6-dihydro-2-[4-[2-[(methylsulfonyl)oxy]ethoxy]phenyl]- chemical structure, C19H19N3O5S, CAS 328546-96-9
Imidazo[4,5,1-jk][1,4]benzodiazepin-7(4H)-one, 5,6-dihydro-2-[4-[2-[(methylsulfonyl)oxy]ethoxy]phenyl]-
CAS 328546-96-9C19H19N3O5S
Orb1706156 chemical structure, C28H39N3OSn, CAS 2211903-84-1
Orb1706156
CAS 2211903-84-1C28H39N3OSn
BIBD-300 chemical structure, C20H20FN3O3, CAS 3030758-22-3
BIBD-300
CAS 3030758-22-3C20H20FN3O3
Orb3210640 chemical structure, C16H12IN3O, CAS 1574367-80-8
Orb3210640
CAS 1574367-80-8C16H12IN3O