CompoundList
Sign in
Murcko scaffold

Ring system with 4 rings and 22 atoms

10 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
22
Chemicals
10
With full pages
2
Scaffold SMILES

c1ccc(-c2nnc3ccc(OCc4ncn[nH]4)nn23)cc1

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 c1ccc(-c2nnc3ccc(OCc4ncn[nH]4)nn23)cc1

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

7-(tert-Butyl)-3-(2,6-difluorophenyl)-6-((1-ethyl-1H-1,2,4-triazol-5-yl)methoxy)-[1,2,4]triazolo[4,3-b]pyridazine chemical structure, C20H21F2N7O, CAS 286456-46-0
7-(tert-Butyl)-3-(2,6-difluorophenyl)-6-((1-ethyl-1H-1,2,4-triazol-5-yl)methoxy)-[1,2,4]triazolo[4,3-b]pyridazine
CAS 286456-46-0C20H21F2N7O
7-(1,1-Dimethylethyl)-6-((1-ethyl-1H-1,2,4-triazol-5-yl)methoxy)-3-(2-fluorophenyl)-1,2,4-triazolo(4,3-b)pyridazine chemical structure, C20H22FN7O, CAS 252977-51-8
7-(1,1-Dimethylethyl)-6-((1-ethyl-1H-1,2,4-triazol-5-yl)methoxy)-3-(2-fluorophenyl)-1,2,4-triazolo(4,3-b)pyridazine
CAS 252977-51-8C20H22FN7O
3-(2,5-Difluorophenyl)-7-(1,1-dimethylethyl)-6-((1-methyl-1H-1,2,4-triazol-5-yl)methoxy)-1,2,4-triazolo(4,3-b)pyridazine chemical structure, C19H19F2N7O, CAS 286456-42-6
3-(2,5-Difluorophenyl)-7-(1,1-dimethylethyl)-6-((1-methyl-1H-1,2,4-triazol-5-yl)methoxy)-1,2,4-triazolo(4,3-b)pyridazine
CAS 286456-42-6C19H19F2N7O
MK9Bpi11IH chemical structure, C18H18FN7O, CAS 503087-54-5
MK9Bpi11IH
CAS 503087-54-5C18H18FN7O
7Znk1yqe2I chemical structure, C19H19F2N7O, CAS 1213669-91-0
7Znk1yqe2I
CAS 1213669-91-0C19H19F2N7O
6-((1-Ethyl-1H-1,2,4-triazol-5-yl)methoxy)-3-(2-fluorophenyl)-7-isopropyl-[1,2,4]triazolo[4,3-B]pyridazine chemical structure, C19H20FN7O, CAS 2102409-54-9
6-((1-Ethyl-1H-1,2,4-triazol-5-yl)methoxy)-3-(2-fluorophenyl)-7-isopropyl-[1,2,4]triazolo[4,3-B]pyridazine
CAS 2102409-54-9C19H20FN7O
MK-0777 M1 chemical structure, C20H22FN7O2, CAS 908140-77-2
MK-0777 M1
CAS 908140-77-2C20H22FN7O2
Xtq2HC7bib chemical structure, C18H18FN7O2, CAS 908140-78-3
Xtq2HC7bib
CAS 908140-78-3C18H18FN7O2
TPA023 metabolite M10 chemical structure, C20H20FN7O3, CAS 908140-81-8
TPA023 metabolite M10
CAS 908140-81-8C20H20FN7O3
CTP-354 hydrate chemical structure, C19H21F2N7O2, CAS 2566446-95-3
CTP-354 hydrate
CAS 2566446-95-3C19H21F2N7O2