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Murcko scaffold

Ring system with 4 rings and 25 atoms

11 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
25
Chemicals
11
With full pages
3
Scaffold SMILES

O=C(C=Cc1ccc2c(c1)OCO2)N1CCN(c2ccccc2)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 O=C(C=Cc1ccc2c(c1)OCO2)N1CCN(c2ccccc2)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 11 of 11 chemicals

1-(3-(1,3-Benzodioxol-5-yl)acryloyl)-4-phenylpiperazine chemical structure, C20H20N2O3, CAS 346726-13-4
1-(3-(1,3-Benzodioxol-5-yl)acryloyl)-4-phenylpiperazine
CAS 346726-13-4C20H20N2O3
(2E)-3-(1,3-Benzodioxol-5-yl)-1-[4-(3-chlorophenyl)piperazin-1-yl]prop-2-en-1-one chemical structure, C20H19ClN2O3, CAS 349418-07-1
(2E)-3-(1,3-Benzodioxol-5-yl)-1-[4-(3-chlorophenyl)piperazin-1-yl]prop-2-en-1-one
CAS 349418-07-1C20H19ClN2O3
(2E)-3-(1,3-Benzodioxol-5-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]prop-2-en-1-one chemical structure, C21H22N2O4, CAS 1164553-21-2
(2E)-3-(1,3-Benzodioxol-5-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]prop-2-en-1-one
CAS 1164553-21-2C21H22N2O4
(E)-3-(1,3-Benzodioxol-5-yl)-1-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]prop-2-en-1-one chemical structure, C21H19F3N2O3, CAS 432510-32-2
(E)-3-(1,3-Benzodioxol-5-yl)-1-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]prop-2-en-1-one
CAS 432510-32-2C21H19F3N2O3
(E)-3-(6-Bromo-1,3-benzodioxol-5-yl)-1-[4-(2-fluorophenyl)piperazino]-2-propen-1-one chemical structure, C20H18BrFN2O3, CAS 478078-33-0
(E)-3-(6-Bromo-1,3-benzodioxol-5-yl)-1-[4-(2-fluorophenyl)piperazino]-2-propen-1-one
CAS 478078-33-0C20H18BrFN2O3
(E)-3-(6-Bromo-1,3-benzodioxol-5-yl)-1-[4-(4-chlorophenyl)piperazino]-2-propen-1-one chemical structure, C20H18BrClN2O3, CAS 478078-52-3
(E)-3-(6-Bromo-1,3-benzodioxol-5-yl)-1-[4-(4-chlorophenyl)piperazino]-2-propen-1-one
CAS 478078-52-3C20H18BrClN2O3
(E)-3-(1,3-Benzodioxol-5-yl)-1-[4-(2-ethoxyphenyl)piperazin-1-yl]prop-2-en-1-one chemical structure, C22H24N2O4, CAS 328270-92-4
(E)-3-(1,3-Benzodioxol-5-yl)-1-[4-(2-ethoxyphenyl)piperazin-1-yl]prop-2-en-1-one
CAS 328270-92-4C22H24N2O4
1-[3-(1,3-Benzodioxol-5-yl)acryloyl]-4-(4-chlorophenyl)piperazine chemical structure, C20H19ClN2O3, CAS 1164508-59-1
1-[3-(1,3-Benzodioxol-5-yl)acryloyl]-4-(4-chlorophenyl)piperazine
CAS 1164508-59-1C20H19ClN2O3
1-(3-(1,3-Benzodioxol-5-yl)acryloyl)-4-(4-fluorophenyl)piperazine chemical structure, C20H19FN2O3, CAS 328270-97-9
1-(3-(1,3-Benzodioxol-5-yl)acryloyl)-4-(4-fluorophenyl)piperazine
CAS 328270-97-9C20H19FN2O3
(2E)-3-(1,3-Benzodioxol-5-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]prop-2-en-1-one chemical structure, C20H19N3O5, CAS 346726-83-8
(2E)-3-(1,3-Benzodioxol-5-yl)-1-[4-(4-nitrophenyl)piperazin-1-yl]prop-2-en-1-one
CAS 346726-83-8C20H19N3O5
1-(3-(1,3-Benzodioxol-5-yl)acryloyl)-4-(4-methoxyphenyl)piperazine chemical structure, C21H22N2O4, CAS 882073-12-3
1-(3-(1,3-Benzodioxol-5-yl)acryloyl)-4-(4-methoxyphenyl)piperazine
CAS 882073-12-3C21H22N2O4