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Murcko scaffold

Ring system with 5 rings and 27 atoms

11 chemicals on CompoundList share this ring system.

Rings
5
Scaffold atoms
27
Chemicals
11
With full pages
3
Scaffold SMILES

c1ccc(-c2nn(-c3ccccc3)cc2C2CC(c3cccs3)=NN2)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(-c2nn(-c3ccccc3)cc2C2CC(c3cccs3)=NN2)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

5-[3-[3-(4-Methylphenyl)-1-phenylpyrazol-4-yl]-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid chemical structure, C28H26N4O3S, CAS 378757-83-6
5-[3-[3-(4-Methylphenyl)-1-phenylpyrazol-4-yl]-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid
CAS 378757-83-6C28H26N4O3S
5-[3-[3-(4-Methoxyphenyl)-1-phenyl-4-pyrazolyl]-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid chemical structure, C28H26N4O4S, CAS 384355-59-3
5-[3-[3-(4-Methoxyphenyl)-1-phenyl-4-pyrazolyl]-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid
CAS 384355-59-3C28H26N4O4S
4-[3-[3-(4-Methoxyphenyl)-1-phenylpyrazol-4-yl]-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid chemical structure, C27H24N4O4S, CAS 369393-81-7
4-[3-[3-(4-Methoxyphenyl)-1-phenylpyrazol-4-yl]-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-4-oxobutanoic acid
CAS 369393-81-7C27H24N4O4S
1-[3-[3-(4-Methoxyphenyl)-1-phenylpyrazol-4-yl]-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone chemical structure, C25H22N4O2S, CAS 402951-09-1
1-[3-[3-(4-Methoxyphenyl)-1-phenylpyrazol-4-yl]-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone
CAS 402951-09-1C25H22N4O2S
5-[3-(1,3-Diphenylpyrazol-4-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid chemical structure, C27H24N4O3S, CAS 381727-89-5
5-[3-(1,3-Diphenylpyrazol-4-yl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid
CAS 381727-89-5C27H24N4O3S
2-Methanesulfonyl-1',3'-diphenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-3,4'-bipyrazole chemical structure, C23H20N4O2S2, CAS 876941-27-4
2-Methanesulfonyl-1',3'-diphenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-3,4'-bipyrazole
CAS 876941-27-4C23H20N4O2S2
2-(Methylsulfonyl)-1'-phenyl-5-(thiophen-2-yl)-3'-(p-tolyl)-3,4-dihydro-1'H,2H-3,4'-bipyrazole chemical structure, C24H22N4O2S2, CAS 876941-56-9
2-(Methylsulfonyl)-1'-phenyl-5-(thiophen-2-yl)-3'-(p-tolyl)-3,4-dihydro-1'H,2H-3,4'-bipyrazole
CAS 876941-56-9C24H22N4O2S2
1-(1',3'-Diphenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-[3,4'-bipyrazol]-2-yl)-2-((2-hydroxyethyl)amino)ethanone chemical structure, C26H25N5O2S, CAS 1010868-12-8
1-(1',3'-Diphenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-[3,4'-bipyrazol]-2-yl)-2-((2-hydroxyethyl)amino)ethanone
CAS 1010868-12-8C26H25N5O2S
2-[(2-Hydroxyethyl)amino]-1-[3'-(4-methylphenyl)-1'-phenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-[3,4'-bipyrazole]-2-yl]ethan-1-one chemical structure, C27H27N5O2S, CAS 1005980-12-0
2-[(2-Hydroxyethyl)amino]-1-[3'-(4-methylphenyl)-1'-phenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-[3,4'-bipyrazole]-2-yl]ethan-1-one
CAS 1005980-12-0C27H27N5O2S
1-(3'-(4-Methoxyphenyl)-1'-phenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-[3,4'-bipyrazol]-2-yl)propan-1-one chemical structure, C26H24N4O2S, CAS 1017500-28-5
1-(3'-(4-Methoxyphenyl)-1'-phenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-[3,4'-bipyrazol]-2-yl)propan-1-one
CAS 1017500-28-5C26H24N4O2S
1-(1',3'-Diphenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-[3,4'-bipyrazol]-2-yl)propan-1-one chemical structure, C25H22N4OS, CAS 1020478-10-7
1-(1',3'-Diphenyl-5-(thiophen-2-yl)-3,4-dihydro-1'H,2H-[3,4'-bipyrazol]-2-yl)propan-1-one
CAS 1020478-10-7C25H22N4OS