CompoundList
Sign in
Murcko scaffold

Ring system with 4 rings and 23 atoms

9 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
23
Chemicals
9
With full pages
1
Scaffold SMILES

c1ccc(CNc2ncnc3[nH]c(-c4ccccc4)cc23)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(CNc2ncnc3[nH]c(-c4ccccc4)cc23)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 9 of 9 chemicals

Pki-166 chemical structure, C20H18N4O, CAS 187724-61-4
Pki-166
CAS 187724-61-4C20H18N4O
(r)-6-(4-Methoxyphenyl)-N-(1-phenylethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine chemical structure, C21H20N4O, CAS 203724-37-2
(r)-6-(4-Methoxyphenyl)-N-(1-phenylethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine
CAS 203724-37-2C21H20N4O
4-(4-{[(1R)-1-(4-Fluorophenyl)ethyl]amino}-7H-pyrrolo[2,3-d]pyrimidin-6-yl)phenol chemical structure, C20H17FN4O, CAS 1011717-25-1
4-(4-{[(1R)-1-(4-Fluorophenyl)ethyl]amino}-7H-pyrrolo[2,3-d]pyrimidin-6-yl)phenol
CAS 1011717-25-1C20H17FN4O
4-[4-(Benzylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenol chemical structure, C19H16N4O, CAS 565175-75-9
4-[4-(Benzylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenol
CAS 565175-75-9C19H16N4O
[6-(4-Chloromethyl-phenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-((R)-1-phenyl-ethyl)-amine chemical structure, C21H19ClN4, CAS 497841-28-8
[6-(4-Chloromethyl-phenyl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-((R)-1-phenyl-ethyl)-amine
CAS 497841-28-8C21H19ClN4
4-[4-[[(1R)-1-(4-Fluorophenyl)ethyl]amino]-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenol chemical structure, C20H17FN4O
4-[4-[[(1R)-1-(4-Fluorophenyl)ethyl]amino]-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenol
C20H17FN4O
PKI-166 (hydrochloride) chemical structure, C20H19ClN4O, CAS 2230253-82-2
PKI-166 (hydrochloride)
CAS 2230253-82-2C20H19ClN4O
PKI 166 hydrochloride chemical structure, C20H19ClN4O
PKI 166 hydrochloride
C20H19ClN4O
[4-[4-[Methyl-[(3-methylphenyl)methyl]amino]-7~{H}-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]methanol chemical structure, C22H22N4O, CAS 2925744-43-8
[4-[4-[Methyl-[(3-methylphenyl)methyl]amino]-7~{H}-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]methanol
CAS 2925744-43-8C22H22N4O