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Murcko scaffold

Ring system with 4 rings and 24 atoms

7 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
24
Chemicals
7
With full pages
3
Scaffold SMILES

c1cncc(CNc2ccc(Cc3c[nH]c4ncccc34)cn2)c1

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 c1cncc(CNc2ccc(Cc3c[nH]c4ncccc34)cn2)c1

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 7 of 7 chemicals

6-Chloro-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]-N-[[6-(trifluoromethyl)pyridin-3-yl]methyl]pyridin-2-amine chemical structure, C21H17ClF3N5, CAS 1029045-08-6
6-Chloro-5-[(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]-N-[[6-(trifluoromethyl)pyridin-3-yl]methyl]pyridin-2-amine
CAS 1029045-08-6C21H17ClF3N5
Pexidartinib chemical structure, C20H15ClF3N5, CAS 1029044-16-3
Pexidartinib
CAS 1029044-16-3C20H15ClF3N5
Plx-5622 chemical structure, C21H19F2N5O, CAS 1303420-67-8
Plx-5622
CAS 1303420-67-8C21H19F2N5O
Pexidartinib hydrochloride chemical structure, C20H16Cl2F3N5, CAS 2040295-03-0
Pexidartinib hydrochloride
CAS 2040295-03-0C20H16Cl2F3N5
N-[5-[(4-Ethynyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]-2-pyridinyl]-6-methoxy-3-pyridinemethanamine chemical structure, C22H19N5O, CAS 1303423-59-7
N-[5-[(4-Ethynyl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]-2-pyridinyl]-6-methoxy-3-pyridinemethanamine
CAS 1303423-59-7C22H19N5O
PLX5622 fumarate chemical structure, C25H23F2N5O5, CAS 2749102-07-4
PLX5622 fumarate
CAS 2749102-07-4C25H23F2N5O5
Pexidartinib dihydrochloride chemical structure, C20H17Cl3F3N5, CAS 2169310-71-6
Pexidartinib dihydrochloride
CAS 2169310-71-6C20H17Cl3F3N5