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Murcko scaffold

Ring system with 4 rings and 21 atoms

10 chemicals on CompoundList share this ring system.

Rings
4
Scaffold atoms
21
Chemicals
10
With full pages
2
Scaffold SMILES

c1ccc(Oc2nncnc2N2CCC3(CNC3)C2)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(Oc2nncnc2N2CCC3(CNC3)C2)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

US12473295, Compound 394 chemical structure, C32H49ClFN7O3, CAS 2654081-14-6
US12473295, Compound 394
CAS 2654081-14-6C32H49ClFN7O3
tert-Butyl 6-(6-{2-[ethyl(propan-2-yl)carbamoyl]-4-fluorophenoxy}-1,2,4-triazin-5-yl)-2,6-diazaspiro[3.4]octane-2-carboxylate chemical structure, C26H35FN6O4, CAS 2654083-05-1
tert-Butyl 6-(6-{2-[ethyl(propan-2-yl)carbamoyl]-4-fluorophenoxy}-1,2,4-triazin-5-yl)-2,6-diazaspiro[3.4]octane-2-carboxylate
CAS 2654083-05-1C26H35FN6O4
(R)-N-Ethyl-5-fluoro-2-((5-(2-(6-((2-hydroxyethyl)(methyl)amino)-2-methylhexan-3-yl)-2,6-diazaspiro[3.4]octan-6-yl)-1,2,4-triazin-6-yl)oxy)-N-isopropylbenzamide chemical structure, C31H48FN7O3, CAS 2654080-48-3
(R)-N-Ethyl-5-fluoro-2-((5-(2-(6-((2-hydroxyethyl)(methyl)amino)-2-methylhexan-3-yl)-2,6-diazaspiro[3.4]octan-6-yl)-1,2,4-triazin-6-yl)oxy)-N-isopropylbenzamide
CAS 2654080-48-3C31H48FN7O3
Bleximenib chemical structure, C32H50FN7O3, CAS 2654081-35-1
Bleximenib
CAS 2654081-35-1C32H50FN7O3
N-Ethyl-5-fluoro-2-{[5-(2-{6-[(2-methoxyethyl)(methyl)amino]-2-methylhexan-3-yl}-2,6-diazaspiro[3.4]octan-6-yl)-1,2,4-triazin-6-yl]oxy}-N-(propan-2-yl)benzamide chemical structure, C32H50FN7O3, CAS 2654081-36-2
N-Ethyl-5-fluoro-2-{[5-(2-{6-[(2-methoxyethyl)(methyl)amino]-2-methylhexan-3-yl}-2,6-diazaspiro[3.4]octan-6-yl)-1,2,4-triazin-6-yl]oxy}-N-(propan-2-yl)benzamide
CAS 2654081-36-2C32H50FN7O3
(R)-N-Ethyl-5-fluoro-N-isopropyl-2-((5-(2-(2-methyl-6-(methylamino)hexan-3-yl)-2,6-diazaspiro[3.4]octan-6-yl)-1,2,4-triazin-6-yl)oxy)benzamide chemical structure, C29H44FN7O2, CAS 2654078-52-9
(R)-N-Ethyl-5-fluoro-N-isopropyl-2-((5-(2-(2-methyl-6-(methylamino)hexan-3-yl)-2,6-diazaspiro[3.4]octan-6-yl)-1,2,4-triazin-6-yl)oxy)benzamide
CAS 2654078-52-9C29H44FN7O2
(S)-Bleximenib (oxalate) chemical structure, C32H50FN7O3, CAS 2654081-27-1
(S)-Bleximenib (oxalate)
CAS 2654081-27-1C32H50FN7O3
Bleximenib oxalate chemical structure, C34H52FN7O7, CAS 2866179-95-3
Bleximenib oxalate
CAS 2866179-95-3C34H52FN7O7
Bleximenib besylate chemical structure, C44H62FN7O9S2, CAS 2866179-96-4
Bleximenib besylate
CAS 2866179-96-4C44H62FN7O9S2
Bleximenib dihydrochloride chemical structure, C32H52Cl2FN7O3, CAS 2866139-02-6
Bleximenib dihydrochloride
CAS 2866139-02-6C32H52Cl2FN7O3