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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
2
Scaffold SMILES

O=[PH](OCC1CCC(n2cnc3cncnc32)O1)Oc1ccccc1

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=[PH](OCC1CCC(n2cnc3cncnc32)O1)Oc1ccccc1

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

Adenosine-5'-(4-fluorosulfonylphenylphosphate) chemical structure, C16H17FN5O9PS, CAS 60397-89-9
Adenosine-5'-(4-fluorosulfonylphenylphosphate)
CAS 60397-89-9C16H17FN5O9PS
PSI 353661 chemical structure, C24H32FN6O8P, CAS 1231747-08-2
PSI 353661
CAS 1231747-08-2C24H32FN6O8P
O-AMP-tyrosine chemical structure, C19H23N6O9P, CAS 93957-03-0
O-AMP-tyrosine
CAS 93957-03-0C19H23N6O9P
Orb1691584 chemical structure, C25H33F2N6O8P, CAS 1613591-70-0
Orb1691584
CAS 1613591-70-0C25H33F2N6O8P
Bemnifosbuvir chemical structure, C24H33FN7O7P, CAS 1998705-64-8
Bemnifosbuvir
CAS 1998705-64-8C24H33FN7O7P
Isopropyl ((((2R,3R,4R,5R)-5-(2-amino-6-(methylamino)-9H-purin-9-yl)-4-fluoro-3-hydroxy-4-methyltetrahydrofuran-2-yl)methoxy)(phenoxy)phosphoryl)-L-alaninate chemical structure, C24H33FN7O7P, CAS 1998705-63-7
Isopropyl ((((2R,3R,4R,5R)-5-(2-amino-6-(methylamino)-9H-purin-9-yl)-4-fluoro-3-hydroxy-4-methyltetrahydrofuran-2-yl)methoxy)(phenoxy)phosphoryl)-L-alaninate
CAS 1998705-63-7C24H33FN7O7P
Bemnifosbuvir sulfate chemical structure, C48H68F2N14O18P2S, CAS 2241337-84-6
Bemnifosbuvir sulfate
CAS 2241337-84-6C48H68F2N14O18P2S
Isopropyl ((S)-(((2S,3S,4R,5R)-5-(2-amino-6-ethoxy-9H-purin-9-yl)-2,4-difluoro-3-hydroxy-4-methyltetrahydrofuran-2-yl)methoxy)(phenoxy)phosphoryl)-L-alaninate chemical structure, C25H33F2N6O8P, CAS 2481279-61-0
Isopropyl ((S)-(((2S,3S,4R,5R)-5-(2-amino-6-ethoxy-9H-purin-9-yl)-2,4-difluoro-3-hydroxy-4-methyltetrahydrofuran-2-yl)methoxy)(phenoxy)phosphoryl)-L-alaninate
CAS 2481279-61-0C25H33F2N6O8P
((2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl (4-nitrophenyl) hydrogen phosphate chemical structure, C16H17N6O9P, CAS 4227-83-2
((2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl (4-nitrophenyl) hydrogen phosphate
CAS 4227-83-2C16H17N6O9P
Adenosine, 3'-acetamido-3'-deoxy-N,N-dimethyl-, 5'-(phenyl phosphate) chemical structure, C20H25N6O7P, CAS 100000-71-3
Adenosine, 3'-acetamido-3'-deoxy-N,N-dimethyl-, 5'-(phenyl phosphate)
CAS 100000-71-3C20H25N6O7P
proAX chemical structure, C25H35N6O8P, CAS 2978687-02-2
proAX
CAS 2978687-02-2C25H35N6O8P