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Murcko scaffold

Ring system with 3 rings and 18 atoms

178 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
18
Chemicals
178
With full pages
46
Scaffold SMILES

O=C(Cc1ccccc1)NC1C(=O)N2CCSC12

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=C(Cc1ccccc1)NC1C(=O)N2CCSC12

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 48 of 178 chemicals

6-((2-Amino-2-phenylacetyl)amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid chemical structure, C16H19N3O4S, CAS 856649-99-5
6-((2-Amino-2-phenylacetyl)amino)-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid
CAS 856649-99-5C16H19N3O4S
Penicillins chemical structure, C16H18N2O4S, CAS 1406-05-9
Penicillins
CAS 1406-05-9C16H18N2O4S
3,3-Dimethyl-7-oxo-6-[(2-phenyl-2-sulfoacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid chemical structure, C16H18N2O7S2, CAS 58569-36-1
3,3-Dimethyl-7-oxo-6-[(2-phenyl-2-sulfoacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
CAS 58569-36-1C16H18N2O7S2
Penicillin G procaine chemical structure, C29H38N4O6S, CAS 54-35-3
Penicillin G procaine
CAS 54-35-3C29H38N4O6S
Penicillin G chemical structure, C16H18N2O4S, CAS 61-33-6
Penicillin G
CAS 61-33-6C16H18N2O4S
Ampicillin chemical structure, C16H19N3O4S, CAS 69-53-4
Ampicillin
CAS 69-53-4C16H19N3O4S
Sulfamoyl 3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate chemical structure, C16H19N3O6S2, CAS 1406-10-6
Sulfamoyl 3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate
CAS 1406-10-6C16H19N3O6S2
Penicillin G benzathine anhydrous chemical structure, C48H56N6O8S2, CAS 1538-09-6
Penicillin G benzathine anhydrous
CAS 1538-09-6C48H56N6O8S2
Carbenicillin chemical structure, C17H18N2O6S, CAS 4697-36-3
Carbenicillin
CAS 4697-36-3C17H18N2O6S
Carbenicillin disodium chemical structure, C17H16N2Na2O6S, CAS 4800-94-6
Carbenicillin disodium
CAS 4800-94-6C17H16N2Na2O6S
Crysticillin chemical structure, C29H40N4O7S, CAS 6130-64-9
Crysticillin
CAS 6130-64-9C29H40N4O7S
RefChem:1071624 chemical structure, C26H33N3O5S, CAS 7177-45-9
RefChem:1071624
CAS 7177-45-9C26H33N3O5S
Ampicillin trihydrate chemical structure, C16H25N3O7S, CAS 7177-48-2
Ampicillin trihydrate
CAS 7177-48-2C16H25N3O7S
RefChem:381312 chemical structure, C16H19N3O4S, CAS 33993-48-5
RefChem:381312
CAS 33993-48-5C16H19N3O4S
2-(Diethylamino)ethyl 4-amino-2-chlorobenzoate, 3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid chemical structure, C29H37ClN4O6S, CAS 7179-55-7
2-(Diethylamino)ethyl 4-amino-2-chlorobenzoate, 3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
CAS 7179-55-7C29H37ClN4O6S
(1) Penethamate hydriodide chemical structure, C22H31N3O4S, CAS 7778-19-0
(1) Penethamate hydriodide
CAS 7778-19-0C22H31N3O4S
Amoxicillin, L- chemical structure, C16H19N3O5S, CAS 26889-93-0
Amoxicillin, L-
CAS 26889-93-0C16H19N3O5S
Pivampicillin hydrochloride chemical structure, C22H30ClN3O6S, CAS 26309-95-5
Pivampicillin hydrochloride
CAS 26309-95-5C22H30ClN3O6S
Pivampicillin chemical structure, C22H29N3O6S, CAS 33817-20-8
Pivampicillin
CAS 33817-20-8C22H29N3O6S
Amoxicillin chemical structure, C16H19N3O5S, CAS 26787-78-0
Amoxicillin
CAS 26787-78-0C16H19N3O5S
(2S,5R,6R)-3,3-Dimethyl-7-oxo-6-{[phenyl(sulfo)acetyl]amino}-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid chemical structure, C16H18N2O7S2, CAS 34779-28-7
(2S,5R,6R)-3,3-Dimethyl-7-oxo-6-{[phenyl(sulfo)acetyl]amino}-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
CAS 34779-28-7C16H18N2O7S2
Amoxicillin trihydrate chemical structure, C16H25N3O8S, CAS 61336-70-7
Amoxicillin trihydrate
CAS 61336-70-7C16H25N3O8S
Benethamine penicillin chemical structure, C31H35N3O4S, CAS 751-84-8
Benethamine penicillin
CAS 751-84-8C31H35N3O4S
Pivampicillin probenate chemical structure, C35H48N4O10S2, CAS 42190-91-0
Pivampicillin probenate
CAS 42190-91-0C35H48N4O10S2