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Murcko scaffold

Ring system with 3 rings and 19 atoms

107 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
19
Chemicals
107
With full pages
14
Scaffold SMILES

O=c1[nH]cnc2ncc(CNc3ccccc3)nc12

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=c1[nH]cnc2ncc(CNc3ccccc3)nc12

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 107 chemicals

Dimethyl 2-[[4-[(2-amino-3-methyl-4-oxopteridin-6-yl)methylamino]benzoyl]amino]pentanedioate chemical structure, C22H25N7O6, CAS 65757-05-3
Dimethyl 2-[[4-[(2-amino-3-methyl-4-oxopteridin-6-yl)methylamino]benzoyl]amino]pentanedioate
CAS 65757-05-3C22H25N7O6
Pteroylhexaglutamylglutamic acid chemical structure, C49H61N13O24, CAS 6484-74-8
Pteroylhexaglutamylglutamic acid
CAS 6484-74-8C49H61N13O24
Folic acid chemical structure, C19H19N7O6, CAS 59-30-3
Folic acid
CAS 59-30-3C19H19N7O6
Pteroic acid chemical structure, C14H12N6O3, CAS 119-24-4
Pteroic acid
CAS 119-24-4C14H12N6O3
2-[[4-[(2-Amino-4-oxo-3H-pteridin-6-yl)methyl-(2-chloroacetyl)amino]benzoyl]amino]pentanedioic acid chemical structure, C21H20ClN7O7, CAS 80402-32-0
2-[[4-[(2-Amino-4-oxo-3H-pteridin-6-yl)methyl-(2-chloroacetyl)amino]benzoyl]amino]pentanedioic acid
CAS 80402-32-0C21H20ClN7O7
2-[[4-[(2-Amino-4-oxo-3H-pteridin-6-yl)methyl-(3-chloropropanoyl)amino]benzoyl]amino]pentanedioic acid chemical structure, C22H22ClN7O7, CAS 80402-33-1
2-[[4-[(2-Amino-4-oxo-3H-pteridin-6-yl)methyl-(3-chloropropanoyl)amino]benzoyl]amino]pentanedioic acid
CAS 80402-33-1C22H22ClN7O7
Rhizopterine chemical structure, C15H12N6O4, CAS 119-20-0
Rhizopterine
CAS 119-20-0C15H12N6O4
10-Formylfolic acid chemical structure, C20H19N7O7, CAS 134-05-4
10-Formylfolic acid
CAS 134-05-4C20H19N7O7
N10-(Trifluoroacetyl)pteroic acid chemical structure, C16H11F3N6O4, CAS 37793-53-6
N10-(Trifluoroacetyl)pteroic acid
CAS 37793-53-6C16H11F3N6O4
Folate chemical structure, C19H19N7O6, CAS 65165-91-5
Folate
CAS 65165-91-5C19H19N7O6
N-(4-{[(2-Amino-4-oxo-1,4-dihydropteridin-6-yl)methyl]amino}benzoyl)-gamma-glutamyl-gamma-glutamyl-gamma-glutamyl-gamma-glutamylglutamic acid chemical structure, C39H47N11O18, CAS 25663-26-7
N-(4-{[(2-Amino-4-oxo-1,4-dihydropteridin-6-yl)methyl]amino}benzoyl)-gamma-glutamyl-gamma-glutamyl-gamma-glutamyl-gamma-glutamylglutamic acid
CAS 25663-26-7C39H47N11O18
Diacetylpteroic acid chemical structure, C18H16N6O5, CAS 70844-36-9
Diacetylpteroic acid
CAS 70844-36-9C18H16N6O5
(S)-2-(4-(((2-Amino-4-oxo-4,8-dihydropteridin-6-yl)methyl)amino)benzamido)-5-hydrazinyl-5-oxopentanoic acid chemical structure, C19H21N9O5, CAS 257938-98-0
(S)-2-(4-(((2-Amino-4-oxo-4,8-dihydropteridin-6-yl)methyl)amino)benzamido)-5-hydrazinyl-5-oxopentanoic acid
CAS 257938-98-0C19H21N9O5
Folate disodium chemical structure, C19H17N7Na2O6, CAS 29704-76-5
Folate disodium
CAS 29704-76-5C19H17N7Na2O6
Etarfolatide chemical structure, C29H35N11O11S, CAS 479578-27-3
Etarfolatide
CAS 479578-27-3C29H35N11O11S
2-[3-[4-[(2-Amino-4-oxo-3H-pteridin-6-yl)methylamino]phenyl]propanoylamino]pentanedioic acid chemical structure, C21H23N7O6, CAS 41934-83-2
2-[3-[4-[(2-Amino-4-oxo-3H-pteridin-6-yl)methylamino]phenyl]propanoylamino]pentanedioic acid
CAS 41934-83-2C21H23N7O6
Methopterin chemical structure, C20H21N7O6, CAS 2410-93-7
Methopterin
CAS 2410-93-7C20H21N7O6
Metfol-B chemical structure, C15H14N6O3, CAS 5623-18-7
Metfol-B
CAS 5623-18-7C15H14N6O3
2-((4-((2-Amino-4-oxo-1H-pteridin-6-yl)methylamino)benzoyl)amino)pentanedioic acid chemical structure, C19H19N7O6, CAS 65165-92-6
2-((4-((2-Amino-4-oxo-1H-pteridin-6-yl)methylamino)benzoyl)amino)pentanedioic acid
CAS 65165-92-6C19H19N7O6
N-[(4-{[(2-Amino-4-oxo-1,4-dihydropteridin-6-yl)methyl]amino}phenyl)acetyl]glutamic acid chemical structure, C20H21N7O6, CAS 41934-82-1
N-[(4-{[(2-Amino-4-oxo-1,4-dihydropteridin-6-yl)methyl]amino}phenyl)acetyl]glutamic acid
CAS 41934-82-1C20H21N7O6
2-[[4-[(2-Amino-4-oxo-3H-pteridin-6-yl)methylamino]-3-ethylbenzoyl]amino]pentanedioic acid chemical structure, C21H23N7O6, CAS 51541-23-2
2-[[4-[(2-Amino-4-oxo-3H-pteridin-6-yl)methylamino]-3-ethylbenzoyl]amino]pentanedioic acid
CAS 51541-23-2C21H23N7O6
2-[[4-[(2-Amino-4-oxo-3H-pteridin-6-yl)methylamino]-3-propan-2-ylbenzoyl]amino]pentanedioic acid chemical structure, C22H25N7O6, CAS 51541-24-3
2-[[4-[(2-Amino-4-oxo-3H-pteridin-6-yl)methylamino]-3-propan-2-ylbenzoyl]amino]pentanedioic acid
CAS 51541-24-3C22H25N7O6
2-[[4-[[2-(Methylamino)-4-oxo-3H-pteridin-6-yl]methylamino]benzoyl]amino]pentanedioic acid chemical structure, C20H21N7O6, CAS 65757-06-4
2-[[4-[[2-(Methylamino)-4-oxo-3H-pteridin-6-yl]methylamino]benzoyl]amino]pentanedioic acid
CAS 65757-06-4C20H21N7O6
Folic acid tetraglutamate chemical structure, C39H47N11O18, CAS 33611-85-7
Folic acid tetraglutamate
CAS 33611-85-7C39H47N11O18