Free for buyers, contact details stay privateFree for buyers. Your contact details stay private until you accept a quote.

Sign in Join free

Murcko scaffold

Ring system with 2 rings and 12 atoms

12 chemicals on CompoundList share this ring system.

Rings: 2
Scaffold atoms: 12
Chemicals: 12
With full pages: 5

Scaffold SMILES

C1=CC(c2cccnc2)C=CN1

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 C1=CC(c2cccnc2)C=CN1

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 12 of 12 chemicals

Mesudipine chemical structure, C19H24N2O4S, CAS 62658-88-2

CAS 62658-88-2C₁₉H₂₄N₂O₄S

Diethyl 1',4'-dihydro-2',6'-dimethyl-(3,4'-bipyridine)-3',5'-dicarboxylate chemical structure, C18H22N2O4, CAS 23125-30-6

Diethyl 1',4'-dihydro-2',6'-dimethyl-(3,4'-bipyridine)-3',5'-dicarboxylate

CAS 23125-30-6C₁₈H₂₂N₂O₄

Prop-2-enyl 5-cyano-6-[2-(ethoxycarbonylamino)-2-oxoethyl]sulfanyl-2-methyl-4-pyridin-3-yl-1,4-dihydropyridine-3-carboxylate chemical structure, C21H22N4O5S, CAS 445391-36-6

Prop-2-enyl 5-cyano-6-[2-(ethoxycarbonylamino)-2-oxoethyl]sulfanyl-2-methyl-4-pyridin-3-yl-1,4-dihydropyridine-3-carboxylate

CAS 445391-36-6C₂₁H₂₂N₄O₅S

Dimethyl 2,6-dimethyl-4-pyridin-3-yl-1,4-dihydropyridine-3,5-dicarboxylate chemical structure, C16H18N2O4, CAS 73349-75-4

Dimethyl 2,6-dimethyl-4-pyridin-3-yl-1,4-dihydropyridine-3,5-dicarboxylate

CAS 73349-75-4C₁₆H₁₈N₂O₄

AF-499/00049040 chemical structure, C16H18N2O2, CAS 54756-39-7

AF-499/00049040

CAS 54756-39-7C₁₆H₁₈N₂O₂

[3,4'-Bipyridine]-3',5'-dicarbonitrile, 1',4'-dihydro-2',6'-dimethyl- chemical structure, C14H12N4, CAS 64089-24-3

[3,4'-Bipyridine]-3',5'-dicarbonitrile, 1',4'-dihydro-2',6'-dimethyl-

CAS 64089-24-3C₁₄H₁₂N₄

(3,4'-Bipyridine)-3'-carbonitrile, 1',4'-dihydro-5'-acetyl-2'-mercapto-6'-methyl- chemical structure, C14H13N3OS, CAS 109619-35-4

(3,4'-Bipyridine)-3'-carbonitrile, 1',4'-dihydro-5'-acetyl-2'-mercapto-6'-methyl-

CAS 109619-35-4C₁₄H₁₃N₃OS

Acetamide, 2-((5'-acetyl-3'-cyano-1',4'-dihydro-6'-methyl(3,4'-bipyridin)-2'-yl)thio)-, monohydrochloride chemical structure, C16H17ClN4O2S, CAS 117491-13-1

Acetamide, 2-((5'-acetyl-3'-cyano-1',4'-dihydro-6'-methyl(3,4'-bipyridin)-2'-yl)thio)-, monohydrochloride

CAS 117491-13-1C₁₆H₁₇ClN₄O₂S

Di-tert-butyl 2',6'-dimethyl-1',4'-dihydro-3,4'-bipyridine-3',5'-dicarboxylate chemical structure, C22H30N2O4, CAS 80592-76-3

Di-tert-butyl 2',6'-dimethyl-1',4'-dihydro-3,4'-bipyridine-3',5'-dicarboxylate

CAS 80592-76-3C₂₂H₃₀N₂O₄

6-Amino-3,5-dicyano-4-pyridin-3-yl-1,4-dihydropyridine-2-thiolate chemical structure, C12H8N5S-, CAS 6926-70-1

6-Amino-3,5-dicyano-4-pyridin-3-yl-1,4-dihydropyridine-2-thiolate

CAS 6926-70-1C₁₂H₈N₅S-

Dipropan-2-yl 2',6'-dimethyl-1',4'-dihydro-3,4'-bipyridine-3',5'-dicarboxylate chemical structure, C20H26N2O4, CAS 104196-54-5

Dipropan-2-yl 2',6'-dimethyl-1',4'-dihydro-3,4'-bipyridine-3',5'-dicarboxylate

CAS 104196-54-5C₂₀H₂₆N₂O₄

Bis(2-methylpropyl) 2',6'-dimethyl-1',4'-dihydro-3,4'-bipyridine-3',5'-dicarboxylate chemical structure, C22H30N2O4, CAS 104196-55-6

Bis(2-methylpropyl) 2',6'-dimethyl-1',4'-dihydro-3,4'-bipyridine-3',5'-dicarboxylate

CAS 104196-55-6C₂₂H₃₀N₂O₄