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Murcko scaffold

Ring system with 3 rings and 12 atoms

27 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
12
Chemicals
27
With full pages
6
Scaffold SMILES

c1cc2c3c(c[nH]c3c1)CCC2

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 c1cc2c3c(c[nH]c3c1)CCC2

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 27 of 27 chemicals

LY 178210 chemical structure, C18H25N3O, CAS 114943-19-0
LY 178210
CAS 114943-19-0C18H25N3O
Benz(cd)indol-4-amine, 1,3,4,5-tetrahydro-6-methoxy-N,N-dipropyl-, hydrochloride (1:1) chemical structure, C18H27ClN2O, CAS 98770-54-8
Benz(cd)indol-4-amine, 1,3,4,5-tetrahydro-6-methoxy-N,N-dipropyl-, hydrochloride (1:1)
CAS 98770-54-8C18H27ClN2O
6-Methoxy-N,N-dipropyl-1,3,4,5-tetrahydrobenzo[cd]indol-4-amine chemical structure, C18H26N2O, CAS 98770-53-7
6-Methoxy-N,N-dipropyl-1,3,4,5-tetrahydrobenzo[cd]indol-4-amine
CAS 98770-53-7C18H26N2O
1-((4R)-4-(Dipropylamino)-1,3,4,5-tetrahydrobenz(cd)indol-6-yl)ethanone chemical structure, C19H26N2O, CAS 141318-62-9
1-((4R)-4-(Dipropylamino)-1,3,4,5-tetrahydrobenz(cd)indol-6-yl)ethanone
CAS 141318-62-9C19H26N2O
RU 27849 chemical structure, C11H12N2, CAS 77963-70-3
RU 27849
CAS 77963-70-3C11H12N2
Benz(cd)indol-4-amine, 1,3,4,5-tetrahydro-N-methyl-5-(2-methyl-1-propenyl)-, (4R,5R)- chemical structure, C16H20N2, CAS 68156-97-8
Benz(cd)indol-4-amine, 1,3,4,5-tetrahydro-N-methyl-5-(2-methyl-1-propenyl)-, (4R,5R)-
CAS 68156-97-8C16H20N2
(AlphaR,4R,5R)-1,3,4,5-tetrahydro-4-(methylamino)-alpha-(1-methylethenyl)benz(cd)indole-5-methanol chemical structure, C16H20N2O, CAS 52052-66-1
(AlphaR,4R,5R)-1,3,4,5-tetrahydro-4-(methylamino)-alpha-(1-methylethenyl)benz(cd)indole-5-methanol
CAS 52052-66-1C16H20N2O
Benz(cd)indole-6-carboxamide, 4-(dipropylamino)-1,3,4,5-tetrahydro-, (R)- chemical structure, C18H25N3O, CAS 115994-31-5
Benz(cd)indole-6-carboxamide, 4-(dipropylamino)-1,3,4,5-tetrahydro-, (R)-
CAS 115994-31-5C18H25N3O
1,3,4,5-Tetrahydro-N,N-dimethylbenz(cd)indol-4-amine chemical structure, C13H16N2, CAS 73625-11-3
1,3,4,5-Tetrahydro-N,N-dimethylbenz(cd)indol-4-amine
CAS 73625-11-3C13H16N2
3-Aminomethyl-1,3,4,5-tetrahydrobenz(cd)indole chemical structure, C12H14N2, CAS 111261-72-4
3-Aminomethyl-1,3,4,5-tetrahydrobenz(cd)indole
CAS 111261-72-4C12H14N2
Benz(cd)indole, 1,3,4,5-tetrahydro-1-(3-(dimethylamino)propyl)-, monohydrochloride chemical structure, C16H23ClN2, CAS 20892-50-6
Benz(cd)indole, 1,3,4,5-tetrahydro-1-(3-(dimethylamino)propyl)-, monohydrochloride
CAS 20892-50-6C16H23ClN2
Chanoclavine chemical structure, C16H20N2O, CAS 2390-99-0
Chanoclavine
CAS 2390-99-0C16H20N2O
Demethylchanoclavine chemical structure, C15H18N2O, CAS 51704-40-6
Demethylchanoclavine
CAS 51704-40-6C15H18N2O
Norchanoclavine I, (+)- chemical structure, C15H18N2O, CAS 106621-75-4
Norchanoclavine I, (+)-
CAS 106621-75-4C15H18N2O
Isochanoclavine I chemical structure, C16H20N2O, CAS 1150-44-3
Isochanoclavine I
CAS 1150-44-3C16H20N2O
Norchanoclavine I, (-)- chemical structure, C15H18N2O, CAS 51743-69-2
Norchanoclavine I, (-)-
CAS 51743-69-2C15H18N2O
1,3,4,5-Tetrahydrobenzo[cd]indole-3-carboxylic acid chemical structure, C12H11NO2, CAS 124051-26-9
1,3,4,5-Tetrahydrobenzo[cd]indole-3-carboxylic acid
CAS 124051-26-9C12H11NO2
1,3,4,5-Tetrahydrobenzo[cd]indole-3-carboxamide chemical structure, C12H12N2O, CAS 124051-27-0
1,3,4,5-Tetrahydrobenzo[cd]indole-3-carboxamide
CAS 124051-27-0C12H12N2O
Chanoclavine II chemical structure, C16H20N2O, CAS 1466-08-6
Chanoclavine II
CAS 1466-08-6C16H20N2O
N-(1,3,4,5-Tetrahydro-6-methoxybenz[cd]indol-4-yl)acetamide chemical structure, C14H16N2O2, CAS 183057-65-0
N-(1,3,4,5-Tetrahydro-6-methoxybenz[cd]indol-4-yl)acetamide
CAS 183057-65-0C14H16N2O2
LY-228729 chemical structure, C27H34N4O4, CAS 137641-36-2
LY-228729
CAS 137641-36-2C27H34N4O4
Chanoclavine-I aldehyde chemical structure, C16H18N2O, CAS 25800-42-4
Chanoclavine-I aldehyde
CAS 25800-42-4C16H18N2O
EZ7Z6Y2Qbq chemical structure, C19H26N2O, CAS 141318-63-0
EZ7Z6Y2Qbq
CAS 141318-63-0C19H26N2O
1,3,4,5-Tetrahydrobenz[cd]indol-5-amine chemical structure, C11H12N2, CAS 38072-97-8
1,3,4,5-Tetrahydrobenz[cd]indol-5-amine
CAS 38072-97-8C11H12N2