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Murcko scaffold

Cycloanthranilylproline scaffold

25 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
16
Chemicals
25
With full pages
2
Scaffold SMILES

O=C1Nc2ccccc2C(=O)N2CCCC12

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 scaffoldOpen the Cycloanthranilylproline page
Murcko scaffold O=C1Nc2ccccc2C(=O)N2CCCC12

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 25 of 25 chemicals

RK 1441B chemical structure, C13H14N2O5, CAS 132138-94-4
RK 1441B
CAS 132138-94-4C13H14N2O5
4-Hydroxy-3-methyl-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione chemical structure, C13H14N2O3, CAS 82635-61-8
4-Hydroxy-3-methyl-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione
CAS 82635-61-8C13H14N2O3
(11aS)-8-Chloro-2,3-dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione chemical structure, C12H11ClN2O2, CAS 78756-34-0
(11aS)-8-Chloro-2,3-dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione
CAS 78756-34-0C12H11ClN2O2
(S)-8-Hydroxy-7-methoxy-1,2,3,11a-tetrahydro-5H-benzo[e]pyrrolo[1,2-a][1,4]diazepine-5,11(10H)-dione chemical structure, C13H14N2O4, CAS 132391-70-9
(S)-8-Hydroxy-7-methoxy-1,2,3,11a-tetrahydro-5H-benzo[e]pyrrolo[1,2-a][1,4]diazepine-5,11(10H)-dione
CAS 132391-70-9C13H14N2O4
2-Amino-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione chemical structure, C12H13N3O2, CAS 1798663-89-4
2-Amino-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione
CAS 1798663-89-4C12H13N3O2
Cycloanthranilylproline chemical structure, C12H12N2O2, CAS 18877-34-4
Cycloanthranilylproline
CAS 18877-34-4C12H12N2O2
(11aR)-1,2,3,10,11,11a-Hexahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-5,11-dione chemical structure, C12H12N2O2, CAS 154802-75-2
(11aR)-1,2,3,10,11,11a-Hexahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepin-5,11-dione
CAS 154802-75-2C12H12N2O2
2-Hydroxy-pbd-5,11-dione chemical structure, C12H12N2O3, CAS 182823-26-3
2-Hydroxy-pbd-5,11-dione
CAS 182823-26-3C12H12N2O3
2,3-Dihydro-2-hydroxy-1H-pyrrolo(2,1-c)(1,4)benzodiazepine-5,11(10H,11aH)-dione chemical structure, C12H12N2O3, CAS 24919-45-7
2,3-Dihydro-2-hydroxy-1H-pyrrolo(2,1-c)(1,4)benzodiazepine-5,11(10H,11aH)-dione
CAS 24919-45-7C12H12N2O3
10-Methyl-2,3-dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione chemical structure, C13H14N2O2, CAS 58207-50-4
10-Methyl-2,3-dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione
CAS 58207-50-4C13H14N2O2
(5,11-Dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)acetic acid chemical structure, C14H14N2O4, CAS 206130-86-1
(5,11-Dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)acetic acid
CAS 206130-86-1C14H14N2O4
(11aS)-2,3-Dihydro-10-methyl-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione chemical structure, C13H14N2O2, CAS 58177-14-3
(11aS)-2,3-Dihydro-10-methyl-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione
CAS 58177-14-3C13H14N2O2
Methyl (5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)acetate chemical structure, C15H16N2O4, CAS 1025685-03-3
Methyl (5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)acetate
CAS 1025685-03-3C15H16N2O4
10-(3-Methylbutyl)-2,3-dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione chemical structure, C17H22N2O2, CAS 1048957-23-8
10-(3-Methylbutyl)-2,3-dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione
CAS 1048957-23-8C17H22N2O2
Ethyl (5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)acetate chemical structure, C16H18N2O4, CAS 1048957-25-0
Ethyl (5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)acetate
CAS 1048957-25-0C16H18N2O4
10-(2-Methoxyethyl)-2,3-dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione chemical structure, C15H18N2O3, CAS 1048957-24-9
10-(2-Methoxyethyl)-2,3-dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione
CAS 1048957-24-9C15H18N2O3
7-Nitro-2,3-dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione chemical structure, C12H11N3O4, CAS 41994-13-2
7-Nitro-2,3-dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione
CAS 41994-13-2C12H11N3O4
12,13-Dimethoxy-3,9-diazatricyclo[8.4.0.0,3,7]tetradeca-1(10),11,13-triene-2,8-dione chemical structure, C14H16N2O4, CAS 187276-05-7
12,13-Dimethoxy-3,9-diazatricyclo[8.4.0.0,3,7]tetradeca-1(10),11,13-triene-2,8-dione
CAS 187276-05-7C14H16N2O4
(S)-6-Bromo-1,2,3,11a-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H)-dione chemical structure, C12H11BrN2O2, CAS 90450-72-9
(S)-6-Bromo-1,2,3,11a-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H)-dione
CAS 90450-72-9C12H11BrN2O2
tert-Butyl [(11aS)-2-amino-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]acetate chemical structure, C18H23N3O4, CAS 1137496-23-1
tert-Butyl [(11aS)-2-amino-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]acetate
CAS 1137496-23-1C18H23N3O4
10-Acetyl-2,3-dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione chemical structure, C14H14N2O3, CAS 1169868-08-9
10-Acetyl-2,3-dihydro-1H-pyrrolo[2,1-c][1,4]benzodiazepine-5,11(10H,11aH)-dione
CAS 1169868-08-9C14H14N2O3
2-[(6aS)-8-[(2-Methylpropan-2-yl)oxycarbonylamino]-6,11-dioxo-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]acetic acid chemical structure, C19H23N3O6, CAS 1236207-50-3
2-[(6aS)-8-[(2-Methylpropan-2-yl)oxycarbonylamino]-6,11-dioxo-6a,7,8,9-tetrahydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl]acetic acid
CAS 1236207-50-3C19H23N3O6
(2R,11aS)-2,8-Dihydroxy-7-methoxy-10-((2-(trimethylsilyl)ethoxy)methyl)-1,2,3,11a-tetrahydro-5H-benzo[e]pyrrolo[1,2-a][1,4]diazepine-5,11(10H)-dione chemical structure, C19H28N2O6Si, CAS 1971076-35-3
(2R,11aS)-2,8-Dihydroxy-7-methoxy-10-((2-(trimethylsilyl)ethoxy)methyl)-1,2,3,11a-tetrahydro-5H-benzo[e]pyrrolo[1,2-a][1,4]diazepine-5,11(10H)-dione
CAS 1971076-35-3C19H28N2O6Si
Chloromethyl 2-(5-{[(tert-butoxy)carbonyl]amino}-2,8-dioxo-3,9-diazatricyclo[8.4.0.0,3,7]tetradeca-1(10),11,13-trien-9-yl)acetate chemical structure, C20H24ClN3O6, CAS 2137505-52-1
Chloromethyl 2-(5-{[(tert-butoxy)carbonyl]amino}-2,8-dioxo-3,9-diazatricyclo[8.4.0.0,3,7]tetradeca-1(10),11,13-trien-9-yl)acetate
CAS 2137505-52-1C20H24ClN3O6