Murcko scaffold
Ring system with 2 rings and 16 atoms
144 chemicals on CompoundList share this ring system.
- Rings
- 2
- Scaffold atoms
- 16
- Chemicals
- 144
- With full pages
- 11
Scaffold SMILES
O=C(NCCc1ccccc1)C1CCCN1
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.
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 144 chemicals
Alacepril
CAS 74258-86-9C20H26N2O5S
Phenylalanyl-prolyl-arginine-chloromethyl ketone
CAS 65149-23-7C21H31ClN6O3
Neurotensin (8-13)
CAS 60482-95-3C38H64N12O8
Kki 5
CAS 97145-43-2C35H55N11O9
Neurotensin-related hexapeptide
CAS 85213-84-9C36H58N8O9
Prolyl-tyrosyl-glycinamide
CAS 132149-55-4C16H22N4O4
Prolyl-phenylalanyl-N-heptylargininamide
CAS 79358-73-9C27H45N7O3
L-Prolyl-L-tyrosine
CAS 19786-36-8C14H18N2O4
Desacetyl-alacepril
CAS 74259-08-8C18H24N2O4S
Acetylneurotensin (8-13)
CAS 74853-69-3C40H66N12O9
MF 13
CAS 38232-20-1C23H34Cl2N4O4
Jmv 449
CAS 139026-66-7C38H66N8O7
L-Phenylalanine, N-(1-nitroso-L-prolyl)-
CAS 88476-98-6C14H17N3O4
Icaria chemotactic peptide, lys(7)-
CAS 108567-69-7C69H119N15O14
Lincophenicol
CAS 148077-13-8C18H27N3O5
L-Tyrosine, 3-hydroxy-N-L-prolyl-, hydrate
CAS 37166-10-2C14H18N2O5
Methyl 3-phenyl-2-(pyrrolidine-2-carbonylamino)propanoate
CAS 54793-80-5C15H20N2O3
Melanocyte Protein PMEL 17 (185-193) (human, bovine, mouse)
CAS 162558-10-3C46H72N10O15
Disomotide
CAS 181477-43-0C47H74N10O14S
(S)-tert-Butyl 2-(phenethylcarbamoyl)pyrrolidine-1-carboxylate
CAS 92122-49-1C18H26N2O3
L-Phenylalaninamide, L-prolyl-
CAS 1510-07-2C14H19N3O2
![Methyl (S)-2-[(S)-1-Boc-pyrrolidine-2-carboxamido]-3-phenylpropanoate chemical structure, C20H28N2O5, CAS 52071-64-4](/s/XYLTWJZHTZTSFD-HOTGVXAUSA-N.svg)
Methyl (S)-2-[(S)-1-Boc-pyrrolidine-2-carboxamido]-3-phenylpropanoate
CAS 52071-64-4C20H28N2O5
![L-Phenylalanine, 1-[(1,1-dimethylethoxy)carbonyl]-D-prolyl-, methyl ester chemical structure, C20H28N2O5, CAS 74086-60-5](/s/XYLTWJZHTZTSFD-JKSUJKDBSA-N.svg)
L-Phenylalanine, 1-[(1,1-dimethylethoxy)carbonyl]-D-prolyl-, methyl ester
CAS 74086-60-5C20H28N2O5
L-Phenylalanine, N-(1-(2-methyl-1-oxo-3-((1-oxopropyl)thio)propyl)-L-prolyl)-, (S)-
CAS 74259-02-2C21H28N2O5S
- L-Tyrosinamide, 1-(1-oxohexyl)-L-prolyl-200954-57-0C20H29N3O4
- L-Tyrosinamide, L-prolyl-, mono(trifluoroacetate) (salt)200954-61-6C16H20F3N3O5
- L-Tyrosinamide, L-prolyl-52329-46-1C14H19N3O3
- H-DL-Lys-DL-Lys-DL-Asp-DL-Ser-Gly-DL-Pro-DL-Tyr-OHC35H55N9O12
- tert-Butyl 2-[(1-methoxy-1-oxo-3-phenylpropan-2-yl)carbamoyl]pyrrolidine-1-carboxylateC20H28N2O5
- Mdl 27399131374-22-6C26H36N4O8
- Cyclo(glycyl-prolyl-phenylalanyl-alanyl-asparaginyl-alanyl-valyl-seryl)107729-99-7C34H49N9O10
- Pro-Phe13589-02-1C14H18N2O3
- 1-Boc-D-prolyl-D-phenylalanine250290-78-9C19H26N2O5
- Boc-D-pro-phe-OH74086-61-6C19H26N2O5
- BocPro-DPheOH94779-08-5C19H26N2O5
- Boc-pro-phe-OH52071-65-5C19H26N2O5
- (2S)-2-[[(2S)-1-[(2S)-2,6-Diaminohexanoyl]pyrrolidine-2-carbonyl]amino]-3-(4-hydroxyphenyl)propanoic acid290314-43-1C20H30N4O5
- (2S)-6-Amino-2-[[(2S)-3-phenyl-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoyl]amino]hexanoic acid40204-88-4C20H30N4O4
- 1 suppliersDilept200954-39-8C21H30N2O5
- Neuromedin N102577-25-3C38H63N7O8
- (S)-N-((S)-1-((2-Amino-2-oxoethyl)amino)-1-oxo-3-phenylpropan-2-yl)pyrrolidine-2-carboxamide114390-34-0C16H22N4O3
- (2S)-2-[[(2S,3S)-2-[[(2S)-3-(4-Hydroxyphenyl)-2-[[(2S)-pyrrolidine-2-carbonyl]amino]propanoyl]amino]-3-methylpentanoyl]amino]-4-methylpentanoic acid60482-97-5C26H40N4O6
- D-Valine, D-prolyl-D-tyrosyl-628282-03-1C19H27N3O5
- Stat3-IN-23286465-26-7C36H61N8O12P
- H-Pro-Phe-Gly-Lys-OH21957-31-3C22H33N5O5
- L-Phenylalanine, L-alanyl-L-arginyl-L-prolyl-443303-13-7C23H35N7O5
- H-Ala-Ala-Ala-Ala-Pro-Phe-OH425369-18-2C26H38N6O7
- N-Formylmethionyl-prolyl-phenylalanine methyl ester150178-44-2C21H29N3O5S
Related scaffolds
Same ring framework with different atoms or bond orders
![Scaffold O=C(CSc1nnc[nH]1)Nc1ccccc1](/scaffold/VJBDIQRNSVRUDP-UHFFFAOYSA-N/structure.svg)
O=C(CSc1nnc[nH]1)Nc1ccccc165 chemicals
O=C(COc1ccccc1)Nc1nccs143 chemicals
O=C(CCc1ccco1)Nc1ccccc134 chemicals
O=C(CSc1nncs1)Nc1ccccc134 chemicals![Scaffold O=C(NN=Cc1ccccc1)c1cc[nH]n1](/scaffold/UEBQXDJERRSAMF-UHFFFAOYSA-N/structure.svg)
O=C(NN=Cc1ccccc1)c1cc[nH]n129 chemicals
O=C(CCc1ccccc1)Nc1nncs125 chemicals
S=C(NCc1ccco1)Nc1ccccc124 chemicals![Scaffold O=C(CSc1nnn[nH]1)Nc1ccccc1](/scaffold/FDRBWKCIVMSABC-UHFFFAOYSA-N/structure.svg)
O=C(CSc1nnn[nH]1)Nc1ccccc122 chemicals![Scaffold O=C(CSc1ncc[nH]1)Nc1ccccc1](/scaffold/OMOYRSCPUXAYDW-UHFFFAOYSA-N/structure.svg)
O=C(CSc1ncc[nH]1)Nc1ccccc121 chemicals
O=C(NC(=S)Nc1ccccc1)c1ccco121 chemicals
O=C(CCN1CCCC1)Nc1ccccc120 chemicals
O=C(NN=Cc1ccco1)c1ccccc119 chemicals