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Murcko scaffold

Ring system with 2 rings and 20 atoms

40 chemicals on CompoundList share this ring system.

Rings
2
Scaffold atoms
20
Chemicals
40
With full pages
3
Scaffold SMILES

O=C(CNC(=O)C1CCCN1)NCCc1ccccc1

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=C(CNC(=O)C1CCCN1)NCCc1ccccc1

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 40 of 40 chemicals

Asp-Pro-Gln-Tyr-Ile-Gln-Ser-Arg chemical structure, C43H67N13O15, CAS 130007-44-2
Asp-Pro-Gln-Tyr-Ile-Gln-Ser-Arg
CAS 130007-44-2C43H67N13O15
Cyclo(methyltyrosyl-isoleucyl-prolyl-leucyl) chemical structure, C27H40N4O5, CAS 68857-04-5
Cyclo(methyltyrosyl-isoleucyl-prolyl-leucyl)
CAS 68857-04-5C27H40N4O5
Cystinyl-aspartyl-prolyl-glycyl-tyrosyl-isoleucyl-glycyl-seryl-arginyl-NH2 chemical structure, C40H63N13O13S, CAS 110590-61-9
Cystinyl-aspartyl-prolyl-glycyl-tyrosyl-isoleucyl-glycyl-seryl-arginyl-NH2
CAS 110590-61-9C40H63N13O13S
L-Leucine, L-arginyl-L-arginyl-L-leucyl-L-prolyl-L-isoleucyl-L-phenylalanyl-L-seryl-L-arginyl- chemical structure, C53H92N18O11, CAS 183203-42-1
L-Leucine, L-arginyl-L-arginyl-L-leucyl-L-prolyl-L-isoleucyl-L-phenylalanyl-L-seryl-L-arginyl-
CAS 183203-42-1C53H92N18O11
Peptide II (aplysia) chemical structure, C56H88N14O20S, CAS 101849-76-7
Peptide II (aplysia)
CAS 101849-76-7C56H88N14O20S
Cys-Asp-Pro-Gly-Tyr-Ile-Gly-Ser-Arg chemical structure, C40H62N12O14S, CAS 110590-60-8
Cys-Asp-Pro-Gly-Tyr-Ile-Gly-Ser-Arg
CAS 110590-60-8C40H62N12O14S
Thymoctonan chemical structure, C43H67N9O13, CAS 107489-37-2
Thymoctonan
CAS 107489-37-2C43H67N9O13
L-Alanine, L-seryl-L-prolyl-L-alanyl-L-phenylalanyl-L-leucyl- chemical structure, C29H44N6O8, CAS 569349-98-0
L-Alanine, L-seryl-L-prolyl-L-alanyl-L-phenylalanyl-L-leucyl-
CAS 569349-98-0C29H44N6O8
H-Cys-Asn-Val-Val-Pro-Leu-Tyr(PO3H2)-Asp-Leu-Leu-Leu-Glu-OH chemical structure, C64H104N13O22PS, CAS 166664-90-0
H-Cys-Asn-Val-Val-Pro-Leu-Tyr(PO3H2)-Asp-Leu-Leu-Leu-Glu-OH
CAS 166664-90-0C64H104N13O22PS
L-Tyrosine, L-asparaginyl-L-prolyl-L-isoleucyl- chemical structure, C24H35N5O7, CAS 208183-74-8
L-Tyrosine, L-asparaginyl-L-prolyl-L-isoleucyl-
CAS 208183-74-8C24H35N5O7
L-Tyrosine, L-asparaginyl-L-prolyl-L-valyl- chemical structure, C23H33N5O7, CAS 663940-77-0
L-Tyrosine, L-asparaginyl-L-prolyl-L-valyl-
CAS 663940-77-0C23H33N5O7
L-Tyrosine, L-asparaginyl-L-prolyl-L-leucyl- chemical structure, C24H35N5O7, CAS 208183-73-7
L-Tyrosine, L-asparaginyl-L-prolyl-L-leucyl-
CAS 208183-73-7C24H35N5O7
Pancreatic Polypeptide (31-36), amide, human chemical structure, C36H61N13O8, CAS 74012-13-8
Pancreatic Polypeptide (31-36), amide, human
CAS 74012-13-8C36H61N13O8
Crebtide chemical structure, C73H129N29O19, CAS 149155-45-3
Crebtide
CAS 149155-45-3C73H129N29O19
L-Leucyl-L-threonyl-N~5~-(diaminomethylidene)-L-ornithyl-L-prolyl-N~5~-(diaminomethylidene)-L-ornithyl-L-tyrosine chemical structure, C36H60N12O9, CAS 192432-73-8
L-Leucyl-L-threonyl-N~5~-(diaminomethylidene)-L-ornithyl-L-prolyl-N~5~-(diaminomethylidene)-L-ornithyl-L-tyrosine
CAS 192432-73-8C36H60N12O9
L-Tyrosinamide, L-threonyl-L-arginyl-L-prolyl-L-arginyl- chemical structure, C30H50N12O7, CAS 111727-68-5
L-Tyrosinamide, L-threonyl-L-arginyl-L-prolyl-L-arginyl-
CAS 111727-68-5C30H50N12O7
H-Gly-Ser-Pro-Met-Phe-Val-NH2 chemical structure, C29H45N7O7S, CAS 115525-98-9
H-Gly-Ser-Pro-Met-Phe-Val-NH2
CAS 115525-98-9C29H45N7O7S
L-Isoleucyl-L-prolyl-L-isoleucyl-L-tyrosyl-L-glutamic acid chemical structure, C31H47N5O9, CAS 210978-17-9
L-Isoleucyl-L-prolyl-L-isoleucyl-L-tyrosyl-L-glutamic acid
CAS 210978-17-9C31H47N5O9
N~5~-(Diaminomethylidene)-L-ornithyl-L-prolyl-L-valyl-L-phenylalanyl-L-valyl-L-seryl-N~5~-(diaminomethylidene)-L-ornithine chemical structure, C39H65N13O9, CAS 377755-89-0
N~5~-(Diaminomethylidene)-L-ornithyl-L-prolyl-L-valyl-L-phenylalanyl-L-valyl-L-seryl-N~5~-(diaminomethylidene)-L-ornithine
CAS 377755-89-0C39H65N13O9
N~5~-(Diaminomethylidene)-L-ornithylglycyl-L-prolyl-L-alanyl-L-phenylalanyl-N~5~-(diaminomethylidene)-L-ornithyl-N~5~-(diaminomethylidene)-L-ornithine chemical structure, C37H62N16O8, CAS 491833-11-5
N~5~-(Diaminomethylidene)-L-ornithylglycyl-L-prolyl-L-alanyl-L-phenylalanyl-N~5~-(diaminomethylidene)-L-ornithyl-N~5~-(diaminomethylidene)-L-ornithine
CAS 491833-11-5C37H62N16O8
Glycyl-L-prolyl-L-alanyl-L-phenylalanine chemical structure, C19H26N4O5, CAS 438573-01-4
Glycyl-L-prolyl-L-alanyl-L-phenylalanine
CAS 438573-01-4C19H26N4O5
L-Glutaminyl-L-prolyl-N~5~-(diaminomethylidene)-L-ornithyl-L-phenylalanyl-L-threonyl-L-leucyl-L-serine chemical structure, C38H61N11O11, CAS 628715-85-5
L-Glutaminyl-L-prolyl-N~5~-(diaminomethylidene)-L-ornithyl-L-phenylalanyl-L-threonyl-L-leucyl-L-serine
CAS 628715-85-5C38H61N11O11
L-Threonyl-L-lysylglycyl-L-prolyl-N~5~-(diaminomethylidene)-L-ornithyl-L-tyrosyl-L-seryl-L-leucine chemical structure, C41H68N12O12, CAS 628715-84-4
L-Threonyl-L-lysylglycyl-L-prolyl-N~5~-(diaminomethylidene)-L-ornithyl-L-tyrosyl-L-seryl-L-leucine
CAS 628715-84-4C41H68N12O12
Glycyl-L-alanyl-L-prolyl-L-valyl-L-tyrosyl-L-leucyl-L-threonine chemical structure, C34H53N7O10, CAS 627863-51-8
Glycyl-L-alanyl-L-prolyl-L-valyl-L-tyrosyl-L-leucyl-L-threonine
CAS 627863-51-8C34H53N7O10