Murcko scaffold
Ring system with 3 rings and 22 atoms
72 chemicals on CompoundList share this ring system.
- Rings
- 3
- Scaffold atoms
- 22
- Chemicals
- 72
- With full pages
- 3
Scaffold SMILES
O=C(CCc1ccccc1)NCCc1c[nH]c2ccccc12
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.
![Murcko scaffold O=C(CCc1ccccc1)NCCc1c[nH]c2ccccc12](/scaffold/FMDRLRDPERCKFE-UHFFFAOYSA-N/structure.svg)
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 72 chemicals
L-Threonine, N-(N2-(N-(1-oxo-3-phenylpropyl)-D-tryptophyl)-L-lysyl)-
CAS 125757-85-9C30H39N5O6
Phenylalanyltryptophan
CAS 24587-41-5C20H21N3O3
Somatostatin(7-10)
CAS 91853-94-0C30H40N6O6
Eel intestinal pentapeptide
CAS 138149-60-7C32H42N8O7
![Ethyl 4-[bis(2-chloroethyl)amino]-N-formylphenylalanyltryptophanate chemical structure, C27H32Cl2N4O4, CAS 7409-38-3](/s/OSKDCUMOFWLRQB-UHFFFAOYSA-N.svg)
Ethyl 4-[bis(2-chloroethyl)amino]-N-formylphenylalanyltryptophanate
CAS 7409-38-3C27H32Cl2N4O4
![N-[2-(6-Methoxy-1H-indol-3-yl)ethyl]-3-phenylpropanamide chemical structure, C20H22N2O2, CAS 775290-93-2](/s/VEDDCERSOBHEMW-UHFFFAOYSA-N.svg)
N-[2-(6-Methoxy-1H-indol-3-yl)ethyl]-3-phenylpropanamide
CAS 775290-93-2C20H22N2O2
![N-[2-(5-Chloro-1H-indol-3-yl)ethyl]-3-phenylpropanamide chemical structure, C19H19ClN2O, CAS 775290-34-1](/s/JJMJTABRFZJMOA-UHFFFAOYSA-N.svg)
N-[2-(5-Chloro-1H-indol-3-yl)ethyl]-3-phenylpropanamide
CAS 775290-34-1C19H19ClN2O
![N-[2-(5-Methyl-1H-indol-3-yl)ethyl]-3-phenylpropanamide chemical structure, C20H22N2O, CAS 775289-76-4](/s/VAMNZXNDWBMUEU-UHFFFAOYSA-N.svg)
N-[2-(5-Methyl-1H-indol-3-yl)ethyl]-3-phenylpropanamide
CAS 775289-76-4C20H22N2O
D-Phenylalanyl-D-tryptophan
CAS 58607-70-8C20H21N3O3
D-Tryptophan, N-L-phenylalanyl-
CAS 66421-20-3C20H21N3O3
D-Phenylalanyl-L-tryptophan
CAS 76327-05-4C20H21N3O3
D-Tryptophan, N-D-phenylalanyl-, methyl ester, monohydrochloride
CAS 76327-08-7C21H24ClN3O3
D-Tryptophan, N-(N-acetyl-D-phenylalanyl)-, methyl ester
CAS 76327-09-8C23H25N3O4
D-Tryptophan, N-(N-acetyl-D-phenylalanyl)-
CAS 76327-10-1C22H23N3O4
D-Tryptophanamide, N(sup alpha)-D-phenylalanyl-
CAS 76327-11-2C20H22N4O2
D-Tryptophanamide, N-acetyl-D-phenylalanyl-
CAS 76340-03-9C22H24N4O3
delta Sleep-inducing peptide, N-tyr-
CAS 65908-45-4C44H57N11O17
MK-2206 (dihydrochloride)
CAS 142479-13-8C54H85N19O13
Ac-Phe-Trp-OH
CAS 19240-41-6C22H23N3O4
H-Tyr-Trp-NH2
CAS 165192-28-9C20H22N4O3
Tyrosyl-tryptophan
CAS 60815-41-0C20H21N3O4
H-Arg-Tyr-Trp-Met-Ser-OH
CAS 244181-62-2C34H47N9O8S
Glycine, L-threonyl-L-tyrosyl-L-tryptophyl-L-leucyl-
CAS 399035-39-3C32H42N6O8
L-Tryptophan, L-arginyl-L-cysteinyl-L-cysteinyl-L-tyrosyl-
CAS 383413-56-7C32H43N9O7S2
- Glycine, L-seryl-L-phenylalanyl-L-tryptophyl-L-isoleucyl-577724-30-2C31H40N6O7
- Glycine, L-seryl-L-tyrosyl-L-tryptophyl-L-isoleucyl-351881-10-2C31H40N6O8
- Glycine, L-asparaginyl-L-tyrosyl-L-tryptophyl-L-isoleucyl-204847-53-0C32H41N7O8
- H-Ser-Tyr-Trp-Met-Gln-OH227026-64-4C33H43N7O9S
- L-Asparagine, L-asparaginyl-L-tyrosyl-L-tryptophyl-L-methionyl-733021-30-2C33H42N8O9S
- L-Asparagine, L-seryl-L-tyrosyl-L-tryptophyl-L-isoleucyl-708259-73-8C33H43N7O9
- Methyl acetyl-L-phenylalanyl-L-tryptophanate157377-51-0C23H25N3O4
- L-Phenylalanyl-L-tryptophyl-L-valyl-L-aspartic acid845509-90-2C29H35N5O7
- N-[2-(5-Chloro-1H-indol-3-yl)ethyl]-3-(3,4-dimethoxyphenyl)propanamide929809-71-2C21H23ClN2O3
- N-[2-(5-Methoxy-1H-indol-3-yl)ethyl]-3-(4-methoxyphenyl)propanamide892471-89-5C21H24N2O3
- 3-(3,4-Dimethoxyphenyl)-N-[2-(5-fluoro-1H-indol-3-yl)ethyl]propanamide929866-02-4C21H23FN2O3
- N(beta)-Phenylpropionyltryptophan74717-58-1C20H20N2O3
- Xenortide B1034707-79-3C27H36N4O2
- L-Tyrosyl-D-tryptophan22032-67-3C20H21N3O4
- L-Threonyl-L-tyrosyl-L-tryptophyl-L-isoleucylglycine637756-64-0C32H42N6O8
- N-{2-[(2S)-2-Aminobutanoyl]hydrazinecarbonyl}-L-phenylalanyl-L-tryptophanamide801297-79-0C25H31N7O4
- N-(3-Phenylpropanoyl)-D-tryptophan87579-19-9C20H20N2O3
- L-Seryl-L-tyrosyl-L-tryptophyl-L-isoleucyl-L-glutamic acid190436-15-8C34H44N6O10
- L-Isoleucyl-L-alanyl-L-tyrosyl-L-tryptophylglycine143313-25-1C31H40N6O7
- N~5~-(Diaminomethylidene)-L-ornithylglycyl-L-tyrosyl-L-tryptophan189073-46-9C28H36N8O6
- L-Cysteinyl-L-phenylalanyl-L-tryptophyl-L-lysyl-L-threonyl-L-cysteine442685-60-1C36H50N8O8S2
- N~5~-(Diaminomethylidene)-L-ornithyl-L-tyrosyl-L-tryptophyl-L-isoleucyl-L-glutamic acid494766-02-8C37H51N9O9
- L-Seryl-L-tyrosyl-L-tryptophyl-L-isoleucyl-L-alanine554399-95-0C32H42N6O8
- L-Tyrosyl-L-tryptophyl-L-threonyl-L-aspartic acid524729-88-2C28H33N5O9
Related scaffolds
Same ring framework with different atoms or bond orders
O=C(CCn1nnc2ccccc21)NN=Cc1ccccc130 chemicals![Scaffold O=C(C=Cc1ccccc1)NCCc1c[nH]c2ccccc12](/scaffold/YSNGDZDGGGVGHU-UHFFFAOYSA-N/structure.svg)
O=C(C=Cc1ccccc1)NCCc1c[nH]c2ccccc1215 chemicals
O=C(CCn1cnc2ccccc21)NN=Cc1ccccc111 chemicals![Scaffold O=C(NN=Cc1c[nH]c2ccccc12)C(=O)Nc1ccccc1](/scaffold/XHWXFANOHIMKIW-UHFFFAOYSA-N/structure.svg)
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O=C(COc1ccccc1)NN=Cc1c[nH]c2ccccc126 chemicalsOc1ccccc1](/scaffold/XKRKGYFXGJKVIE-UHFFFAOYSA-N/structure.svg)
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O=C(CNCCCc1ccccc1)N1CCC2CCCCC215 chemicals
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O=C(CCc1c[nH]c2ccccc12)NCCc1ccccc14 chemicals
O=C(CSc1nnc2ccccn12)NNC(=O)c1ccccc14 chemicals