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Murcko scaffold

Ring system with 3 rings and 34 atoms

7 chemicals on CompoundList share this ring system.

Rings
3
Scaffold atoms
34
Chemicals
7
With full pages
0
Scaffold SMILES

O=C(CCc1c[nH]c2ccccc12)NCC(=O)NCC(=O)NCC(=O)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(CCc1c[nH]c2ccccc12)NCC(=O)NCC(=O)NCC(=O)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 7 of 7 chemicals

SQ 31429 chemical structure, C68H112N22O13, CAS 111394-11-7
SQ 31429
CAS 111394-11-7C68H112N22O13
H-Lys-arg-arg-trp-lys-lys-asn-phe-ile-ala-val-NH2 chemical structure, C68H113N23O12, CAS 198694-74-5
H-Lys-arg-arg-trp-lys-lys-asn-phe-ile-ala-val-NH2
CAS 198694-74-5C68H113N23O12
Palmitoyl(3)-cysteinyl-seryl-(HIV-2(593-603)cyclic disulfide) chemical structure, C111H183N19O23S3, CAS 119290-15-2
Palmitoyl(3)-cysteinyl-seryl-(HIV-2(593-603)cyclic disulfide)
CAS 119290-15-2C111H183N19O23S3
L-Tryptophylglycylglycylglycyl-L-tyrosine chemical structure, C26H30N6O7, CAS 15035-26-4
L-Tryptophylglycylglycylglycyl-L-tyrosine
CAS 15035-26-4C26H30N6O7
L-Tryptophyl-L-isoleucyl-L-threonyl-L-alanyl-L-tyrosine chemical structure, C33H44N6O8, CAS 919298-50-3
L-Tryptophyl-L-isoleucyl-L-threonyl-L-alanyl-L-tyrosine
CAS 919298-50-3C33H44N6O8
Tridecaptin A(sup alpha) chemical structure, C73H115N17O20, CAS 67922-28-5
Tridecaptin A(sup alpha)
CAS 67922-28-5C73H115N17O20
Tridecaptin C chemical structure, C74H117N17O21, CAS 67922-31-0
Tridecaptin C
CAS 67922-31-0C74H117N17O21