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Murcko scaffold

Ring system with 7 rings and 36 atoms

8 chemicals on CompoundList share this ring system.

Rings
7
Scaffold atoms
36
Chemicals
8
With full pages
3
Scaffold SMILES

O=C(NC(Cc1c[nH]c2ccccc12)C(=O)NCCc1ccccc1)OC1C2CC3CC(C2)CC1C3

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(NC(Cc1c[nH]c2ccccc12)C(=O)NCCc1ccccc1)OC1C2CC3CC(C2)CC1C3

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 8 of 8 chemicals

PD 134308 chemical structure, C42H59N5O11, CAS 130404-91-0
PD 134308
CAS 130404-91-0C42H59N5O11
Ci-988 chemical structure, C35H42N4O6, CAS 130332-27-3
Ci-988
CAS 130332-27-3C35H42N4O6
PD 140376 chemical structure, C33H40N4O5, CAS 149027-97-4
PD 140376
CAS 149027-97-4C33H40N4O5
PD 136450 chemical structure, C35H40N4O6, CAS 139067-52-0
PD 136450
CAS 139067-52-0C35H40N4O6
PD-135666 chemical structure, C33H39N3O5, CAS 134557-41-8
PD-135666
CAS 134557-41-8C33H39N3O5
PD-140548 chemical structure, C33H39N3O5, CAS 140677-01-6
PD-140548
CAS 140677-01-6C33H39N3O5
(3S)-3-[[(2R)-2-(2-Adamantyloxycarbonylamino)-3-(1H-indol-3-yl)-2-methylpropanoyl]amino]-4-(4-fluorophenyl)butanoic acid chemical structure, C33H38FN3O5, CAS 181941-32-2
(3S)-3-[[(2R)-2-(2-Adamantyloxycarbonylamino)-3-(1H-indol-3-yl)-2-methylpropanoyl]amino]-4-(4-fluorophenyl)butanoic acid
CAS 181941-32-2C33H38FN3O5
N-(N-((2-Adamantyloxy)carbonyl)-alpha-methyltryptophyl)-N-(2-(4-chlorophenyl)ethyl)glycine chemical structure, C33H38ClN3O5, CAS 150871-05-9
N-(N-((2-Adamantyloxy)carbonyl)-alpha-methyltryptophyl)-N-(2-(4-chlorophenyl)ethyl)glycine
CAS 150871-05-9C33H38ClN3O5