Ligand id: 7529

Name: SGC-CBP30

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 8
Topological polar surface area 65.55
Molecular weight 508.22
XLogP 5
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Gallenkamp D, Gelato KA, Haendler B, Weinmann H. (2014)
Bromodomains and their pharmacological inhibitors.
ChemMedChem, 9 (3): 438-64. [PMID:24497428]
2. Hammitzsch A, Tallant C, Fedorov O, O'Mahony A, Brennan PE, Hay DA, Martinez FO, Al-Mossawi MH, de Wit J, Vecellio M et al.. (2015)
CBP30, a selective CBP/p300 bromodomain inhibitor, suppresses human Th17 responses.
Proc. Natl. Acad. Sci. U.S.A., 112 (34): 10768-73. [PMID:26261308]