Ligand id: 8891

Name: SGI-1027

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 4
Rotatable bonds 7
Topological polar surface area 117.85
Molecular weight 461.2
XLogP 4.18
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Valente S, Liu Y, Schnekenburger M, Zwergel C, Cosconati S, Gros C, Tardugno M, Labella D, Florean C, Minden S et al.. (2014)
Selective non-nucleoside inhibitors of human DNA methyltransferases active in cancer including in cancer stem cells.
J. Med. Chem., 57 (3): 701-13. [PMID:24387159]