estradiol disulfate

Ligand id: 8802

Name: estradiol disulfate

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 4
Topological polar surface area 143.96
Molecular weight 432.09
XLogP 2.05
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Zelcer N, Reid G, Wielinga P, Kuil A, van der Heijden I, Schuetz JD, Borst P. (2003)
Steroid and bile acid conjugates are substrates of human multidrug-resistance protein (MRP) 4 (ATP-binding cassette C4).
Biochem. J., 371 (Pt 2): 361-7. [PMID:12523936]