5α-pregnan-3α-ol-20-one

Ligand id: 4108

Name: 5α-pregnan-3α-ol-20-one

Structure and Physico-chemical Properties

2D Structure
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Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 1
Topological polar surface area 37.3
Molecular weight 318.26
XLogP 6.1
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

References
1. Meltzer-Brody S, Colquhoun H, Riesenberg R, Epperson CN, Deligiannidis KM, Rubinow DR, Li H, Sankoh AJ, Clemson C, Schacterle A et al.. (2018)
Brexanolone injection in post-partum depression: two multicentre, double-blind, randomised, placebo-controlled, phase 3 trials.
Lancet, 392 (10152): 1058-1070. [PMID:30177236]
2. Melón L, Hammond R, Lewis M, Maguire J. (2018)
A Novel, Synthetic, Neuroactive Steroid Is Effective at Decreasing Depression-Like Behaviors and Improving Maternal Care in Preclinical Models of Postpartum Depression.
Front Endocrinol (Lausanne), 9: 703. [PMID:30532739]
3. Wilkinson ST, Sanacora G. (2019)
A new generation of antidepressants: an update on the pharmaceutical pipeline for novel and rapid-acting therapeutics in mood disorders based on glutamate/GABA neurotransmitter systems.
Drug Discov. Today, 24 (2): 606-615. [PMID:30447328]