Ligand id: 7591

Name: butorphanol

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 43.7
Molecular weight 327.22
XLogP 3.66
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Fulton BS, Knapp BI, Bidlack JM, Neumeyer JL. (2008)
Synthesis and pharmacological evaluation of hydrophobic esters and ethers of butorphanol at opioid receptors.
Bioorg. Med. Chem. Lett., 18 (16): 4474-6. [PMID:18674902]
2. Gear RW, Miaskowski C, Gordon NC, Paul SM, Heller PH, Levine JD. (1999)
The kappa opioid nalbuphine produces gender- and dose-dependent analgesia and antianalgesia in patients with postoperative pain.
Pain, 83 (2): 339-45. [PMID:10534607]