Ro 60-0175   Click here for help

GtoPdb Ligand ID: 166

Synonyms: Ro-600175 | Ro600175
Compound class: Synthetic organic
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 30.95
Molecular weight 226.07
XLogP 2.95
No. Lipinski's rules broken 0
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Canonical SMILES CC(Cn1ccc2c1cc(Cl)c(c2)F)N
Isomeric SMILES C[C@@H](Cn1ccc2c1cc(Cl)c(c2)F)N
InChI InChI=1S/C11H12ClFN2/c1-7(14)6-15-3-2-8-4-10(13)9(12)5-11(8)15/h2-5,7H,6,14H2,1H3/t7-/m0/s1
1. Kimura Y, Hatanaka K, Naitou Y, Maeno K, Shimada I, Koakutsu A, Wanibuchi F, Yamaguchi T. (2004)
Pharmacological profile of YM348, a novel, potent and orally active 5-HT2C receptor agonist.
Eur J Pharmacol, 483 (1): 37-43. [PMID:14709324]
2. Knight AR, Misra A, Quirk K, Benwell K, Revell D, Kennett G, Bickerdike M. (2004)
Pharmacological characterisation of the agonist radioligand binding site of 5-HT(2A), 5-HT(2B) and 5-HT(2C) receptors.
Naunyn Schmiedebergs Arch Pharmacol, 370 (2): 114-23. [PMID:15322733]