SCH-486757

/static/temp/default.svg Search structure
Synonyms
Status
Molecule Category Free-form
UNII 2HV668N62T

Structure

InChI Key MQWMHMZNBGQNMT-XHNJZIHCSA-N
Smiles O[C@]1(c2ncccn2)C[C@H]2CC[C@@H](C1)N2C(c1ccccc1Cl)c1ccccc1Cl
InChI
InChI=1S/C24H23Cl2N3O/c25-20-8-3-1-6-18(20)22(19-7-2-4-9-21(19)26)29-16-10-11-17(29)15-24(30,14-16)23-27-12-5-13-28-23/h1-9,12-13,16-17,22,30H,10-11,14-15H2/t16-,17+,24-

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H23Cl2N3O
Molecular Weight 440.37
AlogP 5.39
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 49.25
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 30.0

Pharmacology

Mechanism of Action Action Reference
Nociceptin receptor agonist AGONIST PubMed

Target Conservation

Protein: Nociceptin receptor
Description: Nociceptin receptor
Organism : Homo sapiens
P41146 ENSG00000125510

Cross References

Resources Reference
ChEMBL CHEMBL4297427
DrugBank DB12782
FDA SRS 2HV668N62T
PubChem 11597355
CONTENTS