Synonyms:
Status: Approved (1979)
Entry Type: Small molecule
Molecule Category: UNKNOWN
ATC: N05AL06
UNII: S7064109UD

Structure

InChI Key RYJXBGGBZJGVQF-UHFFFAOYSA-N
Smile C=CCN1CCCC1CNC(=O)c1cc(S(N)(=O)=O)cc(OC)c1OC
InChI
InChI=1S/C17H25N3O5S/c1-4-7-20-8-5-6-12(20)11-19-17(21)14-9-13(26(18,22)23)10-15(24-2)16(14)25-3/h4,9-10,12H,1,5-8,11H2,2-3H3,(H,19,21)(H2,18,22,23)

Physicochemical Descriptors

Property Name Value
Molecular Formula C17H25N3O5S
Molecular Weight 383.47
AlogP 0.73
Hydrogen Bond Acceptor 6.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 8.0
Polar Surface Area 110.96
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 26.0

Pharmacology

Action Mechanism of Action Reference
ANTAGONIST Dopamine D2 receptor antagonist PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 135600
ChEMBL CHEMBL2105581
DrugBank DB13523
DrugCentral 2814
EPA CompTox DTXSID6046268
FDA SRS S7064109UD
PubChem 47979
SureChEMBL SCHEMBL237519