PALOSURAN

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: ULD9ZKE457

Structure
InChI Key WYJCYXOCHXWTHG-UHFFFAOYSA-N
Smile Cc1cc(NC(=O)NCCN2CCC(O)(Cc3ccccc3)CC2)c2ccccc2n1
InChI
InChI=1S/C25H30N4O2/c1-19-17-23(21-9-5-6-10-22(21)27-19)28-24(30)26-13-16-29-14-11-25(31,12-15-29)18-20-7-3-2-4-8-20/h2-10,17,31H,11-16,18H2,1H3,(H2,26,27,28,30)

Physicochemical Descriptors

Property Name Value
Molecular Formula C25H30N4O2
Molecular Weight 418.54
AlogP 3.73
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 6.0
Polar Surface Area 77.49
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 31.0

Pharmacology

Action Mechanism of Action Reference
ANTAGONIST Urotensin II receptor antagonist PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Membrane receptor Family A G protein-coupled receptor Peptide receptor (family A GPCR) Short peptide receptor (family A GPCR) Neuropeptide receptor
- 39-320 - 41 -

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL567303
EPA CompTox DTXSID00202406
FDA SRS ULD9ZKE457
Guide to Pharmacology 3516
PubChem 10173280
SureChEMBL SCHEMBL1363480
ZINC ZINC000034375693
CONTENTS