Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 8163770L8P

Structure

InChI Key MDBNTXARNGRHEV-UHFFFAOYSA-N
Smile Nc1c(Cl)cc(-c2nn(C3CCN(CCc4ccccc4)CC3)c(=O)o2)c2c1OCCO2
InChI
InChI=1S/C23H25ClN4O4/c24-18-14-17(20-21(19(18)25)31-13-12-30-20)22-26-28(23(29)32-22)16-7-10-27(11-8-16)9-6-15-4-2-1-3-5-15/h1-5,14,16H,6-13,25H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C23H25ClN4O4
Molecular Weight 456.93
AlogP 3.39
Hydrogen Bond Acceptor 8.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 5.0
Polar Surface Area 95.75
Molecular species BASE
Aromatic Rings 3.0
Heavy Atoms 32.0

Pharmacology

Action Mechanism of Action Reference
PARTIAL AGONIST Serotonin 4 (5-HT4) receptor partial agonist PubMed Wikipedia

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL2027925
FDA SRS 8163770L8P
Guide to Pharmacology 29
PubChem 9805719
SureChEMBL SCHEMBL4707724
ZINC ZINC000000603773