Synonyms:
Status: Phase 1
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 6QTJ9P2NYT

Structure

InChI Key YXFNPRHZMOGREC-UHFFFAOYSA-N
Smile Cc1nc(C)c(-c2ccc(C3CCC(CC(=O)O)CC3)cc2)nc1C(N)=O
InChI
InChI=1S/C21H25N3O3/c1-12-19(24-20(21(22)27)13(2)23-12)17-9-7-16(8-10-17)15-5-3-14(4-6-15)11-18(25)26/h7-10,14-15H,3-6,11H2,1-2H3,(H2,22,27)(H,25,26)

Physicochemical Descriptors

Property Name Value
Molecular Formula C21H25N3O3
Molecular Weight 367.45
AlogP 3.61
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 5.0
Polar Surface Area 106.17
Molecular species ACID
Aromatic Rings 2.0
Heavy Atoms 27.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Obesity 1 D009765 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL4297354
EPA CompTox DTXSID60655297
FDA SRS 6QTJ9P2NYT
PubChem 42636350
SureChEMBL SCHEMBL2252417
ZINC ZINC000043206395