IMARADENANT

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 770140J08A

Structure
InChI Key NCWQLHHDGDXIJN-UHFFFAOYSA-N
Smile Cc1cc(-c2nnc(N)nc2-c2ccc(F)cc2)cc(Cl)n1
InChI
InChI=1S/C15H11ClFN5/c1-8-6-10(7-12(16)19-8)14-13(20-15(18)22-21-14)9-2-4-11(17)5-3-9/h2-7H,1H3,(H2,18,20,22)

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H11ClFN5
Molecular Weight 315.74
AlogP 3.28
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 2.0
Polar Surface Area 77.58
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 22.0

Pharmacology

Action Mechanism of Action Reference
ANTAGONIST Adenosine A2a receptor antagonist Other PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Prostatic Neoplasms, Castration-Resistant 2 D064129 ClinicalTrials
Neoplasms 1 D009369 ClinicalTrials
Carcinoma, Non-Small-Cell Lung 1 D002289 ClinicalTrials

Cross References

Resources Reference
ChEMBL CHEMBL4594442
FDA SRS 770140J08A
Guide to Pharmacology 11153
PDB F9Q
PubChem 86676119
SureChEMBL SCHEMBL2320714
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