ChEMBL logo

ChEMBL

spacer
ChEMBL Statistics
  Loading Statistics...
spacer

Compound Report Card

Compound Name and Classification

Compound ID CHEMBL381055
CHEMBL381055
Compound Name
ChEMBL Synonyms ADX-47273
Max Phase 0
Trade Names
Molecular Formula C20H17F2N3O2

Additional synonyms for CHEMBL381055 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES Fc1ccc(cc1)C(=O)N2CCC[C@@H](C2)c3onc(n3)c4ccc(F)cc4
Standard InChI InChI=1S/C20H17F2N3O2/c21-16-7-3-13(4-8-16)18-23-19(27-24-18 ...
Download InChI
Standard InChI Key VXQCCZHCFBHTTD-HNNXBMFYSA-N

Clinical Trials for Compound

Number of clinical trials registered at clinicaltrials.gov

Alternate Forms of Compound in ChEMBL


CHEMBL381055

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Ro5 Violations #Rotatable Bonds Ro3 Med Chem Friendly Molecular Species
369.4 369.1289 3.58 0 3 No Yes NEUTRAL


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms Num Alerts QED Weighted
- - 3.64 3.64 3 27 0 0.71

Compound Cross References

ChemSpider ChemSpider:VXQCCZHCFBHTTD-HNNXBMFYSA-N
Wikipedia ADX-47273

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL381055



IUPHAR 1420
PubChem: Drugs of the Future 99431602
ZINC ZINC09576498
FDA SRS 4C4P7L0W63
SureChem SureCN193680
Selleck adx-47273
PubChem: Thomson Pharma 16477027
PubChem 11383075

UniChem REST Service Call: https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/VXQCCZHCFBHTTD-HNNXBMFYSA-N spacer
spacer