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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1574783
CHEMBL1574783
Compound Name
ChEMBL Synonyms
Max Phase 0
Trade Names
Molecular Formula C15H12ClFN2O2

Additional synonyms for CHEMBL1574783 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES Fc1ccc(CNC(=O)NC(=O)c2ccc(Cl)cc2)cc1
Standard InChI InChI=1S/C15H12ClFN2O2/c16-12-5-3-11(4-6-12)14(20)19-15(21)1 ...
Download InChI
Standard InChI Key ZRVAULYAUDNADC-UHFFFAOYSA-N

Sources

  • PubChem BioAssays

Alternate Forms of Compound in ChEMBL


CHEMBL1574783

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
306.7 306.0571 3.27 3 58.2 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
2 2 0 4 2 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
10.47 - 3.86 3.86 2 21 0.91

Structural Alerts

There are 1 structural alerts for CHEMBL1574783. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:ZRVAULYAUDNADC-UHFFFAOYSA-N
PubChem SID: 49821431

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1574783



eMolecules 2529872
Mcule MCULE-4274954223
MolPort MolPort-002-302-472
PubChem 6457051
ZINC ZINC000006700865

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