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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL19274
CHEMBL19274
Compound Name
ChEMBL Synonyms
Max Phase 0
Trade Names
Molecular Formula C20H14N4O2

Additional synonyms for CHEMBL19274 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CC(=O)NC1N2C(=O)c3ccccc3N=C2c4nc5ccccc5cc14
Standard InChI InChI=1S/C20H14N4O2/c1-11(25)21-18-14-10-12-6-2-4-8-15(12)22 ...
Download InChI
Standard InChI Key UXTGICMRNGSLRO-UHFFFAOYSA-N

Sources

  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL19274

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
342.4 342.1117 2.46 1 74.66 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
4 1 0 6 1 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
12.84 .91 1.35 1.35 3 26 0.74

Structural Alerts

There are no structural alerts for CHEMBL19274

Compound Cross References

ChemSpider ChemSpider:UXTGICMRNGSLRO-UHFFFAOYSA-N

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL19274



PubChem 9997468
PubChem: Thomson Pharma 14976933

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