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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL2392915
CHEMBL2392915
Compound Name
ChEMBL Synonyms
Max Phase 0
Trade Names
Molecular Formula C28H27Cl2N5O

Additional synonyms for CHEMBL2392915 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES Cc1nc(nc(NC[C@H](NC(=O)CCCc2ccccc2)c3ccccc3)c1Cl)c4ccc(Cl)cn ...
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Standard InChI InChI=1S/C28H27Cl2N5O/c1-19-26(30)28(35-27(33-19)23-16-15-22 ...
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Standard InChI Key QZLKLWALIASERX-DEOSSOPVSA-N

Sources

  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL2392915

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
520.5 519.1593 6.45 10 79.8 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
5 2 2 6 2 2


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- 2.38 6.31 6.31 4 36 0.25

Structural Alerts

There are 1 structural alerts for CHEMBL2392915. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:QZLKLWALIASERX-DEOSSOPVSA-N

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL2392915



BindingDB 50435201
PubChem 71602527
PubChem: Thomson Pharma 163683651
ZINC ZINC000096271220

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