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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL143202
CHEMBL143202
Compound Name
ChEMBL Synonyms
Max Phase 0
Trade Names
Molecular Formula C14H20N2O

Additional synonyms for CHEMBL143202 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES CCN(CC)CCc1c[nH]c2cccc(O)c12
Standard InChI InChI=1S/C14H20N2O/c1-3-16(4-2)9-8-11-10-15-12-6-5-7-13(17)1 ...
Download InChI
Standard InChI Key OHHYMKDBKJPILO-UHFFFAOYSA-N

Structural Alerts

There are no structural alerts for CHEMBL143202

Alternate Forms of Compound in ChEMBL


CHEMBL143202

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
232.3 232.1576 2.97 5 39.26 BASE


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
2 2 0 3 2 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
9.83 10.45 2.47 -.27 2 17 0.83

Compound Cross References

ChemSpider ChemSpider:OHHYMKDBKJPILO-UHFFFAOYSA-N
Wikipedia 4-HO-DET

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL143202



BindingDB 50094675
DSSTox DTXSID60176755
FDA SRS 7E0BR15575
Nikkaji J1.077.418G
PubChem 9991554
PubChem: Thomson Pharma 14970279

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