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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL376136
CHEMBL376136
Compound Name 3-AMINOPHENOL HYDROCHLORIDE
ChEMBL Synonyms 3-Aminophenol
Max Phase 0
Trade Names
Molecular Formula C6H8ClNO

Additional synonyms for CHEMBL376136 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES Cl.Nc1cccc(O)c1
Standard InChI InChI=1S/C6H7NO.ClH/c7-5-2-1-3-6(8)4-5;/h1-4,8H,7H2;1H
Standard InChI Key DCBCSMXGLXAXDM-UHFFFAOYSA-N

Structural Alerts

There are 3 structural alerts for CHEMBL376136. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL376136

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
109.1 109.0528 0.84 0 46.25 NEUTRAL


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


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
10.01 4.3 .61 .61 1 8 0.49

Compound Cross References

ChemSpider ChemSpider:DCBCSMXGLXAXDM-UHFFFAOYSA-N
Wikipedia 3-Aminophenol

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL376136



ACToR 51-81-0
eMolecules 6882860
FDA SRS NQM2XX7XPO
MolPort MolPort-023-279-299
PubChem 3045332 12231984
SureChEMBL SCHEMBL2475459

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