4-Amino-2-chlorophenol

AlkaPlorer ID: AK284565

Synonym: None

IUPAC Name: 4-amino-2-chlorophenol

Structure

SMILES: NC1=CC(Cl)=C(O)C=C1

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InChI: InChI=1S/C6H6ClNO/c7-5-3-4(8)1-2-6(5)9/h1-3,9H,8H2

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InChIKey: ZYZQSCWSPFLAFM-UHFFFAOYSA-N

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Reference

PubChem CID: 77578

CAS: 3964-52-1

Source

Properties Information

Molecule Weight: 143.573

TPSA: 46.25

MolLogP: 1.6278

Number of H-Donors: 2

Number of H-Acceptors: 2

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
Homo sapiens Carbonic anhydrase I Ki 57800.0 nM 10.1016/j.bmc.2017.03.026
Homo sapiens Carbonic anhydrase II Ki 57500.0 nM 10.1016/j.bmc.2017.03.026
None Unchecked Ki 100000.0 nM 10.1016/j.bmc.2017.03.026
None Unchecked Ratio Ki 0.58 None 10.1016/j.bmc.2017.03.026

Metabolism Information