Details of the Drug

General Information of Drug (ID: DM3R8OM)

• Drug Name: 3-CHLORO-2-(4-HYDROXYPHENYL)-2H-INDAZOL-5-OL
• Synonyms: 3-chloro-2-(4-hydroxyphenyl)-2H-indazol-5-ol; 848142-62-1; 3-chloro-2-(4-hydroxyphenyl)indazol-5-ol; CHEMBL180071; CTK2I5101; DTXSID40463812; Indazole-Cl, > ZINC13609473; AKOS030536245; DB07708; 2-(p-Hydroxyphenyl)-3-chloro-2H-indazole-5-ol; 2H-Indazol-5-ol, 3-chloro-2-(4-hydroxyphenyl)-

Indication

Disease Entry	ICD 11	Status	REF
Discovery agent	N.A.	Investigative	[1]

• Drug Type: Small molecular drug
• #Ro5 Violations (Lipinski): 0:
  Molecular Weight (mw); 260.67
  Logarithm of the Partition Coefficient (xlogp); 3.5
  Rotatable Bond Count (rotbonds); 1
  Hydrogen Bond Donor Count (hbonddonor); 2
  Hydrogen Bond Acceptor Count (hbondacc); 3
• Chemical Identifiers:
  Formula: C13H9ClN2O2
  IUPAC Name: 3-chloro-2-(4-hydroxyphenyl)indazol-5-ol
  Canonical SMILES: C1=CC(=CC=C1N2C(=C3C=C(C=CC3=N2)O)Cl)O
  InChI: InChI=1S/C13H9ClN2O2/c14-13-11-7-10(18)5-6-12(11)15-16(13)8-1-3-9(17)4-2-8/h1-7,17-18H
  InChIKey: ZNHQDSBJVFFIAK-UHFFFAOYSA-N
• Cross-matching ID:
  PubChem CID: 11368987
  CAS Number: 848142-62-1
  DrugBank ID: DB07708
  TTD ID: D01ZRX

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Estrogen receptor (ESR)	TTZAYWL	ESR1_HUMAN	Inhibitor	[1]

References

• [1] The Protein Data Bank. Nucleic Acids Res. 2000 Jan 1;28(1):235-42.