Details of the Drug

General Information of Drug (ID: DMDQL24)

• Drug Name: 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid
• Synonyms: 4,5,6,7-Tetrahydro-1H-indazole-3-carboxylic acid; 6076-13-7; 4,5,6,7-Tetrahydro-2H-indazole-3-carboxylic acid; 714255-28-4; CHEMBL338405; LWXNHFZBFJMHGU-UHFFFAOYSA-N; 2H-Indazole-3-carboxylicacid, 4,5,6,7-tetrahydro-; 1H-Indazole-3-carboxylic acid, 4,5,6,7-tetrahydro-; 2H-Indazole-3-carboxylic acid, 4,5,6,7-tetrahydro-; 1H-4,5,6,7-tetrahydroindazole-3-carboxylic acid; MLS000074645; AC1LDJ0A; ChemDiv2_003320; Oprea1_089683; AC1Q748E; SCHEMBL1808017; AC1Q72Q0; CTK2H6469; DTXSID00349466; MolPort-000-767-792; MolPort-000-149-162

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); 166.18
  Logarithm of the Partition Coefficient (xlogp); 1.3
  Rotatable Bond Count (rotbonds); 1
  Hydrogen Bond Donor Count (hbonddonor); 2
  Hydrogen Bond Acceptor Count (hbondacc); 3
• Chemical Identifiers:
  Formula: C8H10N2O2
  IUPAC Name: 4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid
  Canonical SMILES: C1CCC2=C(C1)C(=NN2)C(=O)O
  InChI: InChI=1S/C8H10N2O2/c11-8(12)7-5-3-1-2-4-6(5)9-10-7/h1-4H2,(H,9,10)(H,11,12)
  InChIKey: LWXNHFZBFJMHGU-UHFFFAOYSA-N
• Cross-matching ID:
  PubChem CID: 648852
  CAS Number: 6076-13-7
  TTD ID: D06UZK

Molecular Interaction Atlas of This Drug

Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Nicotinic acid receptor (HCAR2)	TTWNV8U	HCAR2_HUMAN	Inhibitor	[1]

References

• [1] Pyrazole derivatives as partial agonists for the nicotinic acid receptor. J Med Chem. 2003 Aug 28;46(18):3945-51.