mandelic acid 🐶 Veterinary Use | Indications/Contra | FAERs-F | FAERs-M | Orange Bk | PK/Tox | Related Drugs | BioActivity |

Stem definitionDrug idCAS RN
1629 90-64-2

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • mandelic acid
  • 2-Phenylglycolic acid
  • amygdalic acid
  • paramandelic acid
  • phenylglycolic acid
  • phenylhydroxyacetic acid
  • Molecular weight: 152.15
  • Formula: C8H8O3
  • CLOGP: 0.50
  • LIPINSKI: 0
  • HAC: 3
  • HDO: 2
  • TPSA: 57.53
  • ALOGS: -0.96
  • ROTB: 2

Drug dosage:

DoseUnitRoute
12 g O

ADMET properties:

None

Predicted pharmacokinetic/toxicological properties (PK-AZ):

PropertyDescriptionValueUnitConfidenceSimilarity
kinase-safety-class ACVR2A,ACVR2B,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK4,CDK5,CDK9,DDR1,DYRK1B,EGFR,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,GSK3B,ITK,JAK1,JAK2,MAP2K6,MAP3K21,MAP3K7,MAPK12,MAPK7,MAPKAPK2,MTOR,NTRK2,PDK1,PDK2,PDK4,PIK3CB,PIM2,PRKDC,SIK2,SIK3,STK33,SYK,TEK,TGFBR1,TTK,ZAP70 45
kinase-selectivity-class ACVR2B,AXL,BRAF,CDK9,EIF2AK3,EPHB4,GRK2,MAP2K6,MAPK7,PDK4,STK33,TEK,TGFBR1 13
pfas-class PFAS structural alert (1 = True, 0 = False) 0

Approvals:

None

FDA Adverse Event Reporting System (Female)

None

FDA Adverse Event Reporting System (Male)

None

FDA Adverse Event Reporting System (Geriatric)

None

FDA Adverse Event Reporting System (Pediatric)

None

Pharmacologic Action:

SourceCodeDescription
ATC B05CA06 BLOOD AND BLOOD FORMING ORGANS
BLOOD SUBSTITUTES AND PERFUSION SOLUTIONS
IRRIGATING SOLUTIONS
Antiinfectives
ATC J01XX06 ANTIINFECTIVES FOR SYSTEMIC USE
ANTIBACTERIALS FOR SYSTEMIC USE
OTHER ANTIBACTERIALS
Other antibacterials
CHEBI has role CHEBI:33282 antibacterial agent
CHEBI has role CHEBI:76967 human xenobiotic metabolite

Related Drugs by ATC class:

B05CA Antiinfectives 8 drugs
cetylpyridiniumchlorhexidineethacridineneomycinnitrofurazonenoxytiolinsulfamethizoletaurolidine
J01XX Other antibacterials 12 drugs
bacitracinclofoctoldaptomycinfosfomycingepotidacinlefamulinlinezolidmethenaminenitroxolinespectinomycintedizolid phosphatexibornol

Drug Use | Suggest Off label Use Form| |View source of the data|

DiseaseRelationSNOMED_IDDOID
Urinary tract infectious disease indication 68566005




🐶 Veterinary Drug Use

None

🐶 Veterinary products

None

Acid dissociation constants calculated using MoKa v3.0.0

Dissociation levelDissociation constantType (acidic/basic)
pKa1 3.44 acidic
pKa2 13.02 acidic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

None

External reference:

IDSource
C0065636 UMLSCUI
CHEMBL1609 ChEMBL_ID
DB13218 DRUGBANK_ID
1292 PUBCHEM_CID
C037938 MESH_SUPPLEMENTAL_RECORD_UI
NH496X0UJX UNII
29256 RXNORM
003994 NDDF
350156008 SNOMEDCT_US
395778000 SNOMEDCT_US
786805006 SNOMEDCT_US

Pharmaceutical products:

None