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

Stem definitionDrug idCAS RN
diphenylmethyl piperazine derivatives 2679 83275-56-3

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • tiracizine
  • Molecular weight: 367.45
  • Formula: C21H25N3O3
  • CLOGP: 3.07
  • LIPINSKI: 0
  • HAC: 6
  • HDO: 1
  • TPSA: 61.88
  • ALOGS: -3.87
  • ROTB: 5

Drug dosage:

None

ADMET properties:

PropertyValueReference
BA (Bioavailability) 34 %

Predicted pharmacokinetic/toxicological properties (PK-AZ):

PropertyDescriptionValueUnitConfidenceSimilarity
azlogd74 LogD at pH 7.4 2.540 High 0.83
caco2-efflux Caco-2 efflux ratio (BA/AB) 0.480 High 0.83
caco2-intrinsic-papp Caco-2 intrinsic apparent permeability 35.400 10^-6 cm/s High 0.83
dh-clint Dog hepatocyte intrinsic clearance 56.364 uL/min/10^6 cells High 0.83
dppb Dog plasma protein binding (% unbound) 17.090 % High 0.83
fcs-ppb Fetal calf serum protein binding (% unbound) 38.580 % High 0.83
herg hERG pIC50 5.037 pIC50 High 0.83
hh-clint Human hepatocyte intrinsic clearance 15.205 uL/min/10^6 cells High 0.83
hlm-clint Human liver microsomal intrinsic clearance 36.983 uL/min/mg protein High 0.83
hppb Human plasma protein binding (% unbound) 15.100 % High 0.83
kinase-safety-class ACVR2A,ACVR2B,AKT2,AKT3,AURKA,AXL,BRAF,BTK,CAMK2B,CAMK2D,CDK5,CDK9,CHEK1,DDR1,DYRK1B,EGFR,EIF2AK3,EPHB4,ERBB2,FLT3,GRK2,GSK3B,ITK,JAK2,JAK3,MAP2K6,MAP3K21,MAP3K7,MAPK10,MAPK12,MAPK7,MAPK8,MAPK9,MAPKAPK2,MARK4,MET,MTOR,NTRK2,PDK1,PDK2,PDK4,PDPK1,PIK3CB,PIM2,PLK1,PRKCD,PRKDC,SIK2,SIK3,STK33,SYK,TEK,TTK,ZAP70 54
kinase-selectivity-class AXL,GRK2,PDK4 3
mdck-mdr1-efflux MDCK-MDR1 efflux ratio 1.089 High 0.83
mh-clint Mouse hepatocyte intrinsic clearance 90.157 High 0.83
mppb Mouse plasma protein binding (% unbound) 18.430 High 0.83
nih-mdck-mdr1-efflux NIH MDCK-MDR1 efflux ratio 3.436 High 0.83
pfas-class PFAS structural alert (1 = True, 0 = False) 0
pppb Pig plasma protein binding (% unbound) 29.420 % High 0.83
rh-clint Rat hepatocyte intrinsic clearance 214.783 uL/min/10^6 cells High 0.83
rh-fuinc Rat hepatocyte fraction unbound in incubation 71.850 % High 0.83
rppb Rat plasma protein binding (% unbound) 16.570 % High 0.83
solubility-dd Solubility at pH 7.4 in DMSO 724.436 uM High 0.83

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 C01EB11 CARDIOVASCULAR SYSTEM
CARDIAC THERAPY
OTHER CARDIAC PREPARATIONS
Other cardiac preparations
MeSH PA D000889 Anti-Arrhythmia Agents
MeSH PA D002317 Cardiovascular Agents
MeSH PA D002491 Central Nervous System Agents
MeSH PA D011619 Psychotropic Drugs
CHEBI has role CHEBI:35554 cardiovascular drug

Related Drugs by ATC class:

C01EB Other cardiac preparations 15 drugs

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

None




🐶 Veterinary Drug Use

None

🐶 Veterinary products

None

Acid dissociation constants calculated using MoKa v3.0.0

Dissociation levelDissociation constantType (acidic/basic)
pKa1 11.93 acidic
pKa2 6.86 Basic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

TargetClassPharosUniProtActionTypeActivity value
(-log[M])
Mechanism
action
Bioact sourceMoA source
Nuclear receptor subfamily 1 group I member 3 Nuclear hormone receptor IC50 5.39 CHEMBL

External reference:

IDSource
D07164 KEGG_DRUG
C0145975 UMLSCUI
CHEBI:135549 CHEBI
CHEMBL1625260 ChEMBL_ID
DB13635 DRUGBANK_ID
C048166 MESH_SUPPLEMENTAL_RECORD_UI
71264 PUBCHEM_CID
6494 INN_ID
9UUO2T61K7 UNII

Pharmaceutical products:

None