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

Stem definitionDrug idCAS RN
antiarthritic substances, acting like clobuzarit and lobenzarit 3716 22494-47-9

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • ICI 55,897
  • clobuzarit
  • clozic
  • clozic acid
  • Molecular weight: 304.77
  • Formula: C17H17ClO3
  • CLOGP: 4.64
  • LIPINSKI: 0
  • HAC: 3
  • HDO: 1
  • TPSA: 46.53
  • ALOGS: -5.31
  • ROTB: 5

Drug dosage:

None

ADMET properties:

None

Predicted pharmacokinetic/toxicological properties (PK-AZ):

PropertyDescriptionValueUnitConfidenceSimilarity
azlogd74 LogD at pH 7.4 1.497 High 1
caco2-efflux Caco-2 efflux ratio (BA/AB) 0.560 High 1
caco2-intrinsic-papp Caco-2 intrinsic apparent permeability 174.985 10^-6 cm/s High 1
dh-clint Dog hepatocyte intrinsic clearance 5.395 uL/min/10^6 cells High 1
dppb Dog plasma protein binding (% unbound) 0.360 % High 1
fcs-ppb Fetal calf serum protein binding (% unbound) 0.780 % High 1
herg hERG pIC50 4.797 pIC50 High 1
hh-clint Human hepatocyte intrinsic clearance 4.519 uL/min/10^6 cells High 1
hlm-clint Human liver microsomal intrinsic clearance 3.573 uL/min/mg protein High 1
hppb Human plasma protein binding (% unbound) 0.500 % High 1
kinase-safety-class ACVR2B,AURKA,AXL,BTK,CDK5,CDK9,EIF2AK3,ERBB2,GRK2,MAPK7,PDK1,PDK2,PDK4,PIK3CB,PIK3CG,PRKDC,TGFBR1 17
kinase-selectivity-class ACVR2B 1
mdck-mdr1-efflux MDCK-MDR1 efflux ratio 4.477 High 1
mh-clint Mouse hepatocyte intrinsic clearance 29.444 High 1
mppb Mouse plasma protein binding (% unbound) 1.960 High 1
nih-mdck-mdr1-efflux NIH MDCK-MDR1 efflux ratio 0.705 High 1
pfas-class PFAS structural alert (1 = True, 0 = False) 0
pppb Pig plasma protein binding (% unbound) 0.710 % High 1
rh-clint Rat hepatocyte intrinsic clearance 5.585 uL/min/10^6 cells High 1
rh-fuinc Rat hepatocyte fraction unbound in incubation 39.620 % High 1
rppb Rat plasma protein binding (% unbound) 0.520 % High 1
solubility-dd Solubility at pH 7.4 in DMSO 797.995 uM High 1

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:

None

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 3.87 acidic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

None

External reference:

IDSource
C0063306 UMLSCUI
CHEBI:135294 CHEBI
CHEMBL164447 ChEMBL_ID
C018431 MESH_SUPPLEMENTAL_RECORD_UI
71697 PUBCHEM_CID
4736 INN_ID
W3D7B06505 UNII

Pharmaceutical products:

None