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

Stem definitionDrug idCAS RN
3661 1222-57-7

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • solimidine
  • zolimidine
  • zolimidin
  • solimidin
  • solitacina
was MH 1977-92 (see under PYRIDINES 1977-90); SOLIMIDINE was see ZOLIMIDINE 1977-92; use PYRIDINES to search ZOLIMIDINE 1977-92; compound with analgesic, antipyretic & anti-inflammatory action; used mainly in the treatment of gastrointestinal ulcers due to its considerable mucopoietic action
  • Molecular weight: 272.32
  • Formula: C14H12N2O2S
  • CLOGP: 1.95
  • LIPINSKI: 0
  • HAC: 4
  • HDO: 0
  • TPSA: 51.44
  • ALOGS: -4.16
  • ROTB: 2

Drug dosage:

None

ADMET properties:

None

Predicted pharmacokinetic/toxicological properties (PK-AZ):

PropertyDescriptionValueUnitConfidenceSimilarity
azlogd74 LogD at pH 7.4 1.782 Moderate 0.68
caco2-efflux Caco-2 efflux ratio (BA/AB) 1.327 Moderate 0.68
caco2-intrinsic-papp Caco-2 intrinsic apparent permeability 64.565 10^-6 cm/s Moderate 0.68
dh-clint Dog hepatocyte intrinsic clearance 22.542 uL/min/10^6 cells Moderate 0.68
dppb Dog plasma protein binding (% unbound) 31.870 % Moderate 0.68
fcs-ppb Fetal calf serum protein binding (% unbound) 40.560 % Moderate 0.68
herg hERG pIC50 4.754 pIC50 Moderate 0.68
hh-clint Human hepatocyte intrinsic clearance 3.846 uL/min/10^6 cells Moderate 0.68
hlm-clint Human liver microsomal intrinsic clearance 19.055 uL/min/mg protein Moderate 0.68
hppb Human plasma protein binding (% unbound) 10.490 % Moderate 0.68
kinase-safety-class ACVR2A,ACVR2B,ALK,AXL,BRAF,CAMK2B,CAMK2D,CDK5,CDK9,DDR1,DYRK1B,EIF2AK3,ERBB2,FLT3,GRK2,ITK,JAK1,JAK2,MAP3K1,MAP3K10,MAP3K21,MAP4K1,MAPK10,MAPK7,MARK4,MTOR,PDK1,PDK2,PDK4,PIK3CG,PIM2,PRKCD,PRKDC,SIK2,SIK3,STK33,TEK,TTK,ULK1 39
kinase-selectivity-class ACVR2A,BRAF,DYRK1B 3
mdck-mdr1-efflux MDCK-MDR1 efflux ratio 3.155 Moderate 0.68
mh-clint Mouse hepatocyte intrinsic clearance 18.072 Moderate 0.68
mppb Mouse plasma protein binding (% unbound) 24.530 Moderate 0.68
nih-mdck-mdr1-efflux NIH MDCK-MDR1 efflux ratio 3.327 Moderate 0.68
pfas-class PFAS structural alert (1 = True, 0 = False) 0
pppb Pig plasma protein binding (% unbound) 27.820 % Moderate 0.68
rh-clint Rat hepatocyte intrinsic clearance 10.304 uL/min/10^6 cells Moderate 0.68
rh-fuinc Rat hepatocyte fraction unbound in incubation 86.780 % Moderate 0.68
rppb Rat plasma protein binding (% unbound) 12.810 % Moderate 0.68
solubility-dd Solubility at pH 7.4 in DMSO 80.168 uM Moderate 0.68

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 A02BX10 ALIMENTARY TRACT AND METABOLISM
DRUGS FOR ACID RELATED DISORDERS
DRUGS FOR PEPTIC ULCER AND GASTRO-OESOPHAGEAL REFLUX DISEASE (GORD)
Other drugs for peptic ulcer and gastro-oesophageal reflux disease (GORD)
CHEBI has role CHEBI:49201 anti-ulcer drug

Related Drugs by ATC class:

A02BX Other drugs for peptic ulcer and gastro-oesophageal reflux disease (GORD) 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 5.75 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
Histone deacetylase 6 Enzyme IC50 6.11 CHEMBL

External reference:

IDSource
D07075 KEGG_DRUG
C0650163 UMLSCUI
CHEBI:135125 CHEBI
CHEMBL2105534 ChEMBL_ID
DB13593 DRUGBANK_ID
C073260 MESH_SUPPLEMENTAL_RECORD_UI
14652 PUBCHEM_CID
3089 INN_ID
YCF001N8QB UNII

Pharmaceutical products:

None