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

Stem definitionDrug idCAS RN
antibacterials, nalidixic acid derivatives 677 105956-97-6

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • clinafloxacin
  • Molecular weight: 365.79
  • Formula: C17H17ClFN3O3
  • CLOGP: -0.15
  • LIPINSKI: 0
  • HAC: 6
  • HDO: 2
  • TPSA: 86.87
  • ALOGS: -2.91
  • ROTB: 3

Drug dosage:

None

ADMET properties:

PropertyValueReference
BDDCS (Biopharmaceutical Drug Disposition Classification System) 4 Bocci G, Oprea TI, Benet LZ
BA (Bioavailability) 90 % Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H
Vd (Volume of distribution) 1.90 L/kg Lombardo F, Berellini G, Obach RS
CL (Clearance) 4.70 mL/min/kg Lombardo F, Berellini G, Obach RS
fu (Fraction unbound in plasma) 0.96 % Lombardo F, Berellini G, Obach RS
t_half (Half-life) 5.40 hours Lombardo F, Berellini G, Obach RS
S (Water solubility) 0.05 mg/mL Bocci G, Oprea TI, Benet LZ

Predicted pharmacokinetic/toxicological properties (PK-AZ):

PropertyDescriptionValueUnitConfidenceSimilarity
azlogd74 LogD at pH 7.4 -0.560 High 1
caco2-efflux Caco-2 efflux ratio (BA/AB) 2.877 High 1
caco2-intrinsic-papp Caco-2 intrinsic apparent permeability 2.280 10^-6 cm/s High 1
dh-clint Dog hepatocyte intrinsic clearance 0.902 uL/min/10^6 cells High 1
dppb Dog plasma protein binding (% unbound) 71.480 % High 1
fcs-ppb Fetal calf serum protein binding (% unbound) 70.290 % High 1
herg hERG pIC50 4.598 pIC50 High 1
hh-clint Human hepatocyte intrinsic clearance 1.074 uL/min/10^6 cells High 1
hlm-clint Human liver microsomal intrinsic clearance 3.221 uL/min/mg protein High 1
hppb Human plasma protein binding (% unbound) 71.290 % High 1
kinase-safety-class ACVR2B,EIF2AK3,GRK2,PDK1,PDK2,PDK4 6
kinase-selectivity-class AXL,CDK9,DYRK1B,EIF2AK3,GRK2,MAPK7,PDK4,PRKDC,STK33,TTK 10
mdck-mdr1-efflux MDCK-MDR1 efflux ratio 5.794 High 1
mh-clint Mouse hepatocyte intrinsic clearance 4.677 High 1
mppb Mouse plasma protein binding (% unbound) 68.930 High 1
nih-mdck-mdr1-efflux NIH MDCK-MDR1 efflux ratio 8.670 High 1
pfas-class PFAS structural alert (1 = True, 0 = False) 0
pppb Pig plasma protein binding (% unbound) 79.590 % High 1
rh-clint Rat hepatocyte intrinsic clearance 1.596 uL/min/10^6 cells High 1
rh-fuinc Rat hepatocyte fraction unbound in incubation 83.590 % High 1
rppb Rat plasma protein binding (% unbound) 50.690 % High 1
solubility-dd Solubility at pH 7.4 in DMSO 731.139 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:

SourceCodeDescription
MeSH PA D000890 Anti-Infective Agents
MeSH PA D000900 Anti-Bacterial Agents
MeSH PA D000970 Antineoplastic Agents
MeSH PA D004791 Enzyme Inhibitors
MeSH PA D059003 Topoisomerase Inhibitors
MeSH PA D059005 Topoisomerase II Inhibitors

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 6.06 acidic
pKa2 9.45 Basic
pKa3 1.75 Basic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

None

External reference:

IDSource
C1315753 UMLSCUI
CHEBI:747982 CHEBI
NFX PDB_CHEM_ID
CHEMBL278255 ChEMBL_ID
DB14025 DRUGBANK_ID
C057477 MESH_SUPPLEMENTAL_RECORD_UI
60063 PUBCHEM_CID
10793 IUPHAR_LIGAND_ID
6961 INN_ID
8N86XTF9QD UNII
702747003 SNOMEDCT_US
96083005 SNOMEDCT_US

Pharmaceutical products:

None