temocillin Indications/Contra | FAERs-F | FAERs-M | Orange Bk | BioActivity |

Stem definitionDrug idCAS RN
antibiotics, 6-aminopenicillanic acid derivatives 2587 66148-78-5

Description:

MoleculeDescription

Molfile Inchi Smiles

Synonyms:

  • temocillin disodium
  • temocillin
beta-lactam antibiotic with unusual spectrum of antibacterial activity & exceptional stability to bacterial beta-lactamases; RN given refers to di-Na salt (2S-(2alpha,5alpha,6alpha))-isomer
  • Molecular weight: 414.45
  • Formula: C16H18N2O7S2
  • CLOGP: 1.52
  • LIPINSKI: 0
  • HAC: 9
  • HDO: 3
  • TPSA: 133.24
  • ALOGS: -3.61
  • ROTB: 6

Drug dosage:

DoseUnitRoute
4 g P

ADMET properties:

PropertyValueReference
BDDCS (Biopharmaceutical Drug Disposition Classification System) 3 Benet LZ, Broccatelli F, Oprea TI
MRTD (Maximum Recommended Therapeutic Daily Dose) 147.72 ┬ÁM/kg/day Contrera JF, Matthews EJ, Kruhlak NL, Benz RD
Vd (Volume of distribution) 0.11 L/kg Lombardo F, Berellini G, Obach RS
CL (Clearance) 0.34 mL/min/kg Lombardo F, Berellini G, Obach RS
fu (Fraction unbound in plasma) 0.21 % Lombardo F, Berellini G, Obach RS
t_half (Half-life) 4.10 hours Lombardo F, Berellini G, Obach RS

Approvals:

DateAgencyCompanyOrphan
Jan. 1, 1984 YEAR INTRODUCED

FDA Adverse Event Reporting System (Female)

None

FDA Adverse Event Reporting System (Male)

None

Pharmacologic Action:

SourceCodeDescription
ATC J01CA17 ANTIINFECTIVES FOR SYSTEMIC USE
ANTIBACTERIALS FOR SYSTEMIC USE
BETA-LACTAM ANTIBACTERIALS, PENICILLINS
Penicillins with extended spectrum
MeSH PA D000900 Anti-Bacterial Agents
MeSH PA D000890 Anti-Infective Agents

Drug Use (View source of the data)

None

Acid dissociation constants calculated using MoKa v3.0.0

Dissociation levelDissociation constantType (acidic/basic)
pKa1 3.01 acidic
pKa2 3.6 acidic

Orange Book patent data (new drug applications)

None

Orange Book exclusivity data (new drug applications)

None

Bioactivity Summary:

None

External reference:

IDSource
D06064 KEGG_DRUG
C0076079 UMLSCUI
CHEBI:51817 CHEBI
TJ7 PDB_CHEM_ID
CHEMBL1276310 ChEMBL_ID
C031367 MESH_SUPPLEMENTAL_RECORD_UI
5097 INN_ID
DB12343 DRUGBANK_ID
03QB156W6I UNII
171758 PUBCHEM_CID
10926 IUPHAR_LIGAND_ID
37775 RXNORM
004049 NDDF
387543003 SNOMEDCT_US
96065002 SNOMEDCT_US

Pharmaceutical products:

None