Stem definition | Drug id | CAS RN |
---|---|---|
antibacterials, nalidixic acid derivatives | 657 | 28657-80-9 |
Dose | Unit | Route |
---|---|---|
1 | g | O |
Property | Value | Reference |
---|---|---|
BDDCS (Biopharmaceutical Drug Disposition Classification System) | 4 | Benet LZ, Broccatelli F, Oprea TI |
EoM (Fraction excreted unchanged in urine) | 60 % | Benet LZ, Broccatelli F, Oprea TI |
MRTD (Maximum Recommended Therapeutic Daily Dose) | 63.69 ยตM/kg/day | Contrera JF, Matthews EJ, Kruhlak NL, Benz RD |
BA (Bioavailability) | 72.50 % | Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H |
Date | Agency | Company | Orphan |
---|---|---|---|
June 13, 1980 | FDA | LILLY |
None
None
None
None
Source | Code | Description |
---|---|---|
ATC | J01MB06 | ANTIINFECTIVES FOR SYSTEMIC USE ANTIBACTERIALS FOR SYSTEMIC USE QUINOLONE ANTIBACTERIALS Other quinolones |
CHEBI has role | CHEBI:35441 | antiinfective agents |
CHEBI has role | CHEBI:36047 | antibacterial drugs |
MeSH PA | D000890 | Anti-Infective Agents |
MeSH PA | D000970 | Antineoplastic Agents |
MeSH PA | D004791 | Enzyme Inhibitors |
MeSH PA | D059005 | Topoisomerase II Inhibitors |
MeSH PA | D059003 | Topoisomerase Inhibitors |
Disease | Relation | SNOMED_ID | DOID |
---|---|---|---|
Urinary tract infectious disease | indication | 68566005 |
None
None
Dissociation level | Dissociation constant | Type (acidic/basic) |
---|---|---|
pKa1 | 4.94 | acidic |
pKa2 | 3.27 | Basic |
pKa3 | 0.83 | Basic |
None
None
Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
---|---|---|---|---|---|---|---|---|---|
Carbonic anhydrase 2 | Enzyme | IC50 | 4.08 | WOMBAT-PK | |||||
DNA gyrase | Enzyme | INHIBITOR | CHEMBL | CHEMBL |
ID | Source |
---|---|
4019087 | VUID |
N0000147347 | NUI |
D00872 | KEGG_DRUG |
151514 | RXNORM |
4019087 | VANDF |
C0008806 | UMLSCUI |
CHEBI:3716 | CHEBI |
CHEMBL1208 | ChEMBL_ID |
DB00827 | DRUGBANK_ID |
D002937 | MESH_DESCRIPTOR_UI |
2762 | PUBCHEM_CID |
12401 | IUPHAR_LIGAND_ID |
3513 | INN_ID |
LMK22VUH23 | UNII |
106 | MMSL |
109 | MMSL |
4450 | MMSL |
d01129 | MMSL |
002865 | NDDF |
387549004 | SNOMEDCT_US |
96081007 | SNOMEDCT_US |
None