| Stem definition | Drug id | CAS RN |
|---|---|---|
| antibacterials, nalidixic acid derivatives | 2449 | 127254-12-0 |
| Dose | Unit | Route |
|---|---|---|
| 0.10 | g | O |
| Property | Value | Reference |
|---|---|---|
| BDDCS (Biopharmaceutical Drug Disposition Classification System) | 3 | Benet LZ, Broccatelli F, Oprea TI |
| EoM (Fraction excreted unchanged in urine) | 75 % | Benet LZ, Broccatelli F, Oprea TI |
| BA (Bioavailability) | 89 % | Kim MT, Sedykh A, Chakravarti SK, Saiakhov RD, Zhu H |
| Vd (Volume of distribution) | 1.50 L/kg | Lombardo F, Berellini G, Obach RS |
| CL (Clearance) | 3.70 mL/min/kg | Lombardo F, Berellini G, Obach RS |
| fu (Fraction unbound in plasma) | 0.51 % | Lombardo F, Berellini G, Obach RS |
| t_half (Half-life) | 6.60 hours | Lombardo F, Berellini G, Obach RS |
| Date | Agency | Company | Orphan |
|---|---|---|---|
| Jan. 25, 2008 | PMDA | Daiichi Sankyo |
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| Source | Code | Description |
|---|---|---|
| ATC | J01MA21 | ANTIINFECTIVES FOR SYSTEMIC USE ANTIBACTERIALS FOR SYSTEMIC USE QUINOLONE ANTIBACTERIALS Fluoroquinolones |
| MeSH PA | D000900 | Anti-Bacterial Agents |
| 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 | |
| Respiratory tract infection | indication | 275498002 |
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| Dissociation level | Dissociation constant | Type (acidic/basic) |
|---|---|---|
| pKa1 | 5.69 | acidic |
| pKa2 | 10.5 | Basic |
| pKa3 | 1.75 | Basic |
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| Target | Class | Pharos | UniProt | Action | Type | Activity value (-log[M]) | Mechanism action | Bioact source | MoA source |
|---|---|---|---|---|---|---|---|---|---|
| DNA gyrase subunit B | Enzyme | WOMBAT-PK | |||||||
| DNA topoisomerase 4 subunit A | Enzyme | WOMBAT-PK |
| ID | Source |
|---|---|
| D02475 | KEGG_DRUG |
| C0171447 | UMLSCUI |
| CHEBI:4304 | CHEBI |
| CHEMBL3989504 | ChEMBL_ID |
| CHEMBL108821 | ChEMBL_ID |
| DB13261 | DRUGBANK_ID |
| C076246 | MESH_SUPPLEMENTAL_RECORD_UI |
| 461399 | PUBCHEM_CID |
| 11040 | IUPHAR_LIGAND_ID |
| 9TD681796G | UNII |
| 163253-35-8 | SECONDARY_CAS_RN |
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