Basic Information
| Drug ID | DDPD01586 |
|
| Drug Name | Ursodeoxycholic acid | |
| Molecular Weight | 392.572 | |
| Molecular Formula | C24H40O4 | |
| CAS Number | 128-13-2 | |
| SMILES | [H][C@@]1(CC[C@@]2([H])[C@]3([H])[C@@H](O)C[C@]4([H])C[C@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCC(O)=O | |
| External Links | ||
| DRUGBANK | DB01586 | |
| PubChem Compound | 31401 | |
| PDR | 1231 | |
Experimental Physicochemical Property
| Property Name | Property Value | Unit | Raw Value | Raw Unit | Reference |
|---|---|---|---|---|---|
| Log P | 3.0 | - | 3.0 | - | RODA,A ET AL. (1990) |
| Melting Point | 203.0 | ℃ | 203 | ℃ | PhysProp |
| Water Solubility | 20.0 | mg/L | 20 | mg/L | YALKOWSKY,SH & DANNENFELSER,RM 1992) |
Pharmacokinetic/ Toxicokinetic Property
| Property Name | Property Value | Unit | Raw Value | Raw Unit | Annotation | Reference |
|---|---|---|---|---|---|---|
| Toxicity LD50 | 5000.0 | mg/kg | >5000 | mg/kg | Rattus, Rat; | DRUGBANK | Toxicity LD50 | 7500.0 | mg/kg | >7500 | mg/kg | mouse; | DRUGBANK |
Maximum Dosage
| Property Name | Property Value | Unit | Raw Value | Raw Unit | Annotation | Brand Name | Component | Reference |
|---|---|---|---|---|---|---|---|---|
| Max dose for neonates | 30.0 | mg/kg/day | 30 | mg/kg/day | PO, oral | Actigall | ursodiol | PDR |
| Max dose for neonates | 40.0 | mg/kg/day | 40 | mg/kg/day | PO, oral | Actigall | ursodiol | PDR |
| Max dose for infants | 30.0 | mg/kg/day | 30 | mg/kg/day | PO, oral | Actigall | ursodiol | PDR |
| Max dose for infants | 40.0 | mg/kg/day | 40 | mg/kg/day | PO, oral | Actigall | ursodiol | PDR |
| Max dose for children | 30.0 | mg/kg/day | 30 | mg/kg/day | PO, oral | Actigall | ursodiol | PDR |
| Max dose for adolescents | 30.0 | mg/kg/day | 30 | mg/kg/day | PO, oral | Actigall | ursodiol | PDR |
Drug Property Radar Chart
Note: Center: Q1-1.5*IQR, Edge: Q3+1.5*IQR; Q1: Quantile 1, Q3: Quantile 3, IQR: Q3-Q1