Basic Information
| Drug ID | DDPD00206 |
|
| Drug Name | Reserpine | |
| Molecular Weight | 608.6787 | |
| Molecular Formula | C33H40N2O9 | |
| CAS Number | 50-55-5 | |
| SMILES | [H][C@]12C[C@@H](OC(=O)C3=CC(OC)=C(OC)C(OC)=C3)[C@H](OC)[C@@H](C(=O)OC)[C@@]1([H])C[C@@]1([H])N(CCC3=C1NC1=C3C=CC(OC)=C1)C2 | |
| External Links | ||
| DRUGBANK | DB00206 | |
| T3DB | T3D2713 | |
| PubChem Compound | 5770 | |
| PDR | 792 | |
| Drugs.com | Drugs.com Drug Page | |
Experimental Physicochemical Property
| Property Name | Property Value | Unit | Raw Value | Raw Unit | Reference |
|---|---|---|---|---|---|
| Log P | 3.2 | - | 3.2 | - | DRUGBANK |
| Melting Point | 264.5 | ℃ | 264.5 | ℃ | PhysProp |
| Water Solubility | 73.0 | mg/L | 73 | mg/L | YALKOWSKY,SH & DANNENFELSER,RM 1992) |
| pKa | 6.6 | - | 6.6 | - | MERCK INDEX (1996) |
Pharmacokinetic/ Toxicokinetic Property
| Property Name | Property Value | Unit | Raw Value | Raw Unit | Annotation | Reference |
|---|---|---|---|---|---|---|
| Toxicity LD50 | 420.0 | mg/kg | 420.0 | mg/kg | PO, oral; Rattus, Rat; | DRUGBANK | Toxicity LD50 | 44.0 | mg/kg | 44.0 | mg/kg | Intraperitoneal, IP; Rattus, Rat; | DRUGBANK | Toxicity LD50 | 15.0 | mg/kg | 15.0 | mg/kg | intravenous injection, IV; Rattus, Rat; | DRUGBANK | Toxicity LD50 | 200.0 | mg/kg | 200.0 | mg/kg | PO, oral; mouse; | DRUGBANK | Toxicity LD50 | 52.0 | mg/kg | 52.0 | mg/kg | subcutaneous injection, SC; mouse; | DRUGBANK | Toxicity LD50 | 7.0 | mg/kg | 7.0 | mg/kg | Intraperitoneal, IP; rabbit; | DRUGBANK | Toxicity LD50 | 420.0 | mg/kg | 420.0 | mg/kg | PO, oral; Rattus, Rat; | T3DB | Toxicity LD50 | 44.0 | mg/kg | 44.0 | mg/kg | Intraperitoneal, IP; parenteral administration; Rattus, Rat; | T3DB | Toxicity LD50 | 15.0 | mg/kg | 15.0 | mg/kg | intravenous injection, IV; parenteral administration; Rattus, Rat; | T3DB | Toxicity LD50 | 200.0 | mg/kg | 200.0 | mg/kg | PO, oral; mouse; | T3DB | Toxicity LD50 | 52.0 | mg/kg | 52.0 | mg/kg | subcutaneous injection, SC; parenteral administration; mouse; | T3DB | Toxicity LD50 | 7.0 | mg/kg | 7.0 | mg/kg | Intraperitoneal, IP; parenteral administration; rabbit; | T3DB |
| Protein Binding | 62.0 | % | 62 | % | DRUGBANK |
Maximum Dosage
| Property Name | Property Value | Unit | Raw Value | Raw Unit | Annotation | Brand Name | Component | Reference |
|---|---|---|---|---|---|---|---|---|
| Max dose for adults | 0.5 | mg/day | 0.5 | mg/day | PO, oral | Reserpine | reserpine | PDR |
| Max dose for adults | 1.0 | mg/day | 1 | mg/day | PO, oral | Reserpine | reserpine | PDR |
| Max dose for elderly | 0.25 | mg/day | 0.25 | mg/day | PO, oral | Reserpine | reserpine | 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