Basic Information
| Drug ID | DDPD00688 |
|
| Drug Name | Mycophenolate mofetil | |
| Molecular Weight | 433.4947 | |
| Molecular Formula | C23H31NO7 | |
| CAS Number | 128794-94-5 | |
| SMILES | COC1=C(C\C=C(/C)CCC(=O)OCCN2CCOCC2)C(O)=C2C(=O)OCC2=C1C | |
| External Links | ||
| DRUGBANK | DB00688 | |
| PubChem Compound | 5281078 | |
| Drugs.com | Drugs.com Drug Page | |
Experimental Physicochemical Property
| Property Name | Property Value | Unit | Raw Value | Raw Unit | Reference |
|---|---|---|---|---|---|
| Log P | 2.5 | - | 2.5 | - | http://www.hmdb.ca/metabolites/HMDB0014826 |
| Boiling Point | 637.6 | ℃ | 637.6±55.0 | ℃ | http://www.chemspider.com/Chemical-Structure.4444535.html |
| Melting Point | 93.5 | ℃ | 93-94 | ℃ | https://pubchem.ncbi.nlm.nih.gov/compound/Mycophenolate-mofetil#section=Experimental-Properties |
| Water Solubility | 43.0 | mg/L | 43 | μg/ml | https://www.accessdata.fda.gov/drugsatfda_docs/label/2009/050722s021,050723s019,050758s019,050759s024lbl.pdf |
| pKa | 5.6 | - | 5.6,8.5 | - | https://www.accessdata.fda.gov/drugsatfda_docs/label/2009/050722s021,050723s019,050758s019,050759s024lbl.pdf | pKa | 8.5 | - | 5.6,8.5 | - | DRUGBANK |
Pharmacokinetic/ Toxicokinetic Property
| Property Name | Property Value | Unit | Raw Value | Raw Unit | Annotation | Reference |
|---|---|---|---|---|---|---|
| AUC | 63900.0 | ng.h/ml | 63.9±16.2 | ug.h/ml | Oral single dose; | DRUGBANK | AUC | 65300.0 | ng.h/ml | 65.3±35.4 | ug.h/ml | PO, oral; renal transplant; | DRUGBANK |
| Bioavailability | 94.0 | % | 94 | % | Oral single dose; | DRUGBANK |
| C Max | 24500.0 | ng/ml | 24.5±9.5 | ug/ml | Oral single dose; | DRUGBANK | C Max | 24100.0 | ng/ml | 24.1±12.1 | ug/ml | PO, oral; renal transplant; | DRUGBANK |
| T Max | 1.3 | h | 1-1.5 | h | PO, oral; Active metabolite; | DRUGBANK |
| Clearance | 11.6 | L/h | 193.0 | ml/min | Plasma clearance; PO, oral; | DRUGBANK | Clearance | 10.6 | L/h | 177±31 | ml/min | Plasma clearance; intravenous injection, IV; | DRUGBANK |
| Volume of Distribution | 3.9 | L/kg | 3.6-4.2 | L/kg | DRUGBANK | |
| Half-life | 17.9 | h | 17.9±6.5 | h | PO, oral; | DRUGBANK | Half-life | 16.6 | h | 16.6±5.8 | h | intravenous injection, IV; | DRUGBANK |
| Toxicity LD50 | 250.0 | mg/kg | 250.0 | mg/kg | PO, oral; Rattus, Rat; | DRUGBANK | Toxicity LD50 | 4000.0 | mg/kg | >4000 | mg/kg | PO, oral; mouse; | DRUGBANK |
| Eliminate Route | 93.0 | % | 93 | % | Urinary excretion; | DRUGBANK | Eliminate Route | 6.0 | % | 6 | % | Faeces excretion; | DRUGBANK |
Maximum Dosage
Not Available
Drug Property Radar Chart
Note: Center: Q1-1.5*IQR, Edge: Q3+1.5*IQR; Q1: Quantile 1, Q3: Quantile 3, IQR: Q3-Q1