| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 25th, 2008 | 23 | Yes |
Popular Name: Mycophenolate sodium Mycophenolate sodium
Find On: PubMed — Wikipedia — Google
CAS Number: 1162256-90-7
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.80 | 6.82 | -55.06 | 1 | 5 | -1 | 87 | 317.361 | 6 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| IMDH2-1-E | Inosine-5'-monophosphate Dehydrogenase 2 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 140 | 0.42 | Binding ≤ 10μM |
| Z50587-1-O | Homo Sapiens (cluster #1 Of 9), Other | Other | 830 | 0.37 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| IMDH2_HUMAN | P12268 | Inosine-5'-monophosphate Dehydrogenase 2, Human | 140 | 0.42 | Binding ≤ 1μM |
| IMDH2_HUMAN | P12268 | Inosine-5'-monophosphate Dehydrogenase 2, Human | 140 | 0.42 | Binding ≤ 10μM |
| Z50587 | Z50587 | Homo Sapiens | 830 | 0.37 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| Purine ribonucleoside monophosphate biosynthesis |
No pre-computed analogs available. Try a structural similarity search.