| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 31st, 2009 | 24 | Yes |
None
| 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) | 2.76 | 10 | -15.81 | 0 | 4 | 0 | 52 | 316.36 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.76 | 10.46 | -42.05 | 1 | 4 | 1 | 53 | 317.368 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0311010A2; EP0311010B1; EP0532054A1; US5171745; US5173489; US5300642; US5434264 | IBM Patent Data |
