| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2009 | 18 | Yes |
| 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) | 3.12 | 8.69 | -102.91 | 0 | 4 | -2 | 80 | 256.342 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.12 | 6.7 | -46.25 | 1 | 4 | -1 | 77 | 257.35 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.12 | 6.71 | -46.12 | 1 | 4 | -1 | 77 | 257.35 | 8 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0996134A2 | IBM Patent Data |
