| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2009 | 32 | 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) | 5.38 | 15.77 | -71.09 | 5 | 7 | 1 | 92 | 516.284 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.38 | 13.4 | -19.24 | 4 | 7 | 0 | 91 | 515.276 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 5.38 | 16.22 | -121.73 | 6 | 7 | 2 | 93 | 517.292 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 5.38 | 16.67 | -181.72 | 7 | 7 | 3 | 95 | 518.3 | 8 | ↓ |
