| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 7th, 2008 | 28 | No |
| 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) | 2.95 | 12.71 | -17.59 | 1 | 6 | 0 | 73 | 389.484 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.13 | 12.56 | -40.96 | 0 | 6 | -1 | 74 | 388.476 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.95 | 12.97 | -40.24 | 2 | 6 | 1 | 74 | 390.492 | 4 | ↓ |
