| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 32 | 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) | 1.93 | 7.77 | -77.29 | 1 | 8 | 0 | 93 | 438.48 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.93 | 5.24 | -61.22 | 0 | 8 | -1 | 91 | 437.472 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.93 | 6.95 | -51.47 | 2 | 8 | 1 | 90 | 439.488 | 7 | ↓ |
