| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 24th, 2006 | 31 | 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) | 4.20 | 9.15 | -62.19 | 0 | 6 | -1 | 79 | 422.501 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.62 | 0.8 | -11.44 | 0 | 6 | 0 | 72 | 423.509 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 4.20 | 8.34 | -16.52 | 1 | 6 | 0 | 76 | 423.509 | 9 | ↓ |
