| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 24th, 2009 | 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) | 3.03 | 5.94 | -16.1 | 1 | 7 | 0 | 77 | 420.465 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.03 | 6.58 | -46.02 | 0 | 7 | -1 | 80 | 419.457 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.03 | 8.29 | -62.33 | 2 | 7 | 1 | 78 | 421.473 | 4 | ↓ |
