| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2009 | 39 | 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) | 3.20 | 10.24 | -54.31 | 0 | 9 | -1 | 104 | 536.649 | 14 | ↓ |
| Mid Mid (pH 6-8) | 3.20 | 12.58 | -77.16 | 1 | 9 | 0 | 105 | 537.657 | 14 | ↓ |
| Lo Low (pH 4.5-6) | 3.20 | 11.28 | -64.63 | 2 | 9 | 1 | 103 | 538.665 | 14 | ↓ |
