| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2007 | 34 | 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) | 2.98 | 9.45 | -65.44 | 0 | 9 | -1 | 114 | 463.466 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.40 | 2.21 | -17.98 | 0 | 9 | 0 | 108 | 464.474 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.98 | 8.63 | -21.49 | 1 | 9 | 0 | 111 | 464.474 | 8 | ↓ |
