| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 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) | 2.99 | 9.88 | -67.94 | 0 | 9 | -1 | 114 | 463.466 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.43 | 9.49 | -21.93 | 1 | 9 | 0 | 111 | 464.474 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.40 | 2.93 | -17.65 | 0 | 9 | 0 | 108 | 464.474 | 7 | ↓ |
