| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 6th, 2007 | 32 | 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) | 3.14 | 8.57 | -58.02 | 0 | 6 | -1 | 73 | 437.491 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.55 | 0.25 | -48.52 | 1 | 6 | 1 | 68 | 439.507 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.14 | 10.9 | -77.49 | 1 | 6 | 0 | 74 | 438.499 | 7 | ↓ |
