| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 30th, 2006 | 23 | 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) | 3.74 | 6.58 | -12.97 | 2 | 5 | 0 | 70 | 367.206 | 2 | ↓ |
| Hi High (pH 8-9.5) | 4.20 | 4.53 | -53.24 | 1 | 5 | -1 | 73 | 366.198 | 2 | ↓ |
| Hi High (pH 8-9.5) | 4.20 | 4.8 | -54.16 | 1 | 5 | -1 | 73 | 366.198 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.56 | 7.05 | -82.94 | 4 | 5 | 2 | 69 | 369.222 | 3 | ↓ |
