| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2009 | 30 | Yes |
| 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) | 2.53 | 6.34 | -50.39 | 4 | 7 | 1 | 92 | 407.494 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.53 | 4.1 | -16.02 | 3 | 7 | 0 | 91 | 406.486 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.71 | 1.43 | -14.46 | 3 | 7 | 0 | 94 | 406.486 | 5 | ↓ |
