| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 27 | 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) | 4.21 | 12.19 | -116.11 | 3 | 3 | 2 | 24 | 474.578 | 10 | ↓ |
| Hi High (pH 8-9.5) | 4.21 | 12.73 | -100.24 | 3 | 3 | 1 | 24 | 473.57 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 4.21 | 12.6 | -226.7 | 4 | 3 | 3 | 25 | 475.586 | 10 | ↓ |
