| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 10th, 2011 | 38 | 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) | 7.38 | 15.29 | -10.24 | 2 | 7 | 0 | 81 | 524.522 | 7 | ↓ |
| Hi High (pH 8-9.5) | 7.38 | 14.91 | -44.19 | 1 | 7 | -1 | 79 | 523.514 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 7.38 | 15.39 | -35.31 | 3 | 7 | 1 | 82 | 525.53 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 7.38 | 15.95 | -88.63 | 4 | 7 | 2 | 83 | 526.538 | 7 | ↓ |
