| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2010 | 41 | 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) | 3.77 | 9.12 | -71.64 | 4 | 10 | 0 | 139 | 553.667 | 10 | ↓ |
| Hi High (pH 8-9.5) | 3.77 | 7.86 | -50.57 | 3 | 10 | -1 | 134 | 552.659 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 3.77 | 9.21 | -47.33 | 5 | 10 | 1 | 141 | 554.675 | 10 | ↓ |
