| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2005 | 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) | 3.22 | 8.64 | -8.08 | 2 | 8 | 0 | 101 | 402.245 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.04 | -0.35 | -42.09 | 3 | 8 | 1 | 98 | 403.253 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.22 | 9.02 | -30.37 | 3 | 8 | 1 | 102 | 403.253 | 3 | ↓ |
