| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 13th, 2009 | 31 | 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) | 3.68 | 6.21 | -96.7 | 0 | 9 | -2 | 144 | 453.716 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.68 | 5.2 | -41.37 | 1 | 9 | -1 | 141 | 454.724 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.23 | 7.65 | -14.55 | 2 | 9 | 0 | 138 | 455.732 | 4 | ↓ |
