| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2010 | 37 | 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) | 3.53 | 7.36 | -61.95 | 0 | 8 | -1 | 91 | 501.559 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.53 | 9.64 | -69.32 | 1 | 8 | 0 | 93 | 502.567 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 3.53 | 8.89 | -50.17 | 2 | 8 | 1 | 90 | 503.575 | 8 | ↓ |
