| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 20th, 2009 | 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) | 3.74 | 9.81 | -52.19 | 0 | 8 | -1 | 95 | 506.623 | 13 | ↓ |
| Mid Mid (pH 6-8) | 3.74 | 12.14 | -69.28 | 1 | 8 | 0 | 96 | 507.631 | 13 | ↓ |
| Lo Low (pH 4.5-6) | 3.74 | 10.84 | -56.95 | 2 | 8 | 1 | 93 | 508.639 | 13 | ↓ |
