| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2010 | 38 | 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) | 3.88 | 8.73 | -59.99 | 0 | 8 | -1 | 91 | 515.586 | 9 | ↓ |
| Mid Mid (pH 6-8) | 3.88 | 11.01 | -72.26 | 1 | 8 | 0 | 93 | 516.594 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.88 | 10.26 | -54.09 | 2 | 8 | 1 | 90 | 517.602 | 9 | ↓ |
