| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 30th, 2009 | 35 | 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) | -1.84 | -0.61 | -57.62 | 9 | 14 | 0 | 225 | 513.577 | 13 | ↓ |
| Hi High (pH 8-9.5) | -1.11 | -1.36 | -108.47 | 7 | 14 | -2 | 221 | 511.561 | 13 | ↓ |
| Mid Mid (pH 6-8) | -1.84 | -0.93 | -66.94 | 8 | 14 | -1 | 224 | 512.569 | 13 | ↓ |
| Lo Low (pH 4.5-6) | -1.84 | -2.6 | -65.42 | 10 | 14 | 1 | 222 | 514.585 | 13 | ↓ |
