| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2007 | 23 | Yes |
| 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) | 1.76 | 3.74 | -11.82 | 3 | 6 | 0 | 95 | 327.365 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.39 | 2.14 | -30.42 | 3 | 6 | 0 | 103 | 327.365 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.40 | -0.92 | -48.65 | 2 | 6 | -1 | 102 | 326.357 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.94 | 1.02 | -12.15 | 3 | 6 | 0 | 99 | 327.365 | 3 | ↓ |
