| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 15th, 2006 | 25 | 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) | 3.43 | 5.42 | -14.19 | 3 | 6 | 0 | 90 | 332.363 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.43 | 6.2 | -65.68 | 2 | 6 | -1 | 93 | 331.355 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.43 | 5.47 | -14.67 | 3 | 6 | 0 | 90 | 332.363 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.43 | 5.8 | -42.55 | 4 | 6 | 1 | 92 | 333.371 | 3 | ↓ |
