| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 16th, 2010 | 22 | 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) | 3.06 | 7.11 | -31.84 | 2 | 3 | 1 | 28 | 303.47 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.06 | 8 | -40.2 | 1 | 3 | 0 | 31 | 302.462 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.06 | 7.65 | -30.07 | 1 | 3 | 0 | 31 | 302.462 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.06 | 9.37 | -107.6 | 3 | 3 | 2 | 29 | 304.478 | 4 | ↓ |
