| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2008 | 31 | 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) | 4.43 | 10.65 | -16.13 | 1 | 6 | 0 | 59 | 420.557 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.43 | 12.84 | -51.32 | 2 | 6 | 1 | 61 | 421.565 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.43 | 11.06 | -38.32 | 2 | 6 | 1 | 61 | 421.565 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 4.43 | 13.25 | -114.15 | 3 | 6 | 2 | 62 | 422.573 | 6 | ↓ |
