| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 2nd, 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) | 1.55 | 4.1 | -62.29 | 1 | 9 | -1 | 112 | 479.509 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.55 | 6.36 | -82.12 | 2 | 9 | 0 | 113 | 480.517 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.55 | 5.61 | -60.06 | 3 | 9 | 1 | 110 | 481.525 | 7 | ↓ |
