| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 13th, 2009 | 37 | 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) | 3.02 | 12.88 | -52.27 | 1 | 9 | -1 | 118 | 496.595 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.02 | 13.18 | -62.5 | 2 | 9 | 0 | 119 | 497.603 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.02 | 13.34 | -24.62 | 2 | 9 | 0 | 120 | 497.603 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.02 | 13.64 | -45.4 | 3 | 9 | 1 | 121 | 498.611 | 6 | ↓ |
