| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2009 | 36 | 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) | 1.42 | 4.82 | -59.44 | 1 | 10 | -1 | 120 | 491.524 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.42 | 7.09 | -71.11 | 2 | 10 | 0 | 121 | 492.532 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.42 | 6.35 | -57.14 | 3 | 10 | 1 | 118 | 493.54 | 7 | ↓ |
