| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 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) | 3.12 | 8.69 | -58.06 | 0 | 10 | -1 | 128 | 494.524 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.12 | 10.96 | -79.16 | 1 | 10 | 0 | 129 | 495.532 | 10 | ↓ |
| Lo Low (pH 4.5-6) | 3.12 | 10.2 | -67.81 | 2 | 10 | 1 | 126 | 496.54 | 10 | ↓ |
