| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 10th, 2011 | 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) | -4.92 | -2.64 | -502.09 | 3 | 21 | -5 | 334 | 583.105 | 10 | ↓ |
| Hi High (pH 8-9.5) | -4.72 | -4.72 | -579.28 | 2 | 21 | -6 | 337 | 582.097 | 10 | ↓ |
| Mid Mid (pH 6-8) | -4.92 | -3.8 | -351.79 | 4 | 21 | -4 | 331 | 584.113 | 10 | ↓ |
