| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 21st, 2008 | 23 | 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) | 0.26 | -1.46 | -31.74 | 6 | 11 | 0 | 169 | 363.292 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.91 | 0.94 | -130.91 | 4 | 11 | -2 | 169 | 361.276 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.27 | -1.28 | -53.54 | 7 | 11 | 1 | 170 | 364.3 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.27 | -5.65 | -53.72 | 7 | 11 | 1 | 170 | 364.3 | 4 | ↓ |
