| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 9th, 2004 | 33 | 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) | 1.97 | 5.74 | -44.75 | 4 | 15 | 0 | 210 | 456.423 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.97 | 3.46 | -44.06 | 3 | 15 | -1 | 209 | 455.415 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.97 | 5.39 | -41.95 | 5 | 15 | 1 | 208 | 457.431 | 7 | ↓ |
