| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 13th, 2010 | 30 | No |
None
| 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) | 4.04 | 8.18 | -18.53 | 2 | 7 | 0 | 93 | 422.51 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.23 | 6.53 | -48.39 | 1 | 7 | -1 | 100 | 421.502 | 7 | ↓ |
