| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 16th, 2010 | 32 | Yes |
| 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) | 4.17 | 9.95 | -16.22 | 2 | 6 | 0 | 80 | 490.412 | 7 | ↓ |
| Hi High (pH 8-9.5) | 4.36 | 8.11 | -48.36 | 1 | 6 | -1 | 87 | 489.404 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 4.17 | 10.4 | -53.59 | 3 | 6 | 1 | 82 | 491.42 | 7 | ↓ |
