| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 24th, 2010 | 28 | 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) | 3.00 | 4 | -50.95 | 2 | 7 | -1 | 112 | 443.229 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.00 | 4.91 | -105.1 | 1 | 7 | -2 | 115 | 442.221 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.00 | 3.1 | -12.24 | 3 | 7 | 0 | 109 | 444.237 | 4 | ↓ |
