| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 1st, 2009 | 32 | 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) | 3.13 | 7.87 | -54.29 | 1 | 7 | 1 | 66 | 437.516 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.13 | 4.9 | -11.65 | 0 | 7 | 0 | 64 | 436.508 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.13 | 7.24 | -52.8 | 1 | 7 | 1 | 66 | 437.516 | 5 | ↓ |
