| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 8th, 2006 | 33 | 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) | 3.27 | 10.71 | -13.3 | 2 | 9 | 0 | 107 | 439.479 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.45 | 10.11 | -42.16 | 1 | 9 | -1 | 113 | 438.471 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.44 | 10.99 | -41.37 | 3 | 9 | 1 | 112 | 440.487 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.27 | 10.97 | -50.71 | 3 | 9 | 1 | 108 | 440.487 | 6 | ↓ |
