| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 35 | 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) | 3.27 | 9.53 | -50.49 | 2 | 8 | 1 | 83 | 496.588 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.27 | 7.3 | -18.69 | 1 | 8 | 0 | 81 | 495.58 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.27 | 9.53 | -42.95 | 2 | 8 | 1 | 83 | 496.588 | 7 | ↓ |
