| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 22nd, 2010 | 37 | 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) | 3.89 | 13.14 | -49.05 | 3 | 8 | 1 | 87 | 494.623 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.89 | 10.77 | -14.74 | 2 | 8 | 0 | 86 | 493.615 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.89 | 13.63 | -84.97 | 4 | 8 | 2 | 89 | 495.631 | 7 | ↓ |
