| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 16th, 2008 | 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 | 13.21 | -49.38 | 3 | 8 | 1 | 87 | 494.623 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.89 | 13.08 | -50.25 | 3 | 8 | 1 | 87 | 494.623 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.89 | 10.75 | -18.4 | 2 | 8 | 0 | 86 | 493.615 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.89 | 13.66 | -90.3 | 4 | 8 | 2 | 89 | 495.631 | 7 | ↓ |
