| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 5th, 2006 | 31 | 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) | 0.74 | 2.68 | -22.02 | 4 | 9 | 0 | 162 | 418.457 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.83 | -0.07 | -129.4 | 5 | 9 | 2 | 162 | 420.473 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 0.74 | 2.5 | -63.27 | 5 | 9 | 1 | 164 | 419.465 | 5 | ↓ |
