| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 23rd, 2007 | 36 | 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) | 3.54 | 6.78 | -61.22 | 1 | 8 | -1 | 102 | 493.58 | 11 | ↓ |
| Mid Mid (pH 6-8) | 3.99 | 8.96 | -49.59 | 3 | 8 | 1 | 101 | 495.596 | 10 | ↓ |
| Mid Mid (pH 6-8) | 2.96 | -2.53 | -51.47 | 2 | 8 | 1 | 97 | 495.596 | 11 | ↓ |
| Mid Mid (pH 6-8) | 3.54 | 9.12 | -80.09 | 2 | 8 | 0 | 104 | 494.588 | 11 | ↓ |
