| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 13th, 2007 | 30 | 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) | 3.80 | 1.67 | -49.74 | 2 | 7 | -1 | 111 | 426.449 | 5 | ↓ |
| Ref Reference (pH 7) | 3.61 | 4.37 | -42.29 | 2 | 7 | -1 | 107 | 426.449 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.79 | 5.63 | -38.78 | 3 | 7 | 0 | 112 | 427.457 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.15 | 6.32 | -14.56 | 3 | 7 | 0 | 104 | 427.457 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.34 | 3.6 | -14.62 | 3 | 7 | 0 | 108 | 427.457 | 5 | ↓ |
