| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 7th, 2010 | 14 | 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) | 1.11 | 5.49 | -8.51 | 0 | 3 | 0 | 47 | 257.083 | 1 | ↓ |
| Ref Reference (pH 7) | 1.86 | 5.32 | -39.06 | 0 | 3 | -1 | 53 | 256.075 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.86 | 5.32 | -39.08 | 0 | 3 | -1 | 53 | 256.075 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.86 | 3.59 | -9.29 | 1 | 3 | 0 | 50 | 257.083 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.86 | 3.59 | -9.31 | 1 | 3 | 0 | 50 | 257.083 | 1 | ↓ |
