| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 7th, 2009 | 18 | 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) | -0.19 | 0.56 | -52.12 | 4 | 5 | 1 | 77 | 251.306 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.19 | 2.02 | -34.5 | 4 | 5 | 1 | 77 | 251.306 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.19 | 0.18 | -7.83 | 3 | 5 | 0 | 76 | 250.298 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.19 | 0.3 | -32.88 | 3 | 5 | 0 | 80 | 250.298 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.19 | 2.75 | -107.24 | 5 | 5 | 2 | 79 | 252.314 | 7 | ↓ |
