| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 28th, 2008 | 28 | 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) | 1.27 | 9.3 | -18.99 | 2 | 9 | 0 | 111 | 375.392 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.46 | 6.05 | -52.46 | 1 | 9 | -1 | 112 | 374.384 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.27 | 8.8 | -47.37 | 1 | 9 | -1 | 109 | 374.384 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.27 | 9.28 | -18.68 | 2 | 9 | 0 | 111 | 375.392 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.46 | 6.53 | -18.95 | 2 | 9 | 0 | 114 | 375.392 | 3 | ↓ |
