| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 10th, 2009 | 36 | 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) | -0.53 | 4.37 | -433.16 | 11 | 8 | 5 | 98 | 513.884 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.53 | 2.5 | -292.84 | 10 | 8 | 4 | 97 | 512.876 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.53 | 1.99 | -175.05 | 9 | 8 | 3 | 89 | 511.868 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.53 | 3.4 | -295.98 | 10 | 8 | 4 | 90 | 512.876 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.53 | 3.24 | -280.12 | 10 | 8 | 4 | 94 | 512.876 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.53 | 4.76 | -446.92 | 11 | 8 | 5 | 95 | 513.884 | 4 | ↓ |
