| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 13th, 2010 | 32 | No |
| 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) | 2.65 | 8.2 | -59.22 | 0 | 7 | -1 | 86 | 455.918 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.65 | 10.47 | -74.47 | 1 | 7 | 0 | 87 | 456.926 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.65 | 9.58 | -49.51 | 2 | 7 | 1 | 84 | 457.934 | 8 | ↓ |
