| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 18th, 2006 | 31 | 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) | 3.42 | 10.21 | -46.94 | 0 | 7 | -1 | 96 | 420.441 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.42 | 1.89 | -16.09 | 1 | 7 | 0 | 93 | 421.449 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.84 | 1.76 | -25.82 | 0 | 7 | 0 | 89 | 421.449 | 8 | ↓ |
