| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 7th, 2007 | 36 | 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) | 3.36 | 7.65 | -58.46 | 0 | 8 | -1 | 91 | 491.564 | 11 | ↓ |
| Mid Mid (pH 6-8) | 2.78 | 10.71 | -50.34 | 1 | 8 | 1 | 87 | 493.58 | 11 | ↓ |
| Mid Mid (pH 6-8) | 3.81 | 9.71 | -45.58 | 2 | 8 | 1 | 90 | 493.58 | 10 | ↓ |
| Mid Mid (pH 6-8) | 3.36 | 10 | -69.71 | 1 | 8 | 0 | 93 | 492.572 | 11 | ↓ |
