| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 16th, 2007 | 35 | 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) | 3.18 | 6.57 | -59.04 | 0 | 8 | -1 | 91 | 520.389 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.60 | -0.69 | -56.5 | 1 | 8 | 1 | 86 | 522.405 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.63 | 8.85 | -49.18 | 2 | 8 | 1 | 90 | 522.405 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.18 | 8.97 | -70.58 | 1 | 8 | 0 | 93 | 521.397 | 8 | ↓ |
