| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 14th, 2010 | 25 | 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) | 2.10 | 5.59 | -41.79 | 2 | 6 | -1 | 93 | 394.454 | 1 | ↓ |
| Mid Mid (pH 6-8) | 1.86 | 4.2 | -86.67 | 1 | 6 | -2 | 97 | 393.446 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.86 | 4.23 | -104.42 | 1 | 6 | -2 | 97 | 393.446 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.86 | 4.31 | -104.94 | 1 | 6 | -2 | 97 | 393.446 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.86 | 4.11 | -86.3 | 1 | 6 | -2 | 97 | 393.446 | 2 | ↓ |
