| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 8th, 2007 | 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) | 2.01 | 8.14 | -57.32 | 0 | 8 | -1 | 105 | 434.453 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.43 | 8.48 | -14.58 | 0 | 8 | 0 | 99 | 435.461 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.46 | 7.67 | -19 | 1 | 8 | 0 | 102 | 435.461 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.75 | 4.68 | -47.38 | 1 | 7 | 1 | 71 | 344.391 | 3 | ↓ |
