| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 14th, 2011 | 40 | 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) | -5.45 | 1.58 | -220.51 | 7 | 16 | -1 | 238 | 575.688 | 25 | ↓ |
| Hi High (pH 8-9.5) | -5.45 | 3.58 | -166.88 | 8 | 16 | 0 | 239 | 576.696 | 25 | ↓ |
| Mid Mid (pH 6-8) | -5.45 | 4 | -213.47 | 9 | 16 | 1 | 240 | 577.704 | 25 | ↓ |
| Mid Mid (pH 6-8) | -5.45 | 5.7 | -221.03 | 10 | 16 | 2 | 242 | 578.712 | 25 | ↓ |
