| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 34 | No |
None
| 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) | 3.82 | 8.56 | -43.21 | 4 | 7 | 1 | 95 | 475.594 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.82 | 7.81 | -51.44 | 2 | 7 | -1 | 93 | 473.578 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.82 | 8.98 | -52.43 | 3 | 7 | 0 | 97 | 474.586 | 7 | ↓ |
| Mid Mid (pH 6-8) | 3.82 | 7.39 | -18.3 | 3 | 7 | 0 | 90 | 474.586 | 7 | ↓ |
![1-[3-(1H-indol-3-yl)-5-phenyl-2-pyrazolin-1-yl]-2-(2-thenylamino)ethanone](http://zinc12.docking.org/img/rings/547802.gif)
