| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 8th, 2004 | 30 | No |
Popular Name: 2-butyryl-3-[2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethylimino]cyclohexanone 2-butyryl-3-[2-[2-methyl-5-(trif…
| 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) | 4.43 | 8.13 | -17.56 | 1 | 5 | 0 | 72 | 422.447 | 8 | ↓ |
| Hi High (pH 8-9.5) | 5.01 | 7.93 | -47.57 | 1 | 5 | -1 | 78 | 421.439 | 7 | ↓ |
