| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 17 | Yes |
Popular Name: 3-[methyl-[[3-(trifluoromethyl)phenyl]methyl]amino]propanenitrile 3-[methyl-[[3-(trifluoromethyl)p…
| 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) | 2.07 | 6.22 | -7.8 | 0 | 2 | 0 | 27 | 242.244 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.07 | 8.57 | -54.8 | 1 | 2 | 1 | 28 | 243.252 | 5 | ↓ |
