| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2010 | 18 | Yes |
Popular Name: 4-[methyl-[[3-(trifluoromethyl)phenyl]methyl]amino]butanenitrile 4-[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) | 2.34 | 9.33 | -54.68 | 1 | 2 | 1 | 28 | 257.279 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.34 | 7.01 | -9.58 | 0 | 2 | 0 | 27 | 256.271 | 6 | ↓ |
