| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2009 | 18 | Yes |
Popular Name: (3S)-3-[[3-(trifluoromethyl)phenyl]methylamino]pentanenitrile (3S)-3-[[3-(trifluoromethyl)phen…
| 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) | 2.69 | 6.65 | -6.66 | 1 | 2 | 0 | 36 | 256.271 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.69 | 7.86 | -50.66 | 2 | 2 | 1 | 40 | 257.279 | 6 | ↓ |
