In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 17 | Yes |
Popular Name: (2S)-2-(cyclopropylamino)-2-[2-(difluoromethoxy)phenyl]acetonitrile (2S)-2-(cyclopropylamino)-2-[2-(…
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) | 2.40 | 5.03 | -7.36 | 1 | 3 | 0 | 45 | 238.237 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.40 | 5.94 | -44.97 | 2 | 3 | 1 | 50 | 239.245 | 5 | ↓ |