In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 18 | Yes |
Popular Name: (2S)-3-[[(1S,2R)-2-amino-1-(4-fluorophenyl)propyl]-methyl-amino]-2-methyl-propanenitrile (2S)-3-[[(1S,2R)-2-amino-1-(4-fl…
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) | 1.83 | 4.64 | -53.4 | 3 | 3 | 1 | 55 | 250.341 | 5 | ↓ |