In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 20 | Yes |
Popular Name: (2R)-1-[(1S,2S)-2-amino-1-phenyl-propyl]-N,N-dimethyl-pyrrolidine-2-carboxamide (2R)-1-[(1S,2S)-2-amino-1-phenyl…
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) | 0.43 | 6.94 | -101.34 | 4 | 4 | 2 | 52 | 277.412 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.43 | 4.31 | -40.63 | 3 | 4 | 1 | 51 | 276.404 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.43 | 5.56 | -32.87 | 3 | 4 | 1 | 51 | 276.404 | 4 | ↓ |