In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 11th, 2009 | 17 | Yes |
Popular Name: (2S)-N-[(1R)-1-(2-bromophenyl)ethyl]pyrrolidine-2-carboxamide (2S)-N-[(1R)-1-(2-bromophenyl)et…
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) | 2.31 | 5.14 | -42.39 | 3 | 3 | 1 | 46 | 298.204 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.31 | 3.91 | -13.28 | 2 | 3 | 0 | 41 | 297.196 | 3 | ↓ |