In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2011 | 24 | Yes |
Popular Name: (2S)-1-benzyl-N-[(1S)-1-(3-chlorophenyl)ethyl]pyrrolidine-2-carboxamide (2S)-1-benzyl-N-[(1S)-1-(3-chlor…
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) | 3.85 | 11.05 | -38.73 | 2 | 3 | 1 | 34 | 343.878 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.85 | 8.86 | -10.44 | 1 | 3 | 0 | 32 | 342.87 | 5 | ↓ |