In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | Yes |
Popular Name: (2S,3S)-2-amino-1-[(2R)-2-benzylpyrrolidin-1-yl]-3-methyl-pentan-1-one (2S,3S)-2-amino-1-[(2R)-2-benzyl…
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) | 2.35 | 7.31 | -42.9 | 3 | 3 | 1 | 48 | 275.416 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.35 | 6.97 | -5.73 | 2 | 3 | 0 | 46 | 274.408 | 5 | ↓ |