In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 16 | Yes |
Popular Name: (2R)-2-amino-1-[(3S)-3-pyrrolidin-1-yl-1-piperidyl]propan-1-one (2R)-2-amino-1-[(3S)-3-pyrrolidi…
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) | -0.31 | 3.74 | -89.02 | 4 | 4 | 2 | 52 | 227.352 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.31 | 3.43 | -35.97 | 3 | 4 | 1 | 51 | 226.344 | 2 | ↓ |