In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2011 | 16 | Yes |
Popular Name: (2R)-1-[(3S)-3-(1-piperidyl)pyrrolidin-1-yl]butan-2-amine (2R)-1-[(3S)-3-(1-piperidyl)pyrr…
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) | 1.14 | 4.4 | -87.43 | 4 | 3 | 2 | 35 | 227.396 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.14 | 2.24 | -40.75 | 3 | 3 | 1 | 34 | 226.388 | 4 | ↓ |