In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2011 | 17 | Yes |
Popular Name: (2S)-2-[4-(pyrrolidin-1-ylmethyl)-1-piperidyl]propanoic (2S)-2-[4-(pyrrolidin-1-ylmethyl…
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) | -0.33 | 8.99 | -77.36 | 2 | 4 | 1 | 49 | 241.355 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.33 | 6.78 | -63.63 | 1 | 4 | 0 | 48 | 240.347 | 4 | ↓ |