In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2010 | 16 | Yes |
Popular Name: (1S,2R)-2-(4-propyl-1-piperidyl)cyclopentanecarbonitrile (1S,2R)-2-(4-propyl-1-piperidyl)…
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) | 3.79 | 9.21 | -35.81 | 1 | 2 | 1 | 28 | 221.368 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.79 | 7.45 | -5.8 | 0 | 2 | 0 | 27 | 220.36 | 3 | ↓ |