In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2011 | 18 | Yes |
Popular Name: (2R)-2-[4-(pyrrolidin-1-ylmethyl)-1-piperidyl]cyclopentanone (2R)-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) | 1.61 | 9.48 | -92.72 | 2 | 3 | 2 | 26 | 252.402 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.61 | 7.08 | -35.95 | 1 | 3 | 1 | 25 | 251.394 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.