In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 18 | Yes |
Popular Name: [(2R)-pyrrolidin-2-yl]-[(3R)-3-pyrrolidin-1-yl-1-piperidyl]methanone [(2R)-pyrrolidin-2-yl]-[(3R)-3-p…
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) | 0.66 | 6.02 | -98.71 | 3 | 4 | 2 | 41 | 253.39 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.66 | 4.69 | -36.33 | 2 | 4 | 1 | 37 | 252.382 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.