In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2011 | 17 | Yes |
Popular Name: (2S,6R)-2,6-dimethyl-1-[[(3R)-3-propylpyrrolidin-3-yl]methyl]piperidine (2S,6R)-2,6-dimethyl-1-[[(3R)-3-…
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) | 3.34 | 6.88 | -98.57 | 3 | 2 | 2 | 21 | 240.435 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.34 | 4.73 | -40.81 | 2 | 2 | 1 | 20 | 239.427 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.