In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2011 | 15 | Yes |
Popular Name: (2S,5R)-2,5-dimethyl-4-[[(3R)-3-methylpyrrolidin-3-yl]methyl]morpholine (2S,5R)-2,5-dimethyl-4-[[(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) | 1.41 | 3.26 | -39.92 | 2 | 3 | 1 | 29 | 213.345 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.41 | 4.61 | -100.59 | 3 | 3 | 2 | 30 | 214.353 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.