In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2011 | 16 | Yes |
Popular Name: (2S)-2-ethyl-4-[[(3R)-3-ethylpyrrolidin-3-yl]methyl]morpholine (2S)-2-ethyl-4-[[(3R)-3-ethylpyr…
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) | 1.92 | 3.73 | -40.38 | 2 | 3 | 1 | 29 | 227.372 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.92 | 5.38 | -102.56 | 3 | 3 | 2 | 30 | 228.38 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.