In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 18th, 2011 | 16 | Yes |
Popular Name: 4-[[(3S)-3-ethylpyrrolidin-3-yl]methyl]-2,2-dimethyl-morpholine 4-[[(3S)-3-ethylpyrrolidin-3-yl]…
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) | 1.86 | 4.15 | -39.37 | 2 | 3 | 1 | 29 | 227.372 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.86 | 5.24 | -103.62 | 3 | 3 | 2 | 30 | 228.38 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.