In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 17th, 2010 | 18 | Yes |
Popular Name: [(3R)-1-[(1R)-2-(2-methoxyphenyl)-1-methyl-ethyl]pyrrolidin-3-yl]methanamine [(3R)-1-[(1R)-2-(2-methoxyphenyl…
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) | 1.79 | 4.84 | -45.09 | 3 | 3 | 1 | 40 | 249.378 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.79 | 5.67 | -31.62 | 3 | 3 | 1 | 40 | 249.378 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.