In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 18 | Yes |
Popular Name: (3S)-N-[(3-chloro-4-fluoro-phenyl)methyl]quinuclidin-3-amine (3S)-N-[(3-chloro-4-fluoro-pheny…
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) | 2.92 | 7.39 | -37.28 | 2 | 2 | 1 | 16 | 269.771 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.92 | 8.32 | -122.92 | 3 | 2 | 2 | 21 | 270.779 | 3 | ↓ |