In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 19 | Yes |
Popular Name: (1S)-N-[(3-chloro-4-fluoro-phenyl)methyl]-1-(4-fluorophenyl)ethanamine (1S)-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) | 4.39 | 9.52 | -54.61 | 2 | 1 | 1 | 17 | 282.741 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.39 | 8.39 | -5.2 | 1 | 1 | 0 | 12 | 281.733 | 4 | ↓ |