In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 20 | Yes |
Popular Name: (1R)-N-[(1S)-1-(3-chloro-4-fluoro-phenyl)ethyl]-1-(1,5-dimethylpyrazol-4-yl)ethanamine (1R)-N-[(1S)-1-(3-chloro-4-fluor…
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) | 3.38 | 8.19 | -46.66 | 2 | 3 | 1 | 34 | 296.797 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.38 | 7.39 | -8.8 | 1 | 3 | 0 | 30 | 295.789 | 4 | ↓ |