In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 18 | Yes |
Popular Name: (1S)-1-(1-ethylpyrazol-4-yl)-1-(3-fluoro-4-methyl-phenyl)-N-methyl-methanamine (1S)-1-(1-ethylpyrazol-4-yl)-1-(…
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) | 2.57 | 7.36 | -45.83 | 2 | 3 | 1 | 34 | 248.325 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.57 | 6.21 | -6.35 | 1 | 3 | 0 | 30 | 247.317 | 4 | ↓ |