In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2008 | 14 | Yes |
Popular Name: (1R,2S)-2-(3,5-dimethylpyrazol-1-yl)cyclohexan-1-amine (1R,2S)-2-(3,5-dimethylpyrazol-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) | 1.09 | 4.59 | -45.33 | 3 | 3 | 1 | 45 | 194.302 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.09 | 4.56 | -98.82 | 4 | 3 | 2 | 47 | 195.31 | 1 | ↓ |