In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 24th, 2008 | 15 | Yes |
Popular Name: (1S,2S,4R)-2-(3,5-dimethylpyrazol-1-yl)-4-methyl-cyclohexan-1-amine (1S,2S,4R)-2-(3,5-dimethylpyrazo…
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) | 1.10 | 5.09 | -51.84 | 3 | 3 | 1 | 45 | 208.329 | 1 | ↓ |
Lo Low (pH 4.5-6) | 1.10 | 5.05 | -98.32 | 4 | 3 | 2 | 47 | 209.337 | 1 | ↓ |