In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 20 | Yes |
Popular Name: 1-[1,3-dimethyl-5-(2,3,5-trimethylphenoxy)pyrazol-4-yl]-N-methyl-methanamine 1-[1,3-dimethyl-5-(2,3,5-trimeth…
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) | 3.18 | 6.86 | -37.7 | 2 | 4 | 1 | 44 | 274.388 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.18 | 5.41 | -5.81 | 1 | 4 | 0 | 39 | 273.38 | 4 | ↓ |