In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 18 | Yes |
Popular Name: [5-(2-ethylphenoxy)-1,3-dimethyl-pyrazol-4-yl]methanamine [5-(2-ethylphenoxy)-1,3-dimethyl…
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) | 2.47 | 4.53 | -42.98 | 3 | 4 | 1 | 55 | 246.334 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.47 | 4.13 | -5.82 | 2 | 4 | 0 | 53 | 245.326 | 4 | ↓ |