In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 20 | Yes |
Popular Name: 5-(4-chloro-3,5-dimethyl-phenoxy)-1,3-dimethyl-pyrazole-4-carboxylic 5-(4-chloro-3,5-dimethyl-phenoxy…
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) | 3.42 | 7.63 | -50.84 | 0 | 5 | -1 | 67 | 293.73 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.42 | 7.74 | -41.42 | 1 | 5 | 0 | 68 | 294.738 | 3 | ↓ |