In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2004 | 22 | Yes |
Popular Name: 1-phenyl-3-(4-pyridyl)pyrazole-4-carboxylic-acid-ethyl-ester 1-phenyl-3-(4-pyridyl)pyrazole-4…
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) | 2.18 | 8.91 | -10.22 | 0 | 5 | 0 | 57 | 293.326 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.18 | 9.36 | -34.38 | 1 | 5 | 1 | 58 | 294.334 | 5 | ↓ |