In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2011 | 22 | No |
Popular Name: (E)-3-(3-chlorophenyl)-N-[2-(2-cyanoethyl)-5-methyl-pyrazol-3-yl]prop-2-enamide (E)-3-(3-chlorophenyl)-N-[2-(2-c…
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) | 2.37 | 8.84 | -15.28 | 1 | 5 | 0 | 71 | 314.776 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.