In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2010 | 21 | No |
Popular Name: (E)-3-(3-chloro-5-ethoxy-4-hydroxy-phenyl)-2-cyano-N-cyclopropyl-prop-2-enamide (E)-3-(3-chloro-5-ethoxy-4-hydro…
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) | 2.41 | 4.4 | -9.91 | 2 | 5 | 0 | 82 | 306.749 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.41 | 5.33 | -45.2 | 1 | 5 | -1 | 85 | 305.741 | 5 | ↓ |