In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 25 | No |
Popular Name: (Z)-N-(4-chlorophenyl)-2-(3-methylisoxazol-5-yl)-3-(3-pyridylamino)prop-2-enamide (Z)-N-(4-chlorophenyl)-2-(3-meth…
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) | 2.66 | 7.26 | -10.34 | 2 | 6 | 0 | 80 | 354.797 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.66 | 7.56 | -42.94 | 3 | 6 | 1 | 81 | 355.805 | 5 | ↓ |