In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 22nd, 2006 | 24 | No |
Popular Name: N-(5-chloro-2-methyl-phenyl)-2-cyano-3-(4-hydroxy-3-methoxy-phenyl)-prop-2-enamide N-(5-chloro-2-methyl-phenyl)-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) | 3.58 | 6.36 | -10.54 | 2 | 5 | 0 | 82 | 342.782 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.77 | 4.72 | -41.39 | 1 | 5 | -1 | 89 | 341.774 | 4 | ↓ |