In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2010 | 18 | No |
Popular Name: (Z)-3-(2-bromo-4-hydroxy-5-methoxy-phenyl)-2-cyano-N-methyl-prop-2-enamide (Z)-3-(2-bromo-4-hydroxy-5-metho…
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) | 1.39 | 2.06 | -7.94 | 2 | 5 | 0 | 82 | 311.135 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.39 | 2.99 | -46.83 | 1 | 5 | -1 | 85 | 310.127 | 3 | ↓ |