In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2004 | 25 | No |
Popular Name: [(5E)-5-(4-allyloxybenzylidene)-4-keto-2-thiazolin-2-yl]-(2-bromophenyl)azanide [(5E)-5-(4-allyloxybenzylidene)-…
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) | 5.61 | 9.53 | -41.09 | 0 | 4 | -1 | 53 | 414.304 | 6 | ↓ |
Mid Mid (pH 6-8) | 5.61 | 10.25 | -13.08 | 1 | 4 | 0 | 51 | 415.312 | 6 | ↓ |