In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 12th, 2004 | 26 | No |
Popular Name: (5E)-3-(3-chlorophenyl)-5-[4-(diethylamino)benzylidene]thiazolidine-2,4-quinone (5E)-3-(3-chlorophenyl)-5-[4-(di…
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) | 4.54 | 11.73 | -9.46 | 0 | 4 | 0 | 42 | 386.904 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.54 | 11.85 | -34.12 | 1 | 4 | 0 | 44 | 387.912 | 5 | ↓ |