In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2006 | 25 | No |
Popular Name: 5-(benzo[1,3]dioxol-5-ylmethylene)-2-(3,4-dimethylphenyl)imino-thiazolidin-4-one 5-(benzo[1,3]dioxol-5-ylmethylen…
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) | 5.36 | 7.64 | -9.44 | 1 | 5 | 0 | 64 | 352.415 | 2 | ↓ |
Mid Mid (pH 6-8) | 4.87 | 7.72 | -43.45 | 0 | 5 | -1 | 63 | 351.407 | 3 | ↓ |
Lo Low (pH 4.5-6) | 4.87 | 8.03 | -16.08 | 1 | 5 | 0 | 60 | 352.415 | 3 | ↓ |