In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 7th, 2008 | 25 | No |
Popular Name: (2E,5Z)-2-(2,3-dichlorophenyl)imino-5-[(3-nitrophenyl)methylene]thiazolidin-4-one (2E,5Z)-2-(2,3-dichlorophenyl)im…
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) | 5.84 | 9.89 | -16.71 | 1 | 6 | 0 | 91 | 394.239 | 3 | ↓ |
Hi High (pH 8-9.5) | 6.29 | 7.03 | -44.14 | 0 | 6 | -1 | 94 | 393.231 | 3 | ↓ |
Hi High (pH 8-9.5) | 6.29 | 7.55 | -51.58 | 0 | 6 | -1 | 94 | 393.231 | 3 | ↓ |