In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 31st, 2009 | 24 | No |
Popular Name: (5E)-2-(2-chloroanilino)-5-[(4-nitrophenyl)methylene]thiazol-4-one (5E)-2-(2-chloroanilino)-5-[(4-n…
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) | 5.23 | 9.42 | -13.45 | 1 | 6 | 0 | 91 | 359.794 | 3 | ↓ |
Ref Reference (pH 7) | 4.74 | 9.3 | -37.73 | 0 | 6 | -1 | 90 | 358.786 | 4 | ↓ |
Hi High (pH 8-9.5) | 5.69 | 7.16 | -44.13 | 0 | 6 | -1 | 94 | 358.786 | 3 | ↓ |