In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 20th, 2008 | 24 | No |
Popular Name: (2Z,5S)-5-[(2-nitrophenyl)methyl]-2-(o-tolylimino)thiazolidin-4-one (2Z,5S)-5-[(2-nitrophenyl)methyl…
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) | 3.52 | 9.63 | -11.07 | 1 | 6 | 0 | 87 | 341.392 | 4 | ↓ |
Ref Reference (pH 7) | 3.52 | 9.93 | -11.41 | 1 | 6 | 0 | 87 | 341.392 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.52 | 9.34 | -45.94 | 0 | 6 | -1 | 89 | 340.384 | 5 | ↓ |