In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2010 | 20 | No |
Popular Name: (5Z)-5-[[1-methyl-3-(3-pyridyl)pyrazol-4-yl]methylene]-2-thioxo-thiazolidin-4-one (5Z)-5-[[1-methyl-3-(3-pyridyl)p…
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) | 1.26 | 2.57 | -45.75 | 0 | 5 | -1 | 67 | 301.376 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.80 | 4.64 | -11.37 | 1 | 5 | 0 | 64 | 302.384 | 2 | ↓ |