In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 11th, 2008 | 29 | No |
Popular Name: (5Z)-1-(4-chlorophenyl)-2-sulfanyl-5-[(2,3,4-trimethoxyphenyl)methylene]pyrimidine-4,6-dione (5Z)-1-(4-chlorophenyl)-2-sulfan…
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) | 2.94 | 7.91 | -40.67 | 0 | 7 | -1 | 86 | 431.877 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.48 | 8.99 | -11.46 | 1 | 7 | 0 | 83 | 432.885 | 5 | ↓ |