In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2005 | 27 | No |
Popular Name: 1-(4-fluorophenyl)-5-[(2-methyl-1H-indol-3-yl)methylene]-2-sulfanyl-pyrimidine-4,6-dione 1-(4-fluorophenyl)-5-[(2-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) | 2.97 | 8.76 | -48.93 | 1 | 5 | -1 | 74 | 378.408 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.51 | 9.84 | -14.16 | 2 | 5 | 0 | 71 | 379.416 | 2 | ↓ |