In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2010 | 22 | No |
Popular Name: 6-[(E)-2-(2,4-dichlorophenyl)vinyl]-2-isopropylsulfanyl-4,4-dimethyl-1H-pyrimidine 6-[(E)-2-(2,4-dichlorophenyl)vin…
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) | 5.82 | 11.52 | -31.01 | 1 | 2 | 1 | 26 | 356.342 | 4 | ↓ |
Ref Reference (pH 7) | 5.82 | 11.22 | -8.33 | 0 | 2 | 0 | 25 | 355.334 | 4 | ↓ |
Lo Low (pH 4.5-6) | 5.82 | 11.83 | -26.09 | 1 | 2 | 1 | 26 | 356.342 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.