In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2008 | 28 | Yes |
Popular Name: 2-benzylsulfanyl-5-[(4-isobutoxyphenyl)methyl]-6-methyl-1H-pyrimidin-4-one 2-benzylsulfanyl-5-[(4-isobutoxy…
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) | 6.49 | 10.31 | -49.35 | 0 | 4 | -1 | 58 | 393.532 | 8 | ↓ |
Mid Mid (pH 6-8) | 6.04 | 11.18 | -14.76 | 1 | 4 | 0 | 55 | 394.54 | 8 | ↓ |