In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 29 | Yes |
Popular Name: 2-[(2,4-dimethylphenyl)methylsulfanyl]-6-methyl-5-(tetralin-6-ylmethyl)-3H-pyrimidin-4-one 2-[(2,4-dimethylphenyl)methylsul…
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) | 7.32 | 13.04 | -49.11 | 0 | 3 | -1 | 49 | 403.571 | 5 | ↓ |
Mid Mid (pH 6-8) | 6.87 | 14.15 | -10.41 | 1 | 3 | 0 | 46 | 404.579 | 5 | ↓ |