In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 29th, 2009 | 33 | Yes |
Popular Name: 2-[(4-cyclohexylphenyl)methylsulfanyl]-6-methyl-5-(tetralin-6-ylmethyl)-3H-pyrimidin-4-one 2-[(4-cyclohexylphenyl)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) | 8.62 | 15.59 | -48.33 | 0 | 3 | -1 | 49 | 457.663 | 6 | ↓ |
Mid Mid (pH 6-8) | 8.34 | 16.71 | -10 | 1 | 3 | 0 | 46 | 458.671 | 6 | ↓ |