In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2004 | 27 | Yes |
Popular Name: benzyl-[[4-keto-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-2-yl]methyl]-methyl-ammonium benzyl-[[4-keto-5-(p-tolyl)-3H-t…
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) | 4.22 | 12.42 | -55.37 | 2 | 4 | 1 | 50 | 376.505 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.22 | 10.11 | -12.63 | 1 | 4 | 0 | 49 | 375.497 | 5 | ↓ |