In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 30th, 2009 | 29 | Yes |
Popular Name: 6-acetyl-2-[(4-benzoylpiperazin-1-yl)methyl]-5-methyl-3H-thieno[4,5-e]pyrimidin-4-one 6-acetyl-2-[(4-benzoylpiperazin-…
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) | 1.62 | 7.11 | -19.33 | 1 | 7 | 0 | 86 | 410.499 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.62 | 8.61 | -88.94 | 2 | 7 | 1 | 88 | 411.507 | 4 | ↓ |