In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 28th, 2008 | 31 | Yes |
Popular Name: (4-benzylpiperazin-1-yl)-(4-diethylamino-2,5-dimethyl-thieno[4,5-e]pyrimidin-6-yl)methanone (4-benzylpiperazin-1-yl)-(4-diet…
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) | 3.71 | 10.34 | -8.15 | 0 | 6 | 0 | 53 | 437.613 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.71 | 12.62 | -48.93 | 1 | 6 | 1 | 54 | 438.621 | 6 | ↓ |