In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2009 | 24 | Yes |
Popular Name: 3-[2-(4-isopropylpiperazin-1-yl)-2-oxo-ethyl]-5,6-dimethyl-thieno[3,2-e]pyrimidin-4-one 3-[2-(4-isopropylpiperazin-1-yl)…
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) | 1.33 | 7.2 | -19.57 | 0 | 6 | 0 | 58 | 348.472 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.33 | 9.43 | -56.25 | 1 | 6 | 1 | 60 | 349.48 | 3 | ↓ |