In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 6th, 2009 | 23 | No |
Popular Name: 5,6-dimethyl-2-[(4-prop-2-enoylpiperazin-1-yl)methyl]-3H-thieno[3,2-e]pyrimidin-4-one 5,6-dimethyl-2-[(4-prop-2-enoylp…
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) | 1.11 | 4.93 | -18.26 | 1 | 6 | 0 | 69 | 332.429 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.11 | 6.39 | -77.78 | 2 | 6 | 1 | 70 | 333.437 | 3 | ↓ |