In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 21 | Yes |
Popular Name: 3,5-dimethyl-4-oxo-2-piperazin-1-yl-thieno[2,3-d]pyrimidine-6-carboxamide 3,5-dimethyl-4-oxo-2-piperazin-1…
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) | -0.03 | 2.21 | -65.06 | 4 | 7 | 1 | 98 | 308.387 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.03 | 0.79 | -14.19 | 3 | 7 | 0 | 93 | 307.379 | 2 | ↓ |