In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 19 | Yes |
Popular Name: 3-allyl-2-piperazin-1-yl-thieno[2,3-d]pyrimidin-4-one 3-allyl-2-piperazin-1-yl-thieno[…
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) | 1.18 | 6.1 | -57.24 | 2 | 5 | 1 | 55 | 277.373 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.18 | 4.68 | -9.39 | 1 | 5 | 0 | 50 | 276.365 | 3 | ↓ |