| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 18th, 2009 | 23 | Yes |
Popular Name: 3-allyl-2-piperazin-1-yl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one 3-allyl-2-piperazin-1-yl-5,6,7,8…
| 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) | 2.35 | 8.85 | -56.3 | 2 | 5 | 1 | 55 | 331.465 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.35 | 7.43 | -9.22 | 1 | 5 | 0 | 50 | 330.457 | 3 | ↓ |
