In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 27 | Yes |
Popular Name: 2-[(4-acetylpiperazin-1-yl)methyl]-5-(p-tolyl)-3H-thieno[2,3-d]pyrimidin-4-one 2-[(4-acetylpiperazin-1-yl)methy…
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) | 2.08 | 7.28 | -19.32 | 1 | 6 | 0 | 69 | 382.489 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.08 | 9.46 | -63.86 | 2 | 6 | 1 | 70 | 383.497 | 3 | ↓ |