In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2010 | 24 | Yes |
Popular Name: 4-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]thieno[2,3-d]pyrimidine 4-[4-[(4-ethylphenyl)methyl]pipe…
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) | 3.73 | 12.08 | -43.55 | 1 | 4 | 1 | 33 | 339.488 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.73 | 9.88 | -6.79 | 0 | 4 | 0 | 32 | 338.48 | 4 | ↓ |