In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 7th, 2007 | 32 | Yes |
Popular Name: 1-(4-benzyl-1-piperidyl)-2-[(2-chloro-5,6,7,8-tetrahydroacridin-9-yl)sulfanyl]ethanone 1-(4-benzyl-1-piperidyl)-2-[(2-c…
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) | 6.58 | 15.45 | -9.98 | 0 | 3 | 0 | 33 | 465.062 | 5 | ↓ |
Lo Low (pH 4.5-6) | 6.58 | 15.69 | -36.84 | 1 | 3 | 1 | 34 | 466.07 | 5 | ↓ |