In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 20 | No |
Popular Name: 2-[4-[2-[(3R)-3-methyl-1-piperidyl]ethoxy]phenyl]thioacetamide 2-[4-[2-[(3R)-3-methyl-1-piperid…
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) | 2.27 | 8.41 | -37.96 | 3 | 3 | 1 | 40 | 293.456 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.27 | 6.14 | -11.69 | 2 | 3 | 0 | 38 | 292.448 | 6 | ↓ |