In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 19 | Yes |
Popular Name: 2-[(3S)-3-methyl-1-piperidyl]-1-(2,4,5-trimethylphenyl)ethanone 2-[(3S)-3-methyl-1-piperidyl]-1-…
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) | 3.84 | 10.83 | -37.3 | 1 | 2 | 1 | 22 | 260.401 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.84 | 8.65 | -5.64 | 0 | 2 | 0 | 20 | 259.393 | 3 | ↓ |