In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 10th, 2011 | 26 | Yes |
Popular Name: 2-(dimethylamino)-1-[(3R)-3-[4-(2-methoxyphenyl)piperazin-1-yl]-1-piperidyl]ethanone 2-(dimethylamino)-1-[(3R)-3-[4-(…
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) | 1.71 | 7.66 | -40.96 | 1 | 6 | 1 | 40 | 361.51 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.71 | 5.09 | -10.77 | 0 | 6 | 0 | 39 | 360.502 | 5 | ↓ |