In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2008 | 28 | Yes |
Popular Name: (2,4-dimethoxyphenyl)-[(3S)-1-[(2,3,6-trifluorophenyl)methyl]-3-piperidyl]methanone (2,4-dimethoxyphenyl)-[(3S)-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) | 4.05 | 11.51 | -42.14 | 1 | 4 | 1 | 40 | 394.413 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.05 | 9.28 | -12.38 | 0 | 4 | 0 | 39 | 393.405 | 6 | ↓ |