| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 26 | Yes |
Popular Name: (2,6-dimethoxyphenyl)-[(3S)-3-(2-fluorophenyl)-4-methyl-piperazin-1-yl]methanone (2,6-dimethoxyphenyl)-[(3S)-3-(2…
| 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) | 2.51 | 6.67 | -17.6 | 0 | 5 | 0 | 42 | 358.413 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.51 | 8.59 | -47.86 | 1 | 5 | 1 | 43 | 359.421 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
