| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2011 | 24 | Yes |
Popular Name: (2S)-4-[2-methyl-6-(trifluoromethyl)-4-quinolyl]piperazine-2-carboxylic (2S)-4-[2-methyl-6-(trifluoromet…
| 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) | 1.01 | 8.38 | -69.25 | 3 | 5 | 1 | 74 | 340.325 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.01 | 8 | -38.01 | 2 | 5 | 0 | 73 | 339.317 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
