| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2011 | 20 | Yes |
Popular Name: 6-[[(1S)-2-(4-fluorophenyl)-1-methyl-ethyl]amino]pyridine-3-carboxylic 6-[[(1S)-2-(4-fluorophenyl)-1-me…
| 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) | 2.77 | 8.87 | -46.15 | 2 | 4 | 0 | 66 | 274.295 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.77 | 8.39 | -51.68 | 1 | 4 | -1 | 65 | 273.287 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
