| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 15th, 2010 | 27 | Yes |
Popular Name: (2S)-N-butyl-2-[4-[(1S)-2-(3-fluoroanilino)-1-methyl-2-oxo-ethyl]piperazin-1-yl]propanamide (2S)-N-butyl-2-[4-[(1S)-2-(3-flu…
| 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) | 2.38 | 3.81 | -17.29 | 2 | 6 | 0 | 65 | 378.492 | 8 | ↓ |
| Lo Low (pH 4.5-6) | 2.38 | 6.06 | -41.47 | 3 | 6 | 1 | 66 | 379.5 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
