| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 17 | Yes |
Popular Name: (2S)-2-[(N-ethyl-4-methyl-anilino)methyl]cyclopentanone (2S)-2-[(N-ethyl-4-methyl-anilin…
| 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) | 3.31 | 9.01 | -6.84 | 0 | 2 | 0 | 20 | 231.339 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.31 | 9.52 | -16.56 | 1 | 2 | 0 | 22 | 232.347 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
