| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2010 | 21 | No |
Popular Name: (1S)-1-cyclohexyl-N-[(2,4-difluoro-5-nitro-phenyl)methyl]ethanamine (1S)-1-cyclohexyl-N-[(2,4-difluo…
| 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) | 4.26 | 9.67 | -52 | 2 | 4 | 1 | 62 | 299.341 | 5 | ↓ |
| Hi High (pH 8-9.5) | 4.26 | 8.61 | -4.96 | 1 | 4 | 0 | 58 | 298.333 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
