| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 21 | Yes |
Popular Name: (4S)-4-amino-N-[(1R,2R,4R)-2,4-dimethylcyclohexyl]-4-phenyl-butanamide (4S)-4-amino-N-[(1R,2R,4R)-2,4-d…
| 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) | 1.23 | 7.39 | -54.34 | 4 | 3 | 1 | 57 | 289.443 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.23 | 7.05 | -9.24 | 3 | 3 | 0 | 55 | 288.435 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
