| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 1st, 2009 | 20 | Yes |
Popular Name: (2S)-2-amino-N-ethyl-N-[(1R)-1-(4-fluorophenyl)ethyl]butanediamide (2S)-2-amino-N-ethyl-N-[(1R)-1-(…
| 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) | 1.25 | 1.83 | -41.29 | 5 | 5 | 1 | 91 | 282.339 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 1.49 | -13.31 | 4 | 5 | 0 | 89 | 281.331 | 6 | ↓ |
