| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 23rd, 2010 | 20 | Yes |
Popular Name: (2S)-2-amino-N-[4-methyl-3-(trifluoromethyl)phenyl]butanediamide (2S)-2-amino-N-[4-methyl-3-(trif…
| 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) | 1.48 | -0 | -44.38 | 6 | 5 | 1 | 100 | 290.265 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.48 | -0.35 | -11.37 | 5 | 5 | 0 | 98 | 289.257 | 5 | ↓ |
