In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 18 | Yes |
Popular Name: (2S)-2-amino-N-[4-methyl-3-(trifluoromethyl)phenyl]butanamide (2S)-2-amino-N-[4-methyl-3-(trif…
None
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) | 2.13 | 3.84 | -46.48 | 4 | 3 | 1 | 57 | 261.267 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.13 | 3.51 | -6.8 | 3 | 3 | 0 | 55 | 260.259 | 4 | ↓ |