In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 19 | Yes |
Popular Name: (2S)-2-amino-N-[2-chloro-6-(trifluoromethyl)phenyl]-3-methyl-butanamide (2S)-2-amino-N-[2-chloro-6-(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) | 2.58 | 5.06 | -43.21 | 4 | 3 | 1 | 57 | 295.712 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.58 | 4.78 | -7.17 | 3 | 3 | 0 | 55 | 294.704 | 4 | ↓ |