| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 18th, 2011 | 19 | No |
Popular Name: (2S,3S)-2-cyano-3-sulfanyl-N-[4-(trifluoromethyl)phenyl]butanamide (2S,3S)-2-cyano-3-sulfanyl-N-[4-…
| 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) | 2.85 | 6.11 | -11.92 | 1 | 3 | 0 | 53 | 288.294 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.85 | 6.66 | -48.91 | 1 | 3 | -1 | 53 | 287.286 | 4 | ↓ |
