In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 19 | No |
Popular Name: (2S,4S)-2-[4-(trifluoromethylsulfanyl)phenyl]thiazolidine-4-carboxylic (2S,4S)-2-[4-(trifluoromethylsul…
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) | 3.81 | 6.63 | -38.15 | 2 | 3 | 0 | 57 | 309.334 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.81 | 5.79 | -47.28 | 1 | 3 | -1 | 52 | 308.326 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.