In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 26th, 2008 | 27 | No |
3-[(3-TRIFLUOROMETHYL)PHENYL]-5-[(4-CARBOXYPHENYL)METHYLENE]-2-THIOXO-4-THIAZOLIDINONE
4-[4-Oxo-2-thioxo-3-(3-trifluoromethyl-phenyl)-thiazolidin-5-ylidenemethyl]-benzoicacid
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) | 4.16 | 12.25 | -57.04 | 0 | 4 | -1 | 62 | 408.402 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
Target | CFTR | Selleck Chemicals |
No pre-computed analogs available. Try a structural similarity search.