UCSF

ZINC02560240

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 15 Yes

Popular Name: 4-(Trifluoromethylthio)phenylacetic acid 4-(Trifluoromethylthio)phenylace…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 102582-93-4 , 243977-23-3 , [243977-23-3]

Download: MOL2 SDF SMILES Flexibase

Physical Representations

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) 5.34 2.25 -43.51 0 2 -1 40 235.206 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 114-118° Oakwood Chemical
Purity 95% Fluorochem
Purity 97% Matrix Scientific
Purity 98% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )