UCSF

ZINC00161128

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 17 No

Popular Name: 4-[4-(tert-butyl)-1,3-thiazol-2-yl]benzaldehyde 4-[4-(tert-butyl)-1,3-thiazol-2-…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 175202-78-5 , [175202-78-5]

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) 4.52 1.57 -9.32 0 2 0 29 245.347 3 ↓

Vendor Notes

Note Type Comments Provided By
Mp [°C] 106 - 107 Acros Organics
S phrase S24/25: Avoid contact with skin and eyes. Acros Organics

Activity (Go SEA)

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