UCSF

ZINC02513721

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 13 No

Popular Name: 1,3-di-tert-Butyl-1H-imidazol-3-ium chloride 1,3-di-tert-Butyl-1H-imidazol-3-…

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1,3-Di-t-butylimidazolium chloride , 157197-54-1 , 263163-17-3 , [157197-54-1]

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) -1.11 9.24 -22.81 0 2 1 9 181.303 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 210 TCI

Activity (Go SEA)

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

No pre-computed analogs available. Try a structural similarity search.