UCSF

ZINC12338666

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 16th, 2008 16 Yes

Popular Name: 2-(trifluoromethyl)imidazo[1,2-a]pyridine-3-carboxylic acid 2-(trifluoromethyl)imidazo[1,2-a…

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CAS Numbers: 73221-19-9 , [73221-19-9]

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) 2.25 5.35 -52.83 0 4 -1 57 229.137 2 ↓
Mid Mid (pH 6-8) 2.25 5.75 -42.81 1 4 0 59 230.145 2 ↓

Vendor Notes

Note Type Comments Provided By
melting_point 194 - 196 KeyOrganics
MP 194-196° Matrix Scientific
Purity >95% Matrix Scientific
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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

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