UCSF

ZINC19593540

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 4th, 2008 16 Yes

Popular Name: 2-Trifluoromethyl-1H-benzoimidazole-5-carboxylic acid 2-Trifluoromethyl-1H-benzoimidaz…

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CAS Numbers: 82791-93-3 , N/A

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) 2.32 4.83 -47.79 1 4 -1 69 229.137 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 284-285° Matrix Scientific
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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

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