UCSF

ZINC02574106

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 27th, 2004 17 Yes

Popular Name: 3'-(Trifluoromethyl)[1,1'-biphenyl]-3-amine 3'-(Trifluoromethyl)[1,1'-biphen…

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CAS Numbers: 400749-02-2 , 811842-42-9 , [400749-02-2] , [811842-42-9]

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) 3.66 1.86 -4.78 2 1 0 26 237.224 2 ↓

Vendor Notes

Note Type Comments Provided By
BP 165-166° Oakwood Chemical
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.