UCSF

ZINC31176427

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 7th, 2009 11 Yes

Popular Name: 4-Amino-2-trifluoromethylpyridine 4-Amino-2-trifluoromethylpyridine

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CAS Numbers: 147149-98-2 , [147149-98-2]

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) 1.08 1.68 -7.66 2 2 0 39 162.114 1 ↓
Lo Low (pH 4.5-6) 1.08 2.02 -31.29 3 2 1 40 163.122 1 ↓

Vendor Notes

Note Type Comments Provided By
Purity 97% Matrix Scientific
Warnings IRRITANT Matrix Scientific

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