UCSF

ZINC03192097

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 7th, 2004 14 No

Popular Name: 2,2,2-trifluoro-N-(3-methylphenyl)acetamide 2,2,2-trifluoro-N-(3-methylpheny…

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CAS Number: N/A

Other Names:

MFCD00583987

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) 2.47 4.46 -5.42 1 2 0 29 203.163 2 ↓
Hi High (pH 8-9.5) 2.65 2.79 -38.33 0 2 -1 35 202.155 2 ↓

Activity (Go SEA)

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