UCSF

ZINC00109211

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 17 Yes

Popular Name: 3'-(Trifluoromethyl)pivalanilide 3'-(Trifluoromethyl)pivalanilide

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CAS Number: 1939-19-1

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) 3.69 3.17 -6.48 1 2 0 29 245.244 3 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP1020439A1 IBM Patent Data

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