UCSF

ZINC19957705

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2008 18 Yes

Popular Name: 5-(4-Difluoromethoxy-phenyl)-1 H -pyrazole-3-carboxylic acid 5-(4-Difluoromethoxy-phenyl)-1 H…

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CAS Number: 1046468-64-7

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) 2.42 3.72 -45.71 1 5 -1 78 253.184 4 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

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