UCSF

ZINC02782017

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2004 24 Yes

Popular Name: [1-methyl-5-(trifluoromethyl)pyrazol-3-yl]-(4-pyridin-1-ium-2-ylpiperazino)methanone [1-methyl-5-(trifluoromethyl)pyr…

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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) 1.89 0.33 -37.2 1 6 1 55 340.329 3 ↓

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