UCSF

ZINC32497013

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 1st, 2009 13 Yes

Popular Name: 1-(4-Fluoro-phenyl)-N*1*,N*1*-dimethyl-ethane-1,2-diamine 1-(4-Fluoro-phenyl)-N*1*,N*1*-di…

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CAS Numbers: 842954-71-6 , [842954-71-6]

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) 0.89 2.45 -47.76 3 2 1 31 183.25 3 ↓

Vendor Notes

Note Type Comments Provided By
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks
Warnings IRRITANT Matrix Scientific

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