UCSF

ZINC01587695

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 10 Yes

Popular Name: [(E)-1-methylprop-1-enyl]benzene [(E)-1-methylprop-1-enyl]benzene

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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) 2.92 7.14 -2.04 0 0 0 0 132.206 1 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0019787A2; US4344963; US4485252 IBM Patent Data
PUBCHEM_PATENT_ID EP0757586A1; US5503729; US5679228; US5679229; US5814197; US5948230; US6126805 IBM Patent Data

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