UCSF

ZINC01845506

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2004 11 Yes

Popular Name: (1-methoxy-1-methyl-ethyl)benzene (1-methoxy-1-methyl-ethyl)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) 2.70 1.61 -3.24 0 1 0 9 150.221 2 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID US5703017; US5840722; US6030975 IBM Patent Data

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