UCSF

ZINC02167494

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 15 Yes

Popular Name: p-Tolyl benzyl sulfide p-Tolyl benzyl sulfide

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CAS Number: 5023-60-9

Other Names:

MFCD00027606

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) 4.41 10.08 -3.87 0 0 0 0 214.333 3 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0332331A2 IBM Patent Data

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