UCSF

ZINC01654116

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 18 Yes

Popular Name: 1,4-Diphenoxybutane 1,4-Diphenoxybutane

Find On: PubMed — Wikipedia — Google

CAS Numbers: 3459-88-9 , [3459-88-9] , [345991-04-0]

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) 4.22 1.27 -5.54 0 2 0 18 242.318 7 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0341551A1; EP0341551B1; WO1998023637A1 IBM Patent Data

Activity (Go SEA)

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