UCSF

ZINC00162465

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 14 No

Popular Name: 1,2-EPOXY-3-(4-NITROPHENOXY)PROPANE 1,2-EPOXY-3-(4-NITROPHENOXY)PROPANE

Find On: PubMed — Wikipedia — Google

CAS Numbers: 125279-81-4 , 5255-75-4 , [5255-75-4]

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) 1.79 3.82 -9.59 0 5 0 68 195.174 4 ↓

Vendor Notes

Note Type Comments Provided By
MP 54-55° Oakwood Chemical
Purity 97% Fluorochem
UniProt Database Links GSTT1_HUMAN ChEBI

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Analogs ( Draw Identity 99% 90% 80% 70% )