UCSF

ZINC14255508

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 5th, 2008 31 No

Popular Name: 5-(3,4-Dimethoxy-6-methyl-2,5-benzoquinonyl)-5-phenyl-1-morpholino-1-oxopentane; LS-92730; Morpholine, 4-(5-(4,5-dimethoxy-3,6-dioxo-2-methyl-1,4-cyclohexadien-1-yl)-1-oxo-5-phenylpentyl)- 5-(3,4-Dimethoxy-6-methyl-2,5-be…

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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) 2.64 10.03 -14.44 0 7 0 82 427.497 8 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0240233A1; US4774241 IBM Patent Data

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Rings

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

No pre-computed analogs available. Try a structural similarity search.