UCSF

ZINC01892842

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 9th, 2004 20 No

Popular Name: butyl 4-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)benzoate butyl 4-(2,5-dioxo-2,5-dihydro-1…

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CAS Numbers: , 174603-73-7 , N/A

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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) 2.67 2.63 -10.54 0 5 0 65 273.288 6 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

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