UCSF

ZINC57286243

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 18th, 2011 33 No

Popular Name: 1,3-dimethyl-9-[[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]methyl]purine-2,6-dione 1,3-dimethyl-9-[[4-[2-nitro-4-(t…

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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) 2.45 11.24 -19.1 0 11 0 114 467.408 5 ↓

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