UCSF

ZINC31881357

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 18th, 2009 36 No

Popular Name: Bis-2-((4-(2,3,6-trimethylphenoxy)butyl)amino)ethyldisulfide, dihydrochloride; Butylamine, N,N'-dithiodiethylenebis(4-(2,3,6-trimethylphenoxy)-, dihydrochloride; Disulfide, bis(2-((4-(2,3,6-trimethylphenoxy)butyl)amino)ethyl)-, dihydrochloride; LS-63074 Bis-2-((4-(2,3,6-trimethylphenox…

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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) 7.06 18.54 -107.78 4 4 2 52 534.876 19 ↓
Hi High (pH 8-9.5) 7.06 17.19 -48.43 3 4 1 47 533.868 19 ↓

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