UCSF

ZINC16688276

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 5th, 2008 34 No

Popular Name: (5Z)-1-[2-chloro-5-(trifluoromethyl)phenyl]-5-[(3-ethoxy-4-hydroxy-5-nitro-phenyl)methylene]hexahydr (5Z)-1-[2-chloro-5-(trifluoromet…

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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) 3.85 5.77 -47.55 1 10 -1 150 498.777 6 ↓
Mid Mid (pH 6-8) 3.85 6.71 -98.84 0 10 -2 153 497.769 6 ↓
Mid Mid (pH 6-8) 3.85 6.85 -99.43 0 10 -2 153 497.769 6 ↓
Lo Low (pH 4.5-6) 3.85 6.55 -40.48 1 10 -1 150 498.777 6 ↓
Lo Low (pH 4.5-6) 3.39 8.33 -17.23 2 10 0 147 499.785 6 ↓

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