UCSF

ZINC20650473

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 27th, 2008 33 No

Popular Name: (2Z)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylene]-6-hydroxy-7-[[4-(2-hydroxyethyl)piperazin-1-yl] (2Z)-2-[(6-chloro-4H-1,3-benzodi…

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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) 2.58 4.57 -49.19 3 8 1 97 473.933 5 ↓
Mid Mid (pH 6-8) 2.58 2.24 -13.53 2 8 0 96 472.925 5 ↓
Mid Mid (pH 6-8) 2.58 5.03 -31.07 2 8 0 100 472.925 5 ↓
Mid Mid (pH 6-8) 2.58 2.7 -46.68 1 8 -1 98 471.917 5 ↓
Mid Mid (pH 6-8) 2.58 4.66 -45.62 3 8 1 97 473.933 5 ↓

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