UCSF

ZINC39886739

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 25 No

Popular Name: (4-hydroxyphenyl)-dioxo-thioxo-BLAHcarboxamide (4-hydroxyphenyl)-dioxo-thioxo-B…

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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) 1.46 3.01 -46.38 3 7 -1 114 392.463 1 ↓
Mid Mid (pH 6-8) 1.22 1.63 -90.98 2 7 -2 117 391.455 2 ↓
Mid Mid (pH 6-8) 1.22 1.66 -98.15 2 7 -2 117 391.455 2 ↓
Mid Mid (pH 6-8) 1.22 1.75 -98.9 2 7 -2 117 391.455 2 ↓
Mid Mid (pH 6-8) 1.22 1.54 -90.62 2 7 -2 117 391.455 2 ↓

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