UCSF

ZINC18213336

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2008 31 No

Popular Name: (4E,5R)-4-[(4-chlorophenyl)-hydroxy-methylene]-5-(3-ethoxy-4-hydroxy-phenyl)-1-thiazol-2-yl-pyrrolid (4E,5R)-4-[(4-chlorophenyl)-hydr…

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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) 3.52 7.72 -61.18 1 7 -1 103 455.899 6 ↓
Mid Mid (pH 6-8) 2.94 8.03 -14.51 1 7 0 97 456.907 6 ↓
Mid Mid (pH 6-8) 3.52 7.67 -15.2 2 7 0 100 456.907 6 ↓

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