UCSF

ZINC02098042

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 31 No

Popular Name: 2-[4-({2-[(4-ethoxyphenyl)imino]-4-oxo-1,3-thiazolidin-5-ylidene}methyl)-2-methoxyphenoxy]propanoic acid 2-[4-({2-[(4-ethoxyphenyl)imino]…

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Other Names:

MFCD03696811

Download: MOL2 SDF SMILES Flexibase

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) 4.33 9.17 -54.31 1 8 -1 113 441.485 8 ↓
Ref Reference (pH 7) 4.33 9.58 -54.21 1 8 -1 113 441.485 8 ↓
Mid Mid (pH 6-8) 3.84 8.19 -97.07 0 8 -2 112 440.477 9 ↓

Activity (Go SEA)

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