COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK530569
Chemical Name: (2Z)-2-(4-methoxybenzylidene)butanedioicacid
Smiles: COc1ccc(cc1)/C=C(\C(=O)O)/CC(=O)O

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Molecular Weight: 236.22
Empirical Formula: C12H12O5

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 2.71
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 83
Number of rings: 1

     

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