COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK950464
Chemical Name: (2E)-2-(3-chloro-4-methylphenyl)but-2-enedioicacid
Smiles: OC(=O)/C=C(\c1ccc(c(c1)Cl)C)/C(=O)O

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Molecular Weight: 240.64
Empirical Formula: C11H9ClO4

Physical State: Dry powder
Available Amount: 22 mg

Lipinsky:
logP: 3.219
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 74
Number of rings: 1

     

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