COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK524527
Chemical Name: (2Z,4E)-4-(4-chlorobenzylidene)-3-methylpent-2-enedioicacid
Smiles: OC(=O)/C=C(\C(=C/c1ccc(cc1)Cl)\C(=O)O)/C

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Molecular Weight: 266.68
Empirical Formula: C13H11ClO4

Physical State: Dry powder
Available Amount: 228 mg

Lipinsky:
logP: 3.026
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 74
Number of rings: 1

     

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