COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL199050
Chemical Name: 3-[(2E)-3-(3,4-dichlorophenyl)prop-2-enoyl]-4-hydroxy-6-methyl-2H-pyran-2-one
Smiles: Cc1cc(O)c(c(=O)o1)C(=O)/C=C/c1ccc(c(c1)Cl)Cl

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Molecular Weight: 325.15
Empirical Formula: C15H10Cl2O4

Physical State: Dry powder
Available Amount: 65 mg

Lipinsky:
logP: 3.394
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 63
Number of rings: 2

     

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