COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK387722
Chemical Name: methyl4-[(5E)-5-{[1-(4-chlorobenzyl)-1H-indol-3-yl]methylidene}-3-methyl-4,6-dioxo-2-thioxotetrahydropyrimidin-1(2H)-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)N1C(=O)/C(=C/c2cn(c3c2cccc3)Cc2ccc(cc2)Cl)/C(=O)N(C1=S)C

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Molecular Weight: 544.03
Empirical Formula: C29H22ClN3O4S

Physical State: Dry powder
Available Amount: 96 mg

Lipinsky:
logP: 5.62
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 103
Number of rings: 5

     

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