COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL048939
Chemical Name: (5E)-5-[(1-benzyl-1H-indol-3-yl)methylidene]-1-(2,5-dimethylphenyl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Smiles: Cc1ccc(c(c1)N1C(=NC(=O)/C(=C\c2cn(c3c2cccc3)Cc2ccccc2)/C1=O)S)C

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Molecular Weight: 465.58
Empirical Formula: C28H23N3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.65
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 93
Number of rings: 5

     

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