COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295361
Chemical Name: 5-[({2-[(7-oxo-7H-benzimidazo[2,1-a]benzo[de]isoquinolin-3-yl)sulfanyl]phenyl}amino)methylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Smiles: S=C1NC(=O)C(=CNc2ccccc2Sc2ccc3c4c2cccc4c(=O)n2c3nc3c2cccc3)C(=O)N1

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Molecular Weight: 547.62
Empirical Formula: C29H17N5O3S2

Physical State: Dry powder
Available Amount: 1155 mg

Lipinsky:
logP: 5.249
Rotatable bonds: 2
H-donors: 3
H-acceptors: 3
PSA: 162
Number of rings: 7

     

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