COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL375297
Chemical Name: (5Z)-5-{[1-(4-nitrobenzyl)-1H-indol-3-yl]methylidene}-3-propyl-2-thioxoimidazolidin-4-one
Smiles: CCCN1C(=S)N/C(=C\c2cn(c3c2cccc3)Cc2ccc(cc2)[N+](=O)[O-])/C1=O

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Molecular Weight: 420.49
Empirical Formula: C22H20N4O3S

Physical State: Dry powder
Available Amount: 700 mg

Lipinsky:
logP: 4.845
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 115
Number of rings: 4

     

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