COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK111765
Chemical Name: 2-{[(5E)-5-{[1-(4-chlorophenyl)-1H-pyrrol-2-yl]methylidene}-2,4-dioxo-1,3-thiazolidin-3-yl]methyl}benzonitrile
Smiles: N#Cc1ccccc1CN1C(=O)S/C(=C/c2cccn2c2ccc(cc2)Cl)/C1=O

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Molecular Weight: 419.89
Empirical Formula: C22H14ClN3O2S

Physical State: Dry powder
Available Amount: 280 mg

Lipinsky:
logP: 5.124
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 91
Number of rings: 4

     

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