COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK814070
Chemical Name: 11-[(5Z)-5-({3-[3-methyl-4-(2-methylpropoxy)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]undecanoicacid
Smiles: CC(COc1ccc(cc1C)c1nn(cc1/C=C/1\SC(=S)N(C1=O)CCCCCCCCCCC(=O)O)c1ccccc1)C

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Molecular Weight: 633.88
Empirical Formula: C35H43N3O4S2

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 8.819
Rotatable bonds: 17
H-donors: 1
H-acceptors: 4
PSA: 142
Number of rings: 4

     

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