COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK118454
Chemical Name: 4-(2-{(E)-[3-(2-cyanobenzyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl}-1H-pyrrol-1-yl)benzoicacid
Smiles: N#Cc1ccccc1CN1C(=O)S/C(=C/c2cccn2c2ccc(cc2)C(=O)O)/C1=O

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Molecular Weight: 429.46
Empirical Formula: C23H15N3O4S

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 4.206
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 128
Number of rings: 4

     

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