COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK905990
Chemical Name: 5-(azepan-1-yl)-2-{(E)-[4-oxo-3-(2-phenylethyl)-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}-1,3-oxazole-4-carbonitrile
Smiles: N#Cc1nc(oc1N1CCCCCC1)/C=C\1/SC(=S)N(C1=O)CCc1ccccc1

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Molecular Weight: 438.57
Empirical Formula: C22H22N4O2S2

Physical State: Dry powder
Available Amount: 405 mg

Lipinsky:
logP: 2.874
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 130
Number of rings: 4

     

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