COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK707405
Chemical Name: 5-(azepan-1-yl)-2-[(E)-{3-[2-(4-methoxyphenyl)ethyl]-4-oxo-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)CCc1ccc(cc1)OC

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Molecular Weight: 468.6
Empirical Formula: C23H24N4O3S2

Physical State: Dry powder
Available Amount: 402 mg

Lipinsky:
logP: 2.789
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 139
Number of rings: 4

     

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