COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK905918
Chemical Name: 5-(azepan-1-yl)-2-[(E)-{3-[2-(3,4-dimethoxyphenyl)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(c(c1)OC)OC

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Molecular Weight: 498.63
Empirical Formula: C24H26N4O4S2

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 2.611
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 149
Number of rings: 4

     

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