COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK208527
Chemical Name: 4-{[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}but-2-yn-1-yl3-chloro-1-benzothiophene-2-carboxylate
Smiles: Brc1cccc(c1)c1nnc(o1)SCC#CCOC(=O)c1sc2c(c1Cl)cccc2

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Molecular Weight: 519.83
Empirical Formula: C21H12BrClN2O3S2

Physical State: Dry powder
Available Amount: 103 mg

Lipinsky:
logP: 9.063
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 118
Number of rings: 4

     

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