COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK177444
Chemical Name: 4-(1,3-benzothiazol-2-ylsulfanyl)but-2-yn-1-ylthiophene-2-carboxylate
Smiles: O=C(c1cccs1)OCC#CCSc1nc2c(s1)cccc2

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Molecular Weight: 345.47
Empirical Formula: C16H11NO2S3

Physical State: Dry powder
Available Amount: 493 mg

Lipinsky:
logP: 5.429
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 120
Number of rings: 3

     

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