COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK664479
Chemical Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-1-[4-(pyrimidin-2-yl)piperazin-1-yl]butan-1-one
Smiles: O=C(N1CCN(CC1)c1ncccn1)CCCSc1nc2c(s1)cccc2

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Molecular Weight: 399.54
Empirical Formula: C19H21N5OS2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.775
Rotatable bonds: 5
H-donors: 0
H-acceptors: 1
PSA: 115
Number of rings: 4

     

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