COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL340441
Chemical Name: 4-({[4-oxo-3-(prop-2-en-1-yl)-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl]sulfanyl}methyl)benzonitrile
Smiles: C=CCn1c(SCc2ccc(cc2)C#N)nc2c(c1=O)c1CCCCc1s2

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Molecular Weight: 393.53
Empirical Formula: C21H19N3OS2

Physical State: Dry powder
Available Amount: 145 mg

Lipinsky:
logP: 4.912
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 110
Number of rings: 4

     

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