COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK639089
Chemical Name: 4-(3-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-N-(prop-2-en-1-yl)piperazine-1-carbothioamide
Smiles: C=CCNC(=S)N1CCN(CC1)c1nc2sc3c(c2c(=O)n1CCCC)CCCC3

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Molecular Weight: 445.65
Empirical Formula: C22H31N5OS2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.037
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 111
Number of rings: 4

     

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