COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK829949
Chemical Name: 2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-7-methyl-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Smiles: C=CCn1c(SCc2ccc3c(c2)OCO3)nc2c(c1=O)c1CCC(Cc1s2)C

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Molecular Weight: 426.56
Empirical Formula: C22H22N2O3S2

Physical State: Dry powder
Available Amount: 429 mg

Lipinsky:
logP: 5.829
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 104
Number of rings: 5

     

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