COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK554386
Chemical Name: 2-{[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfanyl}-3-(4-chlorophenyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: Clc1ccc(cc1)n1c(SCC(=O)c2ccc3c(c2)OCO3)nc2c(c1=O)c1CCCc1s2

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Molecular Weight: 496.99
Empirical Formula: C24H17ClN2O4S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.544
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 121
Number of rings: 6

     

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