COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK086226
Chemical Name: 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: COc1ccc(cc1)n1c(SCC(=O)c2ccc(cc2)Br)nc2c(c1=O)c1CCCc1s2

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Molecular Weight: 527.46
Empirical Formula: C24H19BrN2O3S2

Physical State: Dry powder
Available Amount: 467 mg

Lipinsky:
logP: 6.218
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 112
Number of rings: 5

     

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