COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK722400
Chemical Name: 3-butyl-2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CCCCn1c(SCC(=O)c2ccc(cc2)Cl)nc2c(c1=O)c1CCCCCc1s2

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Molecular Weight: 461.05
Empirical Formula: C23H25ClN2O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.193
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 103
Number of rings: 4

     

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