COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK831044
Chemical Name: methyl[(3-benzyl-4-oxo-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
Smiles: COC(=O)CSc1nc2sc3c(c2c(=O)n1Cc1ccccc1)CCCCC3

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Molecular Weight: 414.55
Empirical Formula: C21H22N2O3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.312
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 112
Number of rings: 4

     

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