COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK663301
Chemical Name: tributyl4,4',4''-{1,3,5-triazine-2,4,6-triyltris[sulfanediyl(1-oxoethane-2,1-diyl)imino]}tribenzoate
Smiles: CCCCOC(=O)c1ccc(cc1)NC(=O)CSc1nc(SCC(=O)Nc2ccc(cc2)C(=O)OCCCC)nc(n1)SCC(=O)Nc1ccc(cc1)C(=O)OCCCC

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Molecular Weight: 877.08
Empirical Formula: C42H48N6O9S3

Physical State: Dry powder
Available Amount: 20 mg

Lipinsky:
logP: 11.992
Rotatable bonds: 18
H-donors: 3
H-acceptors: 9
PSA: 280
Number of rings: 4

     

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