COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK928558
Chemical Name: 2,2'-[(11-tert-butyl-10,11,12,13-tetrahydro[1]benzothieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine-3,7-diyl)disulfanediyl]bis(1-phenylethanone)
Smiles: O=C(c1ccccc1)CSc1nnc2n1c1sc3c(c1c1n2c(SCC(=O)c2ccccc2)nn1)CCC(C3)C(C)(C)C

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Molecular Weight: 626.83
Empirical Formula: C32H30N6O2S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 10.662
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 173
Number of rings: 7

     

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