COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL037439
Chemical Name: methyl4-{[(5-{[(4-hydroxy-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}benzoate
Smiles: COC(=O)c1ccc(cc1)CSc1nnc(n1c1ccccc1)CSc1nc(O)c2c(n1)sc(c2C)C

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Molecular Weight: 549.7
Empirical Formula: C26H23N5O3S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.782
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 181
Number of rings: 5

     

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