COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK561536
Chemical Name: methyl2-({[(5-{[(4-amino-6,7-dihydro-5H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}amino)benzoate
Smiles: COC(=O)c1ccccc1NC(=O)CSc1nnc(n1c1ccccc1)CSc1nc(N)c2c(n1)sc1c2CCC1

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Molecular Weight: 603.75
Empirical Formula: C28H25N7O3S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 8.675
Rotatable bonds: 8
H-donors: 3
H-acceptors: 3
PSA: 216
Number of rings: 6

     

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