COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL376872
Chemical Name: dimethyl2-[({[5-(morpholin-4-ylmethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzene-1,4-dicarboxylate
Smiles: COC(=O)c1ccc(cc1NC(=O)CSc1nnc(n1c1ccccc1)CN1CCOCC1)C(=O)OC

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Molecular Weight: 525.59
Empirical Formula: C25H27N5O6S

Physical State: Dry powder
Available Amount: 566 mg

Lipinsky:
logP: 5.047
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 150
Number of rings: 4

     

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