COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK091975
Chemical Name: methyl4-[({[4-(4-chlorophenyl)-5-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COc1ccc(cc1)c1nnc(n1c1ccc(cc1)Cl)SCC(=O)Nc1ccc(cc1)C(=O)OC

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Molecular Weight: 508.98
Empirical Formula: C25H21ClN4O4S

Physical State: Dry powder
Available Amount: 410 mg

Lipinsky:
logP: 7.529
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 120
Number of rings: 4

     

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