COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK132864
Chemical Name: methyl3-{[({5-[3-(4-methoxyphenyl)propyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate
Smiles: COc1ccc(cc1)CCCc1nnc(n1C)SCC(=O)Nc1cccc(c1)C(=O)OC

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Molecular Weight: 454.55
Empirical Formula: C23H26N4O4S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 4.598
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 120
Number of rings: 3

     

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