COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK728123
Chemical Name: 3-[(4-methylbenzyl)sulfanyl]-5-(4-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole
Smiles: C=CCn1c(SCc2ccc(cc2)C)nnc1c1ccc(cc1)C

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Molecular Weight: 335.47
Empirical Formula: C20H21N3S

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 6.389
Rotatable bonds: 4
H-donors: 0
H-acceptors: 0
PSA: 56
Number of rings: 3

     

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