COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK154292
Chemical Name: N-(4-methoxybenzyl)-2-{[5-(4-nitrophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Smiles: C=CCn1c(SCC(=O)NCc2ccc(cc2)OC)nnc1c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 439.5
Empirical Formula: C21H21N5O4S

Physical State: Dry powder
Available Amount: 69 mg

Lipinsky:
logP: 4.33
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 140
Number of rings: 3

     

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