COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK197816
Chemical Name: 2-{[5-benzyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methyl-3-nitrophenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(c(c2)[N+](=O)[O-])C)nnc1Cc1ccccc1

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Molecular Weight: 423.5
Empirical Formula: C21H21N5O3S

Physical State: Dry powder
Available Amount: 296 mg

Lipinsky:
logP: 5.145
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 130
Number of rings: 3

     

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