COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK737184
Chemical Name: {4-[(5-benzyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-3-nitrophenyl}(pyridin-2-yl)methanone
Smiles: [O-][N+](=O)c1cc(ccc1Sc1nnc(n1C)Cc1ccccc1)C(=O)c1ccccn1

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Molecular Weight: 431.47
Empirical Formula: C22H17N5O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.253
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 131
Number of rings: 4

     

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