COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK130226
Chemical Name: 4-methoxy-N-{[4-methyl-5-({2-[(2-methyl-4-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}benzamide
Smiles: COc1ccc(cc1)C(=O)NCc1nnc(n1C)SCC(=O)Nc1ccc(cc1C)[N+](=O)[O-]

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Molecular Weight: 470.51
Empirical Formula: C21H22N6O5S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.668
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 169
Number of rings: 3

     

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