COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK138708
Chemical Name: 4-methoxy-N-{[5-({2-[(4-nitrophenyl)amino]-2-oxoethyl}sulfanyl)-4-phenyl-4H-1,2,4-triazol-3-yl]methyl}benzamide
Smiles: COc1ccc(cc1)C(=O)NCc1nnc(n1c1ccccc1)SCC(=O)Nc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 518.55
Empirical Formula: C25H22N6O5S

Physical State: Dry powder
Available Amount: 152 mg

Lipinsky:
logP: 5.397
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 169
Number of rings: 4

     

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