COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK230233
Chemical Name: 2-{[5-{2-[(2-methoxyphenyl)amino]-2-oxoethyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methyl-4-nitrophenyl)acetamide
Smiles: C=CCn1c(SCC(=O)Nc2ccc(cc2C)[N+](=O)[O-])nnc1CC(=O)Nc1ccccc1OC

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Molecular Weight: 496.55
Empirical Formula: C23H24N6O5S

Physical State: Dry powder
Available Amount: 168 mg

Lipinsky:
logP: 4.488
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 169
Number of rings: 3

     

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