COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK186776
Chemical Name: 2-[(5-{2-[(2,3-dichlorophenyl)amino]-2-oxoethyl}-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methyl-4-nitrophenyl)acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc(cc2C)[N+](=O)[O-])nnc1CC(=O)Nc1cccc(c1Cl)Cl

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Molecular Weight: 523.4
Empirical Formula: C21H20Cl2N6O4S

Physical State: Dry powder
Available Amount: 205 mg

Lipinsky:
logP: 5.051
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 160
Number of rings: 3

     

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