COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL365631
Chemical Name: 2-[(4-ethyl-5-{[(4-fluorophenyl)(methylsulfonyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)acetamide
Smiles: CCn1c(SCC(=O)Nc2ccc3c(c2)[nH]c(=O)[nH]3)nnc1CN(S(=O)(=O)C)c1ccc(cc1)F

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Molecular Weight: 519.58
Empirical Formula: C21H22FN7O4S2

Physical State: Dry powder
Available Amount: 632 mg

Lipinsky:
logP: 2.899
Rotatable bonds: 6
H-donors: 3
H-acceptors: 4
PSA: 172
Number of rings: 4

     

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