COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL365986
Chemical Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(4-methyl-5-{[(methylsulfonyl)(phenyl)amino]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetamide
Smiles: O=C(NCc1ccc2c(c1)OCO2)CSc1nnc(n1C)CN(S(=O)(=O)C)c1ccccc1

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Molecular Weight: 489.58
Empirical Formula: C21H23N5O5S2

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 2.241
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 149
Number of rings: 4

     

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