COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK744044
Chemical Name: N-(1,3-benzodioxol-5-yl)-2-({5-[(2-methyl-5-nitro-1H-imidazol-1-yl)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
Smiles: O=C(Nc1ccc2c(c1)OCO2)CSc1nnc(n1c1ccccc1)Cn1c(C)ncc1[N+](=O)[O-]

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Molecular Weight: 493.5
Empirical Formula: C22H19N7O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.306
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 167
Number of rings: 5

     

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