COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL346723
Chemical Name: 2-({[1-(4-amino-1,2,5-oxadiazol-3-yl)-4-({(2E)-2-[4-(methylsulfanyl)benzylidene]hydrazinyl}carbonyl)-1H-1,2,3-triazol-5-yl]methyl}amino)benzamide
Smiles: CSc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CNc1ccccc1C(=O)N)c1nonc1N

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Molecular Weight: 492.52
Empirical Formula: C21H20N10O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.527
Rotatable bonds: 5
H-donors: 6
H-acceptors: 3
PSA: 217
Number of rings: 4

     

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