COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL003070
Chemical Name: 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-N'-[(2E)-4-phenylbutan-2-ylidene]-1H-1,2,3-triazole-4-carbohydrazide
Smiles: Clc1ccc(cc1)SCc1c(nnn1c1nonc1N)C(=O)N/N=C(/CCc1ccccc1)\C

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Molecular Weight: 496.98
Empirical Formula: C22H21ClN8O2S

Physical State: Dry powder
Available Amount: 267 mg

Lipinsky:
logP: 2.866
Rotatable bonds: 6
H-donors: 3
H-acceptors: 2
PSA: 162
Number of rings: 4

     

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