COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK576020
Chemical Name: 4-({(E)-[4-(diethylamino)phenyl]methylidene}amino)-5-(3-ethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: CCOc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1ccc(cc1)N(CC)CC

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Molecular Weight: 395.53
Empirical Formula: C21H25N5OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.346
Rotatable bonds: 6
H-donors: 1
H-acceptors: 1
PSA: 84
Number of rings: 3

     

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