COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL049838
Chemical Name: N-(4-bromo-3-methylphenyl)-N'-[(2E)-5-propyl-1,3,4-thiadiazol-2(3H)-ylidene]butanediamide
Smiles: CCCc1n[nH]/c(=N\C(=O)CCC(=O)Nc2ccc(c(c2)C)Br)/s1

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Molecular Weight: 411.32
Empirical Formula: C16H19BrN4O2S

Physical State: Dry powder
Available Amount: 161 mg

Lipinsky:
logP: 3.248
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 108
Number of rings: 2

     

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