COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL048192
Chemical Name: 4-(4-benzylpiperazin-1-yl)-N-[(2Z)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxobutanamide
Smiles: CCc1n[nH]/c(=N/C(=O)CCC(=O)N2CCN(CC2)Cc2ccccc2)/s1

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Molecular Weight: 387.51
Empirical Formula: C19H25N5O2S

Physical State: Dry powder
Available Amount: 66 mg

Lipinsky:
logP: 1.122
Rotatable bonds: 4
H-donors: 1
H-acceptors: 2
PSA: 102
Number of rings: 3

     

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