COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK843256
Chemical Name: 3-(4-{(5E)-5-[4-(diethylamino)benzylidene]-4-oxo-4,5-dihydro-1,3-thiazol-2-yl}piperazin-1-yl)propanenitrile
Smiles: N#CCCN1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(cc2)N(CC)CC)/S1

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Molecular Weight: 397.54
Empirical Formula: C21H27N5OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.052
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 88
Number of rings: 3

     

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