COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406899
Chemical Name: (5E)-2-[(2-chlorophenyl)amino]-5-[5-nitro-2-(piperidin-1-yl)benzylidene]-1,3-thiazol-4(5H)-one
Smiles: O=C1N=C(S/C/1=C/c1cc(ccc1N1CCCCC1)[N+](=O)[O-])Nc1ccccc1Cl

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Molecular Weight: 442.93
Empirical Formula: C21H19ClN4O3S

Physical State: Dry powder
Available Amount: 227 mg

Lipinsky:
logP: 5.942
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 115
Number of rings: 4

     

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