COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK567957
Chemical Name: (5E)-2-[4-(3-chlorophenyl)piperazin-1-yl]-5-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-1,3-thiazol-4(5H)-one
Smiles: Clc1cccc(c1)N1CCN(CC1)C1=NC(=O)/C(=C\c2ccc(o2)c2ccccc2[N+](=O)[O-])/S1

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Molecular Weight: 494.96
Empirical Formula: C24H19ClN4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.062
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 120
Number of rings: 5

     

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