COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK042494
Chemical Name: (5E)-2-[4-(3-chlorophenyl)piperazin-1-yl]-5-(thiophen-2-ylmethylidene)-1,3-thiazol-4(5H)-one
Smiles: Clc1cccc(c1)N1CCN(CC1)C1=NC(=O)/C(=C\c2cccs2)/S1

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Molecular Weight: 389.93
Empirical Formula: C18H16ClN3OS2

Physical State: Dry powder
Available Amount: 274 mg

Lipinsky:
logP: 3.92
Rotatable bonds: 1
H-donors: 0
H-acceptors: 1
PSA: 89
Number of rings: 4

     

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