COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK816641
Chemical Name: (5Z)-2-(4-benzylpiperazin-1-yl)-5-{[3-(3-chloro-4-propoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-1,3-thiazol-4(5H)-one
Smiles: CCCOc1ccc(cc1Cl)c1nn(cc1/C=C/1\SC(=NC1=O)N1CCN(CC1)Cc1ccccc1)c1ccccc1

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Saltdata: HCl
Molecular Weight: 598.17
Empirical Formula: C33H32ClN5O2S

Physical State: Dry powder
Available Amount: 105 mg

Lipinsky:
logP: 6.826
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 88
Number of rings: 6

     

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