COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK740413
Chemical Name: (2Z)-3-(azepan-1-yl)-2-[5-(2,3-dichlorobenzyl)-4-oxo-3-phenyl-1,3-thiazolidin-2-ylidene]-3-oxopropanenitrile
Smiles: N#C/C(=C\1/SC(C(=O)N1c1ccccc1)Cc1cccc(c1Cl)Cl)/C(=O)N1CCCCCC1

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Molecular Weight: 500.45
Empirical Formula: C25H23Cl2N3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.773
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 89
Number of rings: 4

     

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