COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL157455
Chemical Name: 3-[(4-chlorobenzyl)amino]-4-[4-(3-chlorophenyl)piperazin-1-yl]cyclobut-3-ene-1,2-dione
Smiles: Clc1ccc(cc1)CNC1=C(C(=O)C1=O)N1CCN(CC1)c1cccc(c1)Cl

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Molecular Weight: 416.31
Empirical Formula: C21H19Cl2N3O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.723
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 52
Number of rings: 4

     

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