COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL158880
Chemical Name: 3-[(3-chlorobenzyl)amino]-4-[4-(4-fluorophenyl)piperazin-1-yl]cyclobut-3-ene-1,2-dione
Smiles: Fc1ccc(cc1)N1CCN(CC1)C1=C(C(=O)C1=O)NCc1cccc(c1)Cl

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Molecular Weight: 399.85
Empirical Formula: C21H19ClFN3O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.854
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 52
Number of rings: 4

     

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