COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL159662
Chemical Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]-4-{[2-(4-hydroxyphenyl)ethyl]amino}cyclobut-3-ene-1,2-dione
Smiles: Oc1ccc(cc1)CCNC1=C(C(=O)C1=O)N1CCN(CC1)c1cccc(c1)Cl

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Molecular Weight: 411.89
Empirical Formula: C22H22ClN3O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.659
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 72
Number of rings: 4

     

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