COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL162480
Chemical Name: 3-[4-(4-fluorophenyl)piperazin-1-yl]-4-[(3-hydroxypropyl)amino]cyclobut-3-ene-1,2-dione
Smiles: OCCCNC1=C(C(=O)C1=O)N1CCN(CC1)c1ccc(cc1)F

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Molecular Weight: 333.36
Empirical Formula: C17H20FN3O3

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 0.137
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 72
Number of rings: 3

     

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