COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL161108
Chemical Name: 3-{[2-(cyclohex-1-en-1-yl)ethyl]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)NCCC1=CCCCC1

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Molecular Weight: 383.47
Empirical Formula: C22H26FN3O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.241
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 52
Number of rings: 4

     

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