COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL157061
Chemical Name: 3-[4-(3-chlorophenyl)piperazin-1-yl]-4-{[(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)methyl]amino}cyclobut-3-ene-1,2-dione
Smiles: CCn1nc(c(c1C)CNC1=C(C(=O)C1=O)N1CCN(CC1)c1cccc(c1)Cl)C

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Molecular Weight: 427.93
Empirical Formula: C22H26ClN5O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.528
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 70
Number of rings: 4

     

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