COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL132749
Chemical Name: (4-butylpiperazin-1-yl)(3-{[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl}-1-ethyl-1H-pyrazol-4-yl)methanone
Smiles: CCCCN1CCN(CC1)C(=O)c1cn(nc1S(=O)(=O)N1CCN(CC1)c1cc(C)ccc1C)CC

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Molecular Weight: 516.71
Empirical Formula: C26H40N6O3S

Physical State: Dry powder
Available Amount: 36 mg

Lipinsky:
logP: 2.062
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 90
Number of rings: 4

     

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