COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL132902
Chemical Name: azepan-1-yl(3-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]sulfonyl}-1-methyl-1H-pyrazol-4-yl)methanone
Smiles: O=C(c1cn(nc1S(=O)(=O)N1CCN(CC1)c1cc(Cl)ccc1C)C)N1CCCCCC1

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Molecular Weight: 480.03
Empirical Formula: C22H30ClN5O3S

Physical State: Dry powder
Available Amount: 23 mg

Lipinsky:
logP: 2.084
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 87
Number of rings: 4

     

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