COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL133060
Chemical Name: 1,4'-bipiperidin-1'-yl(3-{[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl}-1-ethyl-1H-pyrazol-4-yl)methanone
Smiles: CCn1cc(c(n1)S(=O)(=O)N1CCN(CC1)c1cccc(c1C)C)C(=O)N1CCC(CC1)N1CCCCC1

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Molecular Weight: 542.75
Empirical Formula: C28H42N6O3S

Physical State: Dry powder
Available Amount: 40 mg

Lipinsky:
logP: 2.151
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 90
Number of rings: 5

     

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