COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL133079
Chemical Name: 1-[(3-{[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl}-1-ethyl-1H-pyrazol-4-yl)carbonyl]piperidin-4-one
Smiles: CCn1cc(c(n1)S(=O)(=O)N1CCN(CC1)c1cccc(c1C)C)C(=O)N1CCC(=O)CC1

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Molecular Weight: 473.6
Empirical Formula: C23H31N5O4S

Physical State: Dry powder
Available Amount: 17 mg

Lipinsky:
logP: -0.119
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 104
Number of rings: 4

     

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