COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL117691
Chemical Name: {1-[(3-methylbenzyl)sulfonyl]piperidin-4-yl}{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}methanone
Smiles: Cc1cccc(c1)CS(=O)(=O)N1CCC(CC1)C(=O)N1CCN(CC1)C/C=C/c1ccccc1

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Molecular Weight: 481.66
Empirical Formula: C27H35N3O3S

Physical State: Dry powder
Available Amount: 40 mg

Lipinsky:
logP: 4.181
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 69
Number of rings: 4

     

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