COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK902713
Chemical Name: (2E)-1-(2,5-dimethylphenyl)-3-{[4-(piperidin-1-ylsulfonyl)phenyl]amino}prop-2-en-1-one
Smiles: Cc1ccc(c(c1)C(=O)/C=C/Nc1ccc(cc1)S(=O)(=O)N1CCCCC1)C

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Molecular Weight: 398.53
Empirical Formula: C22H26N2O3S

Available Amount: 0 mg

Lipinsky:
logP: 4.67
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 74
Number of rings: 3

     

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