COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK715984
Chemical Name: (2E)-3-(4-benzylpiperidin-1-yl)-2-[(4-chlorophenyl)sulfonyl]prop-2-enenitrile
Smiles: N#C/C(=C\N1CCC(CC1)Cc1ccccc1)/S(=O)(=O)c1ccc(cc1)Cl

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Molecular Weight: 400.93
Empirical Formula: C21H21ClN2O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.891
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 69
Number of rings: 3

     

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