COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL350172
Chemical Name: methyl1-[(1E)-3-(benzylamino)-2-cyano-3-oxoprop-1-en-1-yl]piperidine-4-carboxylate
Smiles: COC(=O)C1CCN(CC1)/C=C(/C(=O)NCc1ccccc1)\C#N

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Molecular Weight: 327.38
Empirical Formula: C18H21N3O3

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 1.602
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 82
Number of rings: 2

     

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