COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK715956
Chemical Name: 1-{(1E)-2-cyano-3-[(4-methoxybenzyl)amino]-3-oxoprop-1-en-1-yl}piperidine-4-carboxylicacid
Smiles: COc1ccc(cc1)CNC(=O)/C(=C/N1CCC(CC1)C(=O)O)/C#N

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Molecular Weight: 343.38
Empirical Formula: C18H21N3O4

Physical State: Dry powder
Available Amount: 324 mg

Lipinsky:
logP: 1.055
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 102
Number of rings: 2

     

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