COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK427527
Chemical Name: (2E)-4-(cyclooctylamino)-2-methyl-4-oxobut-2-enoicacid
Smiles: O=C(/C=C(/C(=O)O)\C)NC1CCCCCCC1

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Molecular Weight: 239.31
Empirical Formula: C13H21NO3

Physical State: Dry powder
Available Amount: 546 mg

Lipinsky:
logP: 2.77
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 66
Number of rings: 1

     

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