COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK427526
Chemical Name: (2E)-4-(cycloheptylamino)-2-methyl-4-oxobut-2-enoicacid
Smiles: O=C(/C=C(/C(=O)O)\C)NC1CCCCCC1

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Molecular Weight: 225.29
Empirical Formula: C12H19NO3

Physical State: Dry powder
Available Amount: 225 mg

Lipinsky:
logP: 2.205
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 66
Number of rings: 1

     

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