COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL528528
Chemical Name: 2-[(2E)-1,3,4,5-tetrahydro-2H-1-benzazepin-2-ylideneammonio]propanoate
Smiles: [O-]C(=O)C(/[NH+]=C/1\CCCc2c(N1)cccc2)C

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Molecular Weight: 232.28
Empirical Formula: C13H16N2O2

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 2.183
Rotatable bonds: 1
H-donors: 2
H-acceptors: 2
PSA: 66
Number of rings: 2

     

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