COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL427200
Chemical Name: methylN-[(2E)-3-phenylprop-2-enoyl]-beta-alaninate
Smiles: COC(=O)CCNC(=O)/C=C/c1ccccc1

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Molecular Weight: 233.27
Empirical Formula: C13H15NO3

Physical State: Dry powder
Available Amount: 1423 mg

Lipinsky:
logP: 1.719
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 55
Number of rings: 1

     

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