COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK367776
Chemical Name: 3-[(3-{4-[(3E)-4-carboxy-2-oxobut-3-en-1-yl]phenyl}-3-oxopropanoyl)amino]-4-[methyl(octadecyl)amino]benzoicacid
Smiles: CCCCCCCCCCCCCCCCCCN(c1ccc(cc1NC(=O)CC(=O)c1ccc(cc1)CC(=O)/C=C/C(=O)O)C(=O)O)C

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Molecular Weight: 676.89
Empirical Formula: C40H56N2O7

Physical State: Dry powder
Available Amount: 39 mg

Lipinsky:
logP: 11.634
Rotatable bonds: 25
H-donors: 3
H-acceptors: 7
PSA: 141
Number of rings: 2

     

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