COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL181362
Chemical Name: 2-{[(2E)-4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-4-oxobut-2-enoyl]amino}benzoicacid
Smiles: CCn1cc(c(n1)C)C(=O)/C=C/C(=O)Nc1ccccc1C(=O)O

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Molecular Weight: 327.34
Empirical Formula: C17H17N3O4

Physical State: Dry powder
Available Amount: 3 mg

Lipinsky:
logP: 3.07
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 101
Number of rings: 2

     

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