COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL019563
Chemical Name: methyl4-{[(2E)-4-amino-4-oxobut-2-enoyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NC(=O)/C=C/C(=O)N

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Molecular Weight: 248.24
Empirical Formula: C12H12N2O4

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 0.664
Rotatable bonds: 3
H-donors: 3
H-acceptors: 4
PSA: 98
Number of rings: 1

     

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