COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL297782
Chemical Name: N-[(1E)-1-(1,3-benzodioxol-5-yl)-3-(benzylamino)-3-oxoprop-1-en-2-yl]-5-bromofuran-2-carboxamide
Smiles: Brc1ccc(o1)C(=O)N/C(=C/c1ccc2c(c1)OCO2)/C(=O)NCc1ccccc1

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Molecular Weight: 469.29
Empirical Formula: C22H17BrN2O5

Physical State: Dry powder
Available Amount: 224 mg

Lipinsky:
logP: 3.765
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 89
Number of rings: 4

     

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