COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL026562
Chemical Name: benzylN-[(2E)-2-{[(5-bromofuran-2-yl)carbonyl]amino}-3-(4-bromophenyl)prop-2-enoyl]glycinate
Smiles: O=C(CNC(=O)/C(=C\c1ccc(cc1)Br)/NC(=O)c1ccc(o1)Br)OCc1ccccc1

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Molecular Weight: 562.21
Empirical Formula: C23H18Br2N2O5

Physical State: Dry powder
Available Amount: 230 mg

Lipinsky:
logP: 4.789
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 97
Number of rings: 3

     

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