COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL148241
Chemical Name: 6-{(3E)-3-[(4-bromophenyl)(hydroxy)methylidene]-4,5-dioxo-2-[4-(propan-2-yl)phenyl]pyrrolidin-1-yl}hexanoicacid
Smiles: OC(=O)CCCCCN1C(c2ccc(cc2)C(C)C)/C(=C(/c2ccc(cc2)Br)\O)/C(=O)C1=O

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Molecular Weight: 514.42
Empirical Formula: C26H28BrNO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.84
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 94
Number of rings: 3

     

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