COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL556121
Chemical Name: 7-phenyl-7-(2,4,5-trimethyl-3,6-dioxocyclohexa-1,4-dien-1-yl)heptanoicacid
Smiles: OC(=O)CCCCCC(C1=C(C)C(=O)C(=C(C1=O)C)C)c1ccccc1

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Molecular Weight: 354.45
Empirical Formula: C22H26O4

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 5.252
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 71
Number of rings: 2

     

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