COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL445452
Chemical Name: 3-{8-[bis(4-methylphenyl)methylidene]-1,3-dioxo-1,3,3a,4,7,7a-hexahydro-2H-4,7-methanoisoindol-2-yl}benzoicacid
Smiles: Cc1ccc(cc1)/C(=C\1/C2C=CC1C1C2C(=O)N(C1=O)c1cccc(c1)C(=O)O)/c1ccc(cc1)C

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Molecular Weight: 475.54
Empirical Formula: C31H25NO4

Physical State: Dry powder
Available Amount: 146 mg

Lipinsky:
logP: 5.899
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 74
Number of rings: 6

     

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