COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK789952
Chemical Name: 4-[(1,3-dioxo-1,3-dihydro-2H-inden-2-ylidene)methyl]phenyl2-(1,3-dioxo-1,3,3a,4-tetrahydro-2H-isoindol-2-yl)butanoate
Smiles: CCC(N1C(=O)C2C(=CC=CC2)C1=O)C(=O)Oc1ccc(cc1)/C=C/1\C(=O)c2c(C1=O)cccc2

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Molecular Weight: 467.48
Empirical Formula: C28H21NO6

Physical State: Dry powder
Available Amount: 317 mg

Lipinsky:
logP: 3.884
Rotatable bonds: 4
H-donors: 0
H-acceptors: 6
PSA: 97
Number of rings: 5

     

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