COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK683087
Chemical Name: 2-[4-(4,4-dimethyl-2,6-dioxocyclohexylidene)-4-(hexylamino)butyl]-1H-isoindole-1,3(2H)-dione
Smiles: CCCCCCNC(=C1C(=O)CC(CC1=O)(C)C)CCCN1C(=O)c2c(C1=O)cccc2

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Molecular Weight: 438.57
Empirical Formula: C26H34N2O4

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 5.23
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 83
Number of rings: 3

     

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