COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK681201
Chemical Name: 2-[1-({2-[5-(benzyloxy)-2-methyl-1H-indol-3-yl]ethyl}amino)butylidene]-5-phenylcyclohexane-1,3-dione
Smiles: CCC/C(=C/1\C(=O)CC(CC1=O)c1ccccc1)/NCCc1c(C)[nH]c2c1cc(OCc1ccccc1)cc2

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Molecular Weight: 520.67
Empirical Formula: C34H36N2O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.757
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 71
Number of rings: 5

     

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