COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK681165
Chemical Name: 3-({2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl}amino)-2-pentanoylcyclohex-2-en-1-one
Smiles: CCCCC(=O)C1=C(CCCC1=O)NCCc1c(C)[nH]c2c1cc(cc2)OC(F)(F)F

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Molecular Weight: 436.47
Empirical Formula: C23H27F3N2O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.866
Rotatable bonds: 8
H-donors: 2
H-acceptors: 3
PSA: 71
Number of rings: 3

     

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