COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK681034
Chemical Name: 3-({2-[2-methyl-5-(trifluoromethoxy)-1H-indol-3-yl]ethyl}amino)-2-pentanoyl-5-phenylcyclohex-2-en-1-one
Smiles: CCCCC(=O)C1=C(NCCc2c(C)[nH]c3c2cc(cc3)OC(F)(F)F)CC(CC1=O)c1ccccc1

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Molecular Weight: 512.57
Empirical Formula: C29H31F3N2O3

Physical State: Dry powder
Available Amount: 64 mg

Lipinsky:
logP: 6.638
Rotatable bonds: 8
H-donors: 2
H-acceptors: 3
PSA: 71
Number of rings: 4

     

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