COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK765458
Chemical Name: 2,6,6-trimethyl-1-(2-methyl-5-nitrophenyl)-3-(2,2,2-trichloroethyl)-1,5,6,7-tetrahydro-4H-indol-4-one
Smiles: Cc1ccc(cc1n1c(C)c(c2c1CC(C)(C)CC2=O)CC(Cl)(Cl)Cl)[N+](=O)[O-]

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Molecular Weight: 443.76
Empirical Formula: C20H21Cl3N2O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.381
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 67
Number of rings: 3

     

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