COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK833124
Chemical Name: ethyl5-hydroxy-1-[2-hydroxy-2-(4-nitrophenyl)ethyl]-2-methyl-1H-benzo[g]indole-3-carboxylate
Smiles: CCOC(=O)c1c(C)n(c2c1cc(O)c1c2cccc1)CC(c1ccc(cc1)[N+](=O)[O-])O

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Molecular Weight: 434.45
Empirical Formula: C24H22N2O6

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 4.742
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 117
Number of rings: 4

     

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