COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK833710
Chemical Name: 2-(3,4-dimethoxyphenyl)-2-[1-(4-methoxyphenyl)-2-nitroethyl]-1H-indene-1,3(2H)-dione
Smiles: COc1ccc(cc1)C(C1(c2ccc(c(c2)OC)OC)C(=O)c2c(C1=O)cccc2)C[N+](=O)[O-]

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Molecular Weight: 461.47
Empirical Formula: C26H23NO7

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 5.289
Rotatable bonds: 5
H-donors: 0
H-acceptors: 7
PSA: 107
Number of rings: 4

     

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