COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK435191
Chemical Name: 2-[methyl(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]ethyl2-(4-butoxyphenyl)quinoline-4-carboxylate
Smiles: CCCCOc1ccc(cc1)c1nc2ccccc2c(c1)C(=O)OCCN(c1ccc(c2c1non2)[N+](=O)[O-])C

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Molecular Weight: 541.56
Empirical Formula: C29H27N5O6

Physical State: Dry powder
Available Amount: 547 mg

Lipinsky:
logP: 7.381
Rotatable bonds: 8
H-donors: 0
H-acceptors: 6
PSA: 136
Number of rings: 5

     

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