COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK527091
Chemical Name: 2-({4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butyl}amino)-4-(4-nitrophenoxy)naphthalen-1-ol
Smiles: CCC(c1cc(ccc1OCCCCNc1cc(Oc2ccc(cc2)[N+](=O)[O-])c2c(c1O)cccc2)C(CC)(C)C)(C)C

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Molecular Weight: 584.76
Empirical Formula: C36H44N2O5

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 11.402
Rotatable bonds: 12
H-donors: 2
H-acceptors: 5
PSA: 96
Number of rings: 4

     

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