COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK080211
Chemical Name: N-{4-[2,4-bis(3-methylbutyl)phenoxy]butyl}-1-hydroxy-4-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]naphthalene-2-carboxamide
Smiles: CC(CCc1cc(CCC(C)C)ccc1OCCCCNC(=O)c1cc(Sc2nnnn2c2ccccc2)c2c(c1O)cccc2)C

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Molecular Weight: 651.87
Empirical Formula: C38H45N5O3S

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 11.815
Rotatable bonds: 16
H-donors: 2
H-acceptors: 3
PSA: 127
Number of rings: 5

     

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