COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK106769
Chemical Name: 5-[(E)-(2-{[4-(2,4,4-trimethylpentan-2-yl)phenoxy]acetyl}hydrazinylidene)methyl]furan-2-sulfonate
Smiles: O=C(COc1ccc(cc1)C(CC(C)(C)C)(C)C)N/N=C/c1ccc(o1)S(=O)(=O)[O-]

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Saltdata: Na+
Molecular Weight: 435.52
Empirical Formula: C21H27N2O6S

Physical State: Dry powder
Available Amount: 235 mg

Lipinsky:
logP: 4.116
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 129
Number of rings: 2

     

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