COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK083086
Chemical Name: 2-{2-[4-(azepan-1-ylsulfonyl)phenyl]hydrazinylidene}-5,5-dimethylcyclohexane-1,3-dione
Smiles: O=C1CC(C)(C)CC(=O)C1=NNc1ccc(cc1)S(=O)(=O)N1CCCCCC1

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Molecular Weight: 405.52
Empirical Formula: C20H27N3O4S

Physical State: Dry powder
Available Amount: 145 mg

Lipinsky:
logP: 3.042
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 104
Number of rings: 3

     

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