COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK584165
Chemical Name: 8-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Smiles: O=S(=O)(c1ccc2c(c1)CCCC2)N1CCc2c(C1)cc1c(c2)OCCCO1

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Molecular Weight: 399.51
Empirical Formula: C22H25NO4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.082
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 64
Number of rings: 5

     

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