COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK588433
Chemical Name: 8-[(3,4-dimethylphenyl)sulfonyl]-3,4,7,8,9,10-hexahydro-2H-[1,4]dioxepino[2,3-g]isoquinoline
Smiles: Cc1cc(ccc1C)S(=O)(=O)N1CCc2c(C1)cc1c(c2)OCCCO1

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Molecular Weight: 373.47
Empirical Formula: C20H23NO4S

Physical State: Dry powder
Available Amount: 269 mg

Lipinsky:
logP: 4.316
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 64
Number of rings: 4

     

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