COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK548489
Chemical Name: N-{3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1,4-dioxo-1,4-dihydronaphthalen-2-yl}benzenesulfonamide
Smiles: O=C1C(=C(N2CCN(CC2)Cc2ccc3c(c2)OCO3)C(=O)c2c1cccc2)NS(=O)(=O)c1ccccc1

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Molecular Weight: 531.59
Empirical Formula: C28H25N3O6S

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 3.823
Rotatable bonds: 1
H-donors: 1
H-acceptors: 6
PSA: 113
Number of rings: 6

     

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