COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK808191
Chemical Name: 2-[3-({5-[3-(azepan-1-ylsulfonyl)phenyl]-1,3,4-oxadiazol-2-yl}sulfanyl)propyl]-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: O=c1c2cccc3c2c(c(=O)n1CCCSc1nnc(o1)c1cccc(c1)S(=O)(=O)N1CCCCCC1)ccc3

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Molecular Weight: 576.7
Empirical Formula: C29H28N4O5S2

Physical State: Dry powder
Available Amount: 97 mg

Lipinsky:
logP: 5.584
Rotatable bonds: 6
H-donors: 0
H-acceptors: 5
PSA: 147
Number of rings: 6

     

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