COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL012021
Chemical Name: 2-{5-[5-(ethylsulfanyl)-1,3,4-oxadiazol-2-yl]pentyl}-1H-benzo[de]isoquinoline-1,3(2H)-dione
Smiles: CCSc1nnc(o1)CCCCCn1c(=O)c2cccc3c2c(c1=O)ccc3

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Molecular Weight: 395.48
Empirical Formula: C21H21N3O3S

Physical State: Dry powder
Available Amount: 137 mg

Lipinsky:
logP: 2.523
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 101
Number of rings: 4

     

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