COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK841328
Chemical Name: methyl4-[({5-[5-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)pentyl]-1,3,4-oxadiazol-2-yl}sulfanyl)methyl]benzoate
Smiles: COC(=O)c1ccc(cc1)CSc1nnc(o1)CCCCCn1c(=O)c2cccc3c2c(c1=O)ccc3

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Molecular Weight: 515.59
Empirical Formula: C28H25N3O5S

Physical State: Dry powder
Available Amount: 340 mg

Lipinsky:
logP: 3.746
Rotatable bonds: 8
H-donors: 0
H-acceptors: 5
PSA: 127
Number of rings: 5

     

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