COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK807665
Chemical Name: ethyl[(5-{[4-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)butanoyl]amino}-1,3,4-thiadiazol-2-yl)sulfanyl]acetate
Smiles: CCOC(=O)CSc1nnc(s1)NC(=O)CCCn1c(=O)c2cccc3c2c(c1=O)ccc3

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Molecular Weight: 484.56
Empirical Formula: C22H20N4O5S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 2.948
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 172
Number of rings: 4

     

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