COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK542460
Chemical Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-({5-[5-(1,3-dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)pentyl]-1,3,4-oxadiazol-2-yl}sulfanyl)acetamide
Smiles: COc1cc(CCNC(=O)CSc2nnc(o2)CCCCCn2c(=O)c3cccc4c3c(c2=O)ccc4)ccc1OC

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Molecular Weight: 588.68
Empirical Formula: C31H32N4O6S

Physical State: Dry powder
Available Amount: 378 mg

Lipinsky:
logP: 2.775
Rotatable bonds: 13
H-donors: 1
H-acceptors: 6
PSA: 149
Number of rings: 5

     

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