COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK674942
Chemical Name: 1-[(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-1-oxobutan-2-yl(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)acetate
Smiles: CCC(C(=O)Nc1sc2c(c1C#N)CCCC2)OC(=O)CN1C(=O)c2c(C1=O)cccc2[N+](=O)[O-]

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Molecular Weight: 496.5
Empirical Formula: C23H20N4O7S

Physical State: Dry powder
Available Amount: 8 mg

Lipinsky:
logP: 4.563
Rotatable bonds: 6
H-donors: 1
H-acceptors: 7
PSA: 190
Number of rings: 4

     

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