COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL036792
Chemical Name: N-[(2E)-1,3-benzothiazol-2(3H)-ylidene]-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-4-(methylsulfanyl)butanamide
Smiles: CSCCC(N1C(=O)c2c(C1=O)cccc2)C(=O)/N=c\1/sc2c([nH]1)cccc2

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Molecular Weight: 411.51
Empirical Formula: C20H17N3O3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.857
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 129
Number of rings: 4

     

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