COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL009640
Chemical Name: N-[(2E)-3-[4-(dimethylamino)phenyl]-5,5-dioxidotetrahydrothieno[3,4-d][1,3]thiazol-2(3H)-ylidene]-1,3-benzodioxole-5-carboxamide
Smiles: CN(c1ccc(cc1)N1/C(=N\C(=O)c2ccc3c(c2)OCO3)/SC2C1CS(=O)(=O)C2)C

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Molecular Weight: 459.55
Empirical Formula: C21H21N3O5S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.322
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 122
Number of rings: 5

     

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