COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL484103
Chemical Name: N-[(2E)-4-bromo-3a-methyl-5,5-dioxidotetrahydrothieno[3,4-d][1,3]dithiol-2-ylidene]propan-2-aminium
Smiles: BrC1S(=O)(=O)CC2C1(C)S/C(=[NH+]/C(C)C)/S2

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Saltdata: Br-
Molecular Weight: 345.33
Empirical Formula: C9H15BrNO2S3

Available Amount: 0 mg

Lipinsky:
logP: 1.528
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 107
Number of rings: 2

     

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