COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK900150
Chemical Name: N-[(3aR,6aR)-4-bromo-3a-methyl-5,5-dioxidotetrahydrothieno[3,4-d][1,3]dithiol-2-ylidene]-N-ethylethanaminium
Smiles: CC[N+](=C1S[C@H]2[C@](S1)(C)C(S(=O)(=O)C2)Br)CC

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Molecular Weight: 359.35
Empirical Formula: C10H17BrNO2S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 96
Number of rings: 2

     

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