COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK382549
Chemical Name: N-ethyl-N-(3a-methyl-5,5-dioxido-3a,4-dihydrothieno[3,4-d][1,3]dithiol-2-ylidene)ethanaminium
Smiles: CC[N+](=C1SC2=CS(=O)(=O)CC2(S1)C)CC

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Saltdata: ClO4-
Molecular Weight: 278.44
Empirical Formula: C10H16NO2S3

Physical State: Dry powder
Available Amount: 97 mg

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

     

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