COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK031133
Chemical Name: 1-(2,3-dimethyl-1H-indol-1-yl)-2-[(4-phenyl-5-thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone
Smiles: S=c1sc(nn1c1ccccc1)SCC(=O)n1c(C)c(c2c1cccc2)C

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Molecular Weight: 411.57
Empirical Formula: C20H17N3OS3

Physical State: Dry powder
Available Amount: 455 mg

Lipinsky:
logP: 5.313
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 120
Number of rings: 4

     

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