COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK135440
Chemical Name: 1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[(4-phenyl-5-thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]ethanone
Smiles: O=C(N1CCc2c(C1)cccc2)CSc1nn(c(=S)s1)c1ccccc1

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Molecular Weight: 399.56
Empirical Formula: C19H17N3OS3

Physical State: Dry powder
Available Amount: 384 mg

Lipinsky:
logP: 3.88
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 118
Number of rings: 4

     

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