COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK601275
Chemical Name: 1-[(2Z)-5-[(E)-2-(2-chlorophenyl)ethenyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-(3,4-dichlorophenyl)urea
Smiles: O=C(/N=c\1/[nH]nc(s1)/C=C/c1ccccc1Cl)Nc1ccc(c(c1)Cl)Cl

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Molecular Weight: 425.72
Empirical Formula: C17H11Cl3N4OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.922
Rotatable bonds: 2
H-donors: 2
H-acceptors: 1
PSA: 91
Number of rings: 3

     

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