COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK610405
Chemical Name: 1-(3,4-dichlorophenyl)-3-[(2Z)-5-{2-[(2-fluorobenzyl)sulfanyl]phenyl}-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: O=C(/N=c\1/[nH]nc(s1)c1ccccc1SCc1ccccc1F)Nc1ccc(c(c1)Cl)Cl

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Molecular Weight: 505.42
Empirical Formula: C22H15Cl2FN4OS2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.193
Rotatable bonds: 4
H-donors: 2
H-acceptors: 1
PSA: 116
Number of rings: 4

     

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