COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL039388
Chemical Name: 1-(2-methoxyphenyl)-3-[(2E)-5-{[(3-methylbenzyl)sulfanyl]methyl}-1,3,4-thiadiazol-2(3H)-ylidene]urea
Smiles: COc1ccccc1NC(=O)/N=c/1\[nH]nc(s1)CSCc1cccc(c1)C

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Molecular Weight: 400.53
Empirical Formula: C19H20N4O2S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.763
Rotatable bonds: 5
H-donors: 2
H-acceptors: 2
PSA: 125
Number of rings: 3

     

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