COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL044440
Chemical Name: methyl2-[({[(5Z)-5-{[(2-chlorophenyl)carbonyl]imino}-4,5-dihydro-1,3,4-thiadiazol-2-yl]sulfanyl}acetyl)amino]benzoate
Smiles: COC(=O)c1ccccc1NC(=O)CSc1n[nH]/c(=N/C(=O)c2ccccc2Cl)/s1

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Molecular Weight: 462.94
Empirical Formula: C19H15ClN4O4S2

Physical State: Dry powder
Available Amount: 247 mg

Lipinsky:
logP: 3.874
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 159
Number of rings: 3

     

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