COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL444651
Chemical Name: 2-{[5-({2-[(2-chlorophenyl)amino]-2-oxoethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]carbamoyl}benzoicacid
Smiles: O=C(Nc1ccccc1Cl)CSc1nnc(s1)NC(=O)c1ccccc1C(=O)O

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Molecular Weight: 448.91
Empirical Formula: C18H13ClN4O4S2

Physical State: Dry powder
Available Amount: 43 mg

Lipinsky:
logP: 2.904
Rotatable bonds: 6
H-donors: 3
H-acceptors: 4
PSA: 174
Number of rings: 3

     

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