COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL045562
Chemical Name: 7-[4-({[3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazol-4-yl]carbonyl}carbamothioyl)piperazin-1-ium-1-yl]-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylate
Smiles: CCn1cc(C(=O)[O-])c(=O)c2c1cc(c(c2)F)[NH+]1CCN(CC1)C(=S)NC(=O)c1c(C)onc1c1c(Cl)cccc1Cl

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Molecular Weight: 632.5
Empirical Formula: C28H24Cl2FN5O5S

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 2.293
Rotatable bonds: 2
H-donors: 2
H-acceptors: 5
PSA: 155
Number of rings: 5

     

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