COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK544641
Chemical Name: 7-(4-{[(6-chloropyridin-3-yl)carbonyl]carbamothioyl}piperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CCn1cc(C(=O)O)c(=O)c2c1cc(N1CCN(CC1)C(=S)NC(=O)c1ccc(nc1)Cl)c(c2)F

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Molecular Weight: 517.97
Empirical Formula: C23H21ClFN5O4S

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 1.466
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 138
Number of rings: 4

     

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