COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK549122
Chemical Name: 1-ethyl-6-fluoro-4-oxo-7-(4-{[(3,4,5-trimethoxyphenyl)carbonyl]carbamothioyl}piperazin-1-yl)-1,4-dihydroquinoline-3-carboxylicacid
Smiles: COc1cc(cc(c1OC)OC)C(=O)NC(=S)N1CCN(CC1)c1cc2n(CC)cc(c(=O)c2cc1F)C(=O)O

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Molecular Weight: 572.61
Empirical Formula: C27H29FN4O7S

Physical State: Dry powder
Available Amount: 308 mg

Lipinsky:
logP: 1.89
Rotatable bonds: 5
H-donors: 2
H-acceptors: 7
PSA: 152
Number of rings: 4

     

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