COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK328944
Chemical Name: 7-(4-{[3-(ethoxycarbonyl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl]carbamothioyl}piperazin-1-yl)-1-ethyl-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylicacid
Smiles: CCOC(=O)c1c(NC(=S)N2CCN(CC2)c2cc3n(CC)cc(c(=O)c3cc2F)C(=O)O)sc2c1CCCCC2

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Molecular Weight: 600.74
Empirical Formula: C29H33FN4O5S2

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 6.141
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 162
Number of rings: 5

     

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