COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK566091
Chemical Name: 7-{4-[(3-chlorophenyl)carbonyl]piperazin-1-yl}-1-cyclopropyl-6-fluoro-N-[(2E)-5-(2-methylpropyl)-1,3,4-thiadiazol-2(3H)-ylidene]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Smiles: CC(Cc1n[nH]/c(=N\C(=O)c2cn(C3CC3)c3c(c2=O)cc(c(c3)N2CCN(CC2)C(=O)c2cccc(c2)Cl)F)/s1)C

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Molecular Weight: 609.12
Empirical Formula: C30H30ClFN6O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.05
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 122
Number of rings: 6

     

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