COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK684737
Chemical Name: diethyl2-amino-1-(3,5-dichlorophenyl)-4-(2-fluorophenyl)-5-oxo-7-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3,6-dicarboxylate
Smiles: CCOC(=O)C1C(=O)C2=C(CC1c1cccs1)N(c1cc(Cl)cc(c1)Cl)C(=C(C2c1ccccc1F)C(=O)OCC)N

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Molecular Weight: 629.54
Empirical Formula: C31H27Cl2FN2O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.175
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 127
Number of rings: 5

     

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