COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK435011
Chemical Name: [6-chloro-2-(5-ethylthiophen-2-yl)quinolin-4-yl][4-(4-nitrophenyl)piperazin-1-yl]methanone
Smiles: CCc1ccc(s1)c1nc2ccc(cc2c(c1)C(=O)N1CCN(CC1)c1ccc(cc1)[N+](=O)[O-])Cl

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Molecular Weight: 507.01
Empirical Formula: C26H23ClN4O3S

Physical State: Dry powder
Available Amount: 2099 mg

Lipinsky:
logP: 5.441
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 110
Number of rings: 5

     

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