COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK301391
Chemical Name: N-[(2-methyl-5-nitrophenyl)carbamothioyl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide
Smiles: CC(COc1cccc(c1)c1nc2ccccc2c(c1)C(=O)NC(=S)Nc1cc(ccc1C)[N+](=O)[O-])C

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Molecular Weight: 514.6
Empirical Formula: C28H26N4O4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.75
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 141
Number of rings: 4

     

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