COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK829743
Chemical Name: (2E)-1-[(2R,4R)-2-methyl-4-(phenylamino)-3,4-dihydroquinolin-1(2H)-yl]-3-(4-nitrophenyl)prop-2-en-1-one
Smiles: C[C@@H]1C[C@@H](Nc2ccccc2)c2c(N1C(=O)/C=C/c1ccc(cc1)[N+](=O)[O-])cccc2

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Molecular Weight: 413.48
Empirical Formula: C25H23N3O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.106
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 78
Number of rings: 4

     

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