COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK785336
Chemical Name: 1-(3,4-dihydroquinolin-1(2H)-yl)-4-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)butan-1-one
Smiles: O=C(N1CCCc2c1cccc2)CCCn1nc(c(c1C)[N+](=O)[O-])C

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Molecular Weight: 342.4
Empirical Formula: C18H22N4O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.942
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 83
Number of rings: 3

     

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