COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK373222
Chemical Name: 2,7,7-trimethyl-4-(6-nitro-1,3-benzodioxol-5-yl)-3-(piperidin-1-ylcarbonyl)-4,6,7,8-tetrahydroquinolin-5(1H)-one
Smiles: CC1=C(C(=O)N2CCCCC2)C(C2=C(N1)CC(C)(C)CC2=O)c1cc2OCOc2cc1[N+](=O)[O-]

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Molecular Weight: 467.52
Empirical Formula: C25H29N3O6

Physical State: Dry powder
Available Amount: 13 mg

Lipinsky:
logP: 3.24
Rotatable bonds: 2
H-donors: 1
H-acceptors: 6
PSA: 113
Number of rings: 5

     

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