COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK194677
Chemical Name: 3,4-dihydroisoquinolin-2(1H)-yl{1-[(3-nitrophenyl)carbonyl]piperidin-3-yl}methanone
Smiles: O=C(N1CCc2c(C1)cccc2)C1CCCN(C1)C(=O)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 393.44
Empirical Formula: C22H23N3O4

Physical State: Dry powder
Available Amount: 396 mg

Lipinsky:
logP: 2.282
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 86
Number of rings: 4

     

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