COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK193869
Chemical Name: 3,4-dihydroisoquinolin-2(1H)-yl{1-[(4-nitrophenyl)sulfonyl]piperidin-3-yl}methanone
Smiles: O=C(N1CCc2c(C1)cccc2)C1CCCN(C1)S(=O)(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 429.5
Empirical Formula: C21H23N3O5S

Physical State: Dry powder
Available Amount: 135 mg

Lipinsky:
logP: 3.662
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 111
Number of rings: 4

     

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