COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL184279
Chemical Name: [4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl][5-(4-nitrophenyl)-1H-pyrazol-4-yl]methanone
Smiles: O=C(c1cn[nH]c1c1ccc(cc1)[N+](=O)[O-])N1CCN(CC1)Cc1ccc2c(c1)OCO2

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Molecular Weight: 435.44
Empirical Formula: C22H21N5O5

Physical State: Dry powder
Available Amount: 7 mg

Lipinsky:
logP: 1.493
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 116
Number of rings: 5

     

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