COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK529681
Chemical Name: [(1,3-dibenzyl-2'-nitro-1H,4'H-spiro[cyclohepta[d]imidazol-1-ium-2,1'-cyclohexa[2,5]dien]-4'-ylidene)(oxido)-lambda~5~-azanyl]oxidanide
Smiles: [O-][N+](=C1C=CC2(C(=C1)[N+](=O)[O-])N(Cc1ccccc1)C1=CC=CC=CC1=[N+]2Cc1ccccc1)[O-]

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Molecular Weight: 466.5
Empirical Formula: C27H22N4O4

Physical State: Dry powder
Available Amount: 272 mg

Lipinsky:
logP: 0
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 103
Number of rings: 5

     

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