COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK889098
Chemical Name: (7E)-7-(3-nitrobenzylidene)-3-(3-nitrophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazole
Smiles: [O-][N+](=O)c1cccc(c1)/C=C/1\CCCC2C1=NNC2c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 378.39
Empirical Formula: C20H18N4O4

Available Amount: 0 mg

Lipinsky:
logP: 3.957
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 116
Number of rings: 4

     

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