COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK889211
Chemical Name: 2-(2-fluorophenoxy)-1-[(7E)-7-(3-nitrobenzylidene)-3-(3-nitrophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]ethanone
Smiles: O=C(N1N=C2C(C1c1cccc(c1)[N+](=O)[O-])CCC/C/2=C\c1cccc(c1)[N+](=O)[O-])COc1ccccc1F

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Molecular Weight: 530.51
Empirical Formula: C28H23FN4O6

Physical State: Dry powder
Available Amount: 44 mg

Lipinsky:
logP: 4.989
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 133
Number of rings: 5

     

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