COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK993721
Chemical Name: (7Z)-7-(4-methoxybenzylidene)-3-(4-methoxyphenyl)-2-(4-nitrophenyl)-3,3a,4,5,6,7-hexahydro-2H-indazole
Smiles: COc1ccc(cc1)/C=C\1/CCCC2C1=NN(C2c1ccc(cc1)OC)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 469.54
Empirical Formula: C28H27N3O4

Available Amount: 0 mg

Lipinsky:
logP: 5.432
Rotatable bonds: 0
H-donors: 0
H-acceptors: 4
PSA: 79
Number of rings: 5

     

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