COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL286802
Chemical Name: 1-[(7E)-3-(1,3-benzodioxol-5-yl)-7-(1,3-benzodioxol-5-ylmethylidene)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-2-(2-fluorophenoxy)ethanone
Smiles: O=C(N1N=C2C(C1c1ccc3c(c1)OCO3)CCC/C/2=C\c1ccc2c(c1)OCO2)COc1ccccc1F

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Molecular Weight: 528.54
Empirical Formula: C30H25FN2O6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.341
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 78
Number of rings: 7

     

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