COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK302266
Chemical Name: 1-[(7E)-7-(3,4-dimethoxybenzylidene)-3-(3,4-dimethoxyphenyl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]-2-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]ethanone
Smiles: COc1cc(ccc1OC)C1N(N=C2C1CCC/C/2=C\c1ccc(c(c1)OC)OC)C(=O)Cn1nc(cc1C)C(F)(F)F

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Molecular Weight: 598.62
Empirical Formula: C31H33F3N4O5

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.845
Rotatable bonds: 8
H-donors: 0
H-acceptors: 5
PSA: 87
Number of rings: 5

     

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