COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK675554
Chemical Name: N-[(4Z)-4-(3,4-dimethoxybenzylidene)-5-oxo-1-(2,4,6-trichlorophenyl)-4,5-dihydro-1H-pyrazol-3-yl]-3-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)benzamide
Smiles: COc1cc(ccc1OC)/C=C\1/C(=NN(C1=O)c1c(Cl)cc(cc1Cl)Cl)NC(=O)c1cccc(c1)N1C(=O)c2c(C1=O)cccc2

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Molecular Weight: 675.91
Empirical Formula: C33H21Cl3N4O6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.333
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 117
Number of rings: 6

     

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