COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK823821
Chemical Name: (4Z)-4-({3-[4-(benzyloxy)-3-methylphenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-5-{[(4-methylphenyl)sulfanyl]methyl}-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(cc1)SCC1=NN(C(=O)/C/1=C\c1cn(nc1c1ccc(c(c1)C)OCc1ccccc1)c1ccccc1)c1ccccc1

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Molecular Weight: 646.81
Empirical Formula: C41H34N4O2S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 10.171
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 85
Number of rings: 7

     

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