COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK759004
Chemical Name: 1,5-dimethyl-4-{[(E)-{4-[(1-methyl-1H-imidazol-2-yl)sulfanyl]-3-nitrophenyl}methylidene]amino}-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Smiles: [O-][N+](=O)c1cc(/C=N/c2c(C)n(n(c2=O)c2ccccc2)C)ccc1Sc1nccn1C

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Molecular Weight: 448.51
Empirical Formula: C22H20N6O3S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 3.372
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 124
Number of rings: 4

     

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