COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL295117
Chemical Name: (4E)-4-{[(2,6-dichloro-4-nitrophenyl)amino]methylidene}-2-(3,4-dimethylphenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=C/Nc1c(Cl)cc(cc1Cl)[N+](=O)[O-])c1ccc(c(c1)C)C

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Molecular Weight: 419.27
Empirical Formula: C19H16Cl2N4O3

Physical State: Dry powder
Available Amount: 210 mg

Lipinsky:
logP: 4.809
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 90
Number of rings: 3

     

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