COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK219846
Chemical Name: (4E)-2-(2-chloro-3-methylphenyl)-5-methyl-4-{[5-(4-nitrophenyl)furan-2-yl]methylidene}-2,4-dihydro-3H-pyrazol-3-one
Smiles: CC1=NN(C(=O)/C/1=C/c1ccc(o1)c1ccc(cc1)[N+](=O)[O-])c1cccc(c1Cl)C

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Molecular Weight: 421.84
Empirical Formula: C22H16ClN3O4

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 5.394
Rotatable bonds: 1
H-donors: 0
H-acceptors: 4
PSA: 91
Number of rings: 4

     

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