COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK963028
Chemical Name: (4E)-4-{[5-(3-bromophenyl)furan-2-yl]methylidene}-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Brc1cccc(c1)c1ccc(o1)/C=C/1\C(=NN(C1=O)c1ccccc1)C

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Molecular Weight: 407.27
Empirical Formula: C21H15BrN2O2

Physical State: Dry powder
Available Amount: 141 mg

Lipinsky:
logP: 5.401
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 45
Number of rings: 4

     

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