COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL324092
Chemical Name: (4E)-4-{[5-(3-nitrophenyl)furan-2-yl]methylidene}-2-phenyl-5-[(phenylsulfanyl)methyl]-2,4-dihydro-3H-pyrazol-3-one
Smiles: O=C1/C(=C/c2ccc(o2)c2cccc(c2)[N+](=O)[O-])/C(=NN1c1ccccc1)CSc1ccccc1

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Molecular Weight: 481.53
Empirical Formula: C27H19N3O4S

Physical State: Dry powder
Available Amount: 139 mg

Lipinsky:
logP: 6.664
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 116
Number of rings: 5

     

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