COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK092561
Chemical Name: 4-[(E)-(3-methyl-5-oxo-1-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene)methyl]phenyl2-nitrobenzenesulfonate
Smiles: CC1=NN(C(=O)/C/1=C/c1ccc(cc1)OS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1

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Molecular Weight: 463.47
Empirical Formula: C23H17N3O6S

Physical State: Dry powder
Available Amount: 67 mg

Lipinsky:
logP: 4.169
Rotatable bonds: 2
H-donors: 0
H-acceptors: 6
PSA: 130
Number of rings: 4

     

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