COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406915
Chemical Name: (4E)-4-{[1-(3,4-dichlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-5-hydroxy-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: OC1=NN(C(=O)/C/1=C/c1cc(n(c1C)c1ccc(c(c1)Cl)Cl)C)c1ccccc1

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Molecular Weight: 426.3
Empirical Formula: C22H17Cl2N3O2

Physical State: Dry powder
Available Amount: 446 mg

Lipinsky:
logP: 6.031
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 57
Number of rings: 4

     

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