COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431357
Chemical Name: ethyl4-(5-{(Z)-[1-(5-chloro-2-nitrophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}furan-2-yl)benzoate
Smiles: CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C\1/C(=NN(C1=O)c1cc(Cl)ccc1[N+](=O)[O-])C

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Molecular Weight: 479.88
Empirical Formula: C24H18ClN3O6

Physical State: Dry powder
Available Amount: 269 mg

Lipinsky:
logP: 5.503
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 117
Number of rings: 4

     

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