COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL507655
Chemical Name: (4Z)-2-(3-chlorophenyl)-5-hydroxy-4-[(2E)-3-(3-nitrophenyl)prop-2-en-1-ylidene]-2,4-dihydro-3H-pyrazol-3-one
Smiles: Clc1cccc(c1)N1N=C(/C(=C/C=C/c2cccc(c2)[N+](=O)[O-])/C1=O)O

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Molecular Weight: 369.76
Empirical Formula: C18H12ClN3O4

Physical State: Dry powder
Available Amount: 56 mg

Lipinsky:
logP: 3.474
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 98
Number of rings: 3

     

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