COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK513840
Chemical Name: N-[(1E)-1-(1,3-benzodioxol-5-yl)-3-{(2E)-2-[(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]hydrazinyl}-3-oxoprop-1-en-2-yl]benzamide
Smiles: O=C(/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1)N/N=C/c1c(C)nn(c1O)c1ccccc1

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Molecular Weight: 509.52
Empirical Formula: C28H23N5O5

Physical State: Dry powder
Available Amount: 135 mg

Lipinsky:
logP: 6.752
Rotatable bonds: 4
H-donors: 3
H-acceptors: 5
PSA: 127
Number of rings: 5

     

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