COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK028996
Chemical Name: N-[(1E)-1-(1,3-benzodioxol-5-yl)-3-{(2E)-2-[1-(3-bromophenyl)ethylidene]hydrazinyl}-3-oxoprop-1-en-2-yl]benzamide
Smiles: Brc1cccc(c1)/C(=N/NC(=O)/C(=C\c1ccc2c(c1)OCO2)/NC(=O)c1ccccc1)/C

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Molecular Weight: 506.36
Empirical Formula: C25H20BrN3O4

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 5.317
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 89
Number of rings: 4

     

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