COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK037212
Chemical Name: 1-[(1Z)-3-(azepan-1-yl)-1-(3-bromophenyl)-3-oxoprop-1-en-2-yl]pyridin-2(1H)-one
Smiles: Brc1cccc(c1)/C=C(\n1ccccc1=O)/C(=O)N1CCCCCC1

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Molecular Weight: 401.3
Empirical Formula: C20H21BrN2O2

Physical State: Dry powder
Available Amount: 230 mg

Lipinsky:
logP: 3.673
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 40
Number of rings: 3

     

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