COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK056984
Chemical Name: 1-[(1Z)-3-(azepan-1-yl)-1-(3,5-dimethoxyphenyl)-3-oxoprop-1-en-2-yl]pyridin-2(1H)-one
Smiles: COc1cc(cc(c1)OC)/C=C(\n1ccccc1=O)/C(=O)N1CCCCCC1

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Molecular Weight: 382.46
Empirical Formula: C22H26N2O4

Physical State: Dry powder
Available Amount: 250 mg

Lipinsky:
logP: 2.672
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 59
Number of rings: 3

     

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