COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK986981
Chemical Name: (2E)-3-[(2-chloro-6-methylphenyl)amino]-1-(2,5-dimethoxyphenyl)prop-2-en-1-one
Smiles: COc1ccc(c(c1)C(=O)/C=C/Nc1c(C)cccc1Cl)OC

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Molecular Weight: 331.8
Empirical Formula: C18H18ClNO3

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.827
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 47
Number of rings: 2

     

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