COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK902313
Chemical Name: (2E)-1-(1,3-benzodioxol-5-yl)-3-[(4-chloro-2-methoxy-5-methylphenyl)amino]prop-2-en-1-one
Smiles: COc1cc(Cl)c(cc1N/C=C/C(=O)c1ccc2c(c1)OCO2)C

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Molecular Weight: 345.78
Empirical Formula: C18H16ClNO4

Physical State: Dry powder
Available Amount: 24 mg

Lipinsky:
logP: 3.904
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 56
Number of rings: 3

     

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