COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK396792
Chemical Name: (2E)-3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]-N-(3-chloro-2-methylphenyl)-2-cyanoprop-2-enamide
Smiles: N#C/C(=C\c1ccc(c(c1)OC)OCC(=O)N)/C(=O)Nc1cccc(c1C)Cl

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Molecular Weight: 399.83
Empirical Formula: C20H18ClN3O4

Physical State: Dry powder
Available Amount: 213 mg

Lipinsky:
logP: 3.206
Rotatable bonds: 6
H-donors: 3
H-acceptors: 4
PSA: 114
Number of rings: 2

     

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