COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL383487
Chemical Name: (2E)-3-{4-[(2-chlorobenzyl)oxy]-3-methoxyphenyl}-2-cyano-N-(2-methoxy-4-nitrophenyl)prop-2-enamide
Smiles: N#C/C(=C\c1ccc(c(c1)OC)OCc1ccccc1Cl)/C(=O)Nc1ccc(cc1OC)[N+](=O)[O-]

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Molecular Weight: 493.9
Empirical Formula: C25H20ClN3O6

Physical State: Dry powder
Available Amount: 113 mg

Lipinsky:
logP: 6.121
Rotatable bonds: 7
H-donors: 1
H-acceptors: 6
PSA: 126
Number of rings: 3

     

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