COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK181021
Chemical Name: (2E)-3-[4-(benzyloxy)-5-methoxy-2-nitrophenyl]-2-cyano-N-(naphthalen-2-yl)prop-2-enamide
Smiles: N#C/C(=C\c1cc(OC)c(cc1[N+](=O)[O-])OCc1ccccc1)/C(=O)Nc1ccc2c(c1)cccc2

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Molecular Weight: 479.49
Empirical Formula: C28H21N3O5

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: 6.118
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 117
Number of rings: 4

     

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