COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK029135
Chemical Name: (2E)-2-cyano-N-(2-methyl-5-nitrophenyl)-3-(3-phenoxyphenyl)prop-2-enamide
Smiles: N#C/C(=C\c1cccc(c1)Oc1ccccc1)/C(=O)Nc1cc(ccc1C)[N+](=O)[O-]

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Molecular Weight: 399.41
Empirical Formula: C23H17N3O4

Physical State: Dry powder
Available Amount: 140 mg

Lipinsky:
logP: 6.223
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 107
Number of rings: 3

     

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