COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK765188
Chemical Name: ethyl(2E)-3-amino-2-nitro-3-[(phenylcarbonyl)amino]prop-2-enoate
Smiles: CCOC(=O)/C(=C(\NC(=O)c1ccccc1)/N)/[N+](=O)[O-]

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Molecular Weight: 279.25
Empirical Formula: C12H13N3O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: -0.425
Rotatable bonds: 3
H-donors: 3
H-acceptors: 5
PSA: 127
Number of rings: 1

     

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