COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL322791
Chemical Name: N-[(1E)-3-[(2-bromoethyl)amino]-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Smiles: BrCCNC(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccccc1

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Molecular Weight: 418.25
Empirical Formula: C18H16BrN3O4

Physical State: Dry powder
Available Amount: 245 mg

Lipinsky:
logP: 2.591
Rotatable bonds: 4
H-donors: 2
H-acceptors: 4
PSA: 104
Number of rings: 2

     

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