COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK832575
Chemical Name: N-[(1E)-3-[(2-hydroxyethyl)amino]-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Smiles: OCCNC(=O)/C(=C\c1cccc(c1)[N+](=O)[O-])/NC(=O)c1ccccc1

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Molecular Weight: 355.35
Empirical Formula: C18H17N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.986
Rotatable bonds: 5
H-donors: 3
H-acceptors: 5
PSA: 124
Number of rings: 2

     

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