COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL383461
Chemical Name: 3-({(2E)-2-cyano-3-[4-(2,4-dinitrophenoxy)phenyl]prop-2-enoyl}amino)benzoicacid
Smiles: N#C/C(=C\c1ccc(cc1)Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/C(=O)Nc1cccc(c1)C(=O)O

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Molecular Weight: 474.39
Empirical Formula: C23H14N4O8

Physical State: Dry powder
Available Amount: 10 mg

Lipinsky:
logP: 4.463
Rotatable bonds: 4
H-donors: 2
H-acceptors: 8
PSA: 191
Number of rings: 3

     

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