COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL367450
Chemical Name: (2E)-2-cyano-3-[4-(2,4-dinitrophenoxy)-3-iodo-5-methoxyphenyl]prop-2-enamide
Smiles: N#C/C(=C\c1cc(I)c(c(c1)OC)Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/C(=O)N

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Molecular Weight: 510.2
Empirical Formula: C17H11IN4O7

Physical State: Dry powder
Available Amount: 747 mg

Lipinsky:
logP: 1.603
Rotatable bonds: 5
H-donors: 2
H-acceptors: 7
PSA: 176
Number of rings: 2

     

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