COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK522784
Chemical Name: (2E)-3-{4-[(4-chlorobenzyl)oxy]-3,5-diiodophenyl}-2-cyano-N-(2-methoxy-4-nitrophenyl)prop-2-enamide
Smiles: N#C/C(=C\c1cc(I)c(c(c1)I)OCc1ccc(cc1)Cl)/C(=O)Nc1ccc(cc1OC)[N+](=O)[O-]

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Molecular Weight: 715.67
Empirical Formula: C24H16ClI2N3O5

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 8.072
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 117
Number of rings: 3

     

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