COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK746990
Chemical Name: methyl2-[6-amino-4-(3-bromophenyl)-5-cyano-3-nitro-4H-pyran-2-yl]benzoate
Smiles: N#CC1=C(N)OC(=C(C1c1cccc(c1)Br)[N+](=O)[O-])c1ccccc1C(=O)OC

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Molecular Weight: 456.25
Empirical Formula: C20H14BrN3O5

Available Amount: 0 mg

Lipinsky:
logP: 3.823
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 131
Number of rings: 3

     

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