COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL374177
Chemical Name: 4,5-bis(4-methoxyphenyl)-2-{[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylidene]amino}furan-3-carbonitrile
Smiles: COc1ccc(cc1)c1c(C#N)c(oc1c1ccc(cc1)OC)/N=C/c1cc2OCOc2cc1[N+](=O)[O-]

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Molecular Weight: 497.46
Empirical Formula: C27H19N3O7

Physical State: Dry powder
Available Amount: 116 mg

Lipinsky:
logP: 5.402
Rotatable bonds: 1
H-donors: 0
H-acceptors: 7
PSA: 132
Number of rings: 5

     

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