COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK012572
Chemical Name: 4-{[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylidene]amino}phenol
Smiles: Oc1ccc(cc1)/N=C/c1cc2OCOc2cc1[N+](=O)[O-]

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Molecular Weight: 286.24
Empirical Formula: C14H10N2O5

Physical State: Dry powder
Available Amount: 169 mg

Lipinsky:
logP: 2.237
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 96
Number of rings: 3

     

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