COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK750726
Chemical Name: 3-chloro-4-methoxy-N-[(E)-(6-nitro-1,3-benzodioxol-5-yl)methylidene]aniline
Smiles: COc1ccc(cc1Cl)/N=C/c1cc2OCOc2cc1[N+](=O)[O-]

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Molecular Weight: 334.72
Empirical Formula: C15H11ClN2O5

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 3.302
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 85
Number of rings: 3

     

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