COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK671955
Chemical Name: butyl4-{[(E)-(3-chloro-6-hydroxy-2,4-dimethyl-5-nitrophenyl)methylidene]amino}benzoate
Smiles: CCCCOC(=O)c1ccc(cc1)/N=C/c1c(C)c(Cl)c(c(c1O)[N+](=O)[O-])C

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Molecular Weight: 404.85
Empirical Formula: C20H21ClN2O5

Physical State: Dry powder
Available Amount: 2 mg

Lipinsky:
logP: 7.6
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 104
Number of rings: 2

     

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