COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL446383
Chemical Name: 2-{[(4-chloro-2-nitrophenyl)amino]methylidene}-5-phenylcyclohexane-1,3-dione
Smiles: Clc1ccc(c(c1)[N+](=O)[O-])N/C=C/1\C(=O)CC(CC1=O)c1ccccc1

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Molecular Weight: 370.79
Empirical Formula: C19H15ClN2O4

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 3.676
Rotatable bonds: 0
H-donors: 1
H-acceptors: 4
PSA: 91
Number of rings: 3

     

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