COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL410931
Chemical Name: methyl2-{[2-(cyclohexylamino)-3,4-dioxocyclobut-1-en-1-yl]amino}benzoate
Smiles: COC(=O)c1ccccc1NC1=C(C(=O)C1=O)NC1CCCCC1

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Molecular Weight: 328.37
Empirical Formula: C18H20N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.78
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 84
Number of rings: 3

     

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