COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL575010
Chemical Name: methyl4-{[(4-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)methyl]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)NCN1C(=O)c2c(C1=O)cccc2[N+](=O)[O-]

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Molecular Weight: 355.31
Empirical Formula: C17H13N3O6

Physical State: Dry powder
Available Amount: 4 mg

Lipinsky:
logP: 2.937
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 121
Number of rings: 3

     

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