COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK280765
Chemical Name: 2-{[(E)-(4-hydroxy-3-nitrophenyl)methylidene]amino}-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Smiles: O=C1N(/N=C/c2ccc(c(c2)[N+](=O)[O-])O)C(=O)C2C1C1CCC2C=C1

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Molecular Weight: 341.32
Empirical Formula: C17H15N3O5

Physical State: Dry powder
Available Amount: 52 mg

Lipinsky:
logP: 2.201
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 115
Number of rings: 5

     

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