COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK280903
Chemical Name: 2-{[(E)-(2,4-dihydroxy-5-nitrophenyl)methylidene]amino}-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Smiles: O=C1C2C3CCC(C2C(=O)N1/N=C/c1cc([N+](=O)[O-])c(cc1O)O)C=C3

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Molecular Weight: 357.32
Empirical Formula: C17H15N3O6

Physical State: Dry powder
Available Amount: 190 mg

Lipinsky:
logP: 2.543
Rotatable bonds: 3
H-donors: 2
H-acceptors: 6
PSA: 136
Number of rings: 5

     

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