COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK280789
Chemical Name: 2-({(E)-[5-(2-methoxy-5-nitrophenyl)furan-2-yl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-ethanoisoindole-1,3(2H)-dione
Smiles: COc1ccc(cc1c1ccc(o1)/C=N/N1C(=O)C2C(C1=O)C1CCC2C=C1)[N+](=O)[O-]

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Molecular Weight: 421.41
Empirical Formula: C22H19N3O6

Physical State: Dry powder
Available Amount: 128 mg

Lipinsky:
logP: 1.983
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 117
Number of rings: 6

     

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