COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL387466
Chemical Name: 2-({(E)-[5-(2-methyl-5-nitrophenyl)furan-2-yl]methylidene}amino)-3a,4,7,7a-tetrahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
Smiles: O=C1C2C3C=CC(C2C(=O)N1/N=C/c1ccc(o1)c1cc(ccc1C)[N+](=O)[O-])C3

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Molecular Weight: 391.38
Empirical Formula: C21H17N3O5

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 2.047
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 108
Number of rings: 5

     

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