COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK777772
Chemical Name: 1-butyl-5a,10,10-trihydroxy-4-(4-nitrophenyl)-5a,10-dihydro-1H-indeno[1',2':2,3]furo[3,4-b]pyrrole-2,3-dione
Smiles: CCCCN1C(=O)C(=O)C2=C(OC3(C12C(O)(O)c1c3cccc1)O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 452.42
Empirical Formula: C23H20N2O8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.63
Rotatable bonds: 6
H-donors: 3
H-acceptors: 8
PSA: 153
Number of rings: 5

     

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