COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK035564
Chemical Name: 2-[4-(1,3-benzoxazol-2-yl)phenyl]-5-[(4-nitrophenyl)carbonyl]-1H-isoindole-1,3(2H)-dione
Smiles: O=C1N(c2ccc(cc2)c2nc3c(o2)cccc3)C(=O)c2c1ccc(c2)C(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 489.44
Empirical Formula: C28H15N3O6

Physical State: Dry powder
Available Amount: 337 mg

Lipinsky:
logP: 5.027
Rotatable bonds: 1
H-donors: 0
H-acceptors: 6
PSA: 126
Number of rings: 6

     

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