COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK717860
Chemical Name: 5-hydroxy-3-(4-nitrophenoxy)-4-oxo-4H-chromen-7-ylN-(tert-butoxycarbonyl)-L-isoleucinate
Smiles: CC[C@H]([C@@H](C(=O)Oc1cc(O)c2c(c1)occ(c2=O)Oc1ccc(cc1)[N+](=O)[O-])NC(=O)OC(C)(C)C)C

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Molecular Weight: 528.52
Empirical Formula: C26H28N2O10

Physical State: Dry powder
Available Amount: 282 mg

Lipinsky:
logP: 6.79
Rotatable bonds: 8
H-donors: 2
H-acceptors: 10
PSA: 166
Number of rings: 3

     

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