COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL565466
Chemical Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-ylN-(tert-butoxycarbonyl)-D-tryptophanate
Smiles: O=C(OC(C)(C)C)N[C@@H](C(=O)Oc1ccc2c(c1)oc(c(c2=O)c1ccc2c(c1)OCCCO2)C)Cc1c[nH]c2c1cccc2

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Molecular Weight: 610.66
Empirical Formula: C35H34N2O8

Physical State: Liquid
Available Amount: 58 mg

Lipinsky:
logP: 6.891
Rotatable bonds: 7
H-donors: 2
H-acceptors: 8
PSA: 125
Number of rings: 6

     

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