COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL460854
Chemical Name: N-{2-[(3-benzyl-4,8-dimethyl-2-oxo-2H-chromen-7-yl)oxy]propanoyl}-L-isoleucine
Smiles: CC[C@H]([C@@H](C(=O)O)NC(=O)C(Oc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1)C)C

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Molecular Weight: 465.55
Empirical Formula: C27H31NO6

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 6.273
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 101
Number of rings: 3

     

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