COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL463626
Chemical Name: N-{[(4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-5-yl)oxy]acetyl}-D-isoleucine
Smiles: CC[C@@H]([C@H](C(=O)O)NC(=O)COc1cc2OC(C)(C)CCc2c2c1c(C)cc(=O)o2)C

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Molecular Weight: 431.49
Empirical Formula: C23H29NO7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.943
Rotatable bonds: 7
H-donors: 2
H-acceptors: 7
PSA: 111
Number of rings: 3

     

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