COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL534174
Chemical Name: N-{[(2,2-dimethyl-6-oxo-3,4,6,7,8,9-hexahydro-2H-cyclopenta[c]pyrano[2,3-h]chromen-10-yl)oxy]acetyl}-L-isoleucine
Smiles: CC[C@H]([C@@H](C(=O)O)NC(=O)COc1cc2OC(C)(C)CCc2c2c1c1CCCc1c(=O)o2)C

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Molecular Weight: 457.52
Empirical Formula: C25H31NO7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.408
Rotatable bonds: 7
H-donors: 2
H-acceptors: 7
PSA: 111
Number of rings: 4

     

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