COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL463700
Chemical Name: (3beta)-cholest-5-en-3-yl[(5-hydroxy-4-oxo-2-phenyl-4H-chromen-7-yl)oxy]acetate
Smiles: CC(CCC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CC=C2[C@]1(C)CC[C@@H](C2)OC(=O)COc1cc(O)c2c(c1)oc(cc2=O)c1ccccc1)C)C

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Molecular Weight: 680.93
Empirical Formula: C44H56O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 12.935
Rotatable bonds: 9
H-donors: 1
H-acceptors: 6
PSA: 82
Number of rings: 7

     

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