COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL470857
Chemical Name: methylN-(3,7-dihydroxy-24-oxocholan-24-yl)phenylalaninate
Smiles: COC(=O)C(Cc1ccccc1)NC(=O)CCC(C1CCC2C1(C)CCC1C2C(O)CC2C1(C)CCC(C2)O)C

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Molecular Weight: 553.78
Empirical Formula: C34H51NO5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.022
Rotatable bonds: 10
H-donors: 3
H-acceptors: 5
PSA: 95
Number of rings: 5

     

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