COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL527152
Chemical Name: 5-[(4-{[(8xi,9xi,11beta,14xi)-11,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl]oxy}-4-oxobutanoyl)amino]pentanoicacid
Smiles: O=C(OCC(=O)[C@@]1(O)CCC2[C@]1(C)C[C@H](O)C1C2CCC2=CC(=O)C=C[C@]12C)CCC(=O)NCCCCC(=O)O

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Molecular Weight: 559.66
Empirical Formula: C30H41NO9

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.949
Rotatable bonds: 13
H-donors: 4
H-acceptors: 9
PSA: 167
Number of rings: 4

     

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