COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL003393
Chemical Name: (9xi,14xi)-11,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl4-oxo-4-[(tetrahydrofuran-2-ylmethyl)amino]butanoate
Smiles: O=C(CCC(=O)OCC(=O)[C@@]1(O)CCC2[C@]1(C)CC(O)C1[C@H]2CCC2=CC(=O)C=C[C@]12C)NCC1CCCO1

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Molecular Weight: 543.66
Empirical Formula: C30H41NO8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.631
Rotatable bonds: 10
H-donors: 3
H-acceptors: 8
PSA: 139
Number of rings: 5

     

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