COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL002109
Chemical Name: (9xi,11beta,14xi)-11,17-dihydroxy-3,20-dioxopregn-4-en-21-yl4-oxo-4-{[2-(piperazin-1-yl)ethyl]amino}butanoate
Smiles: O=C(OCC(=O)[C@@]1(O)CCC2[C@]1(C)C[C@H](O)C1[C@H]2CCC2=CC(=O)CC[C@]12C)CCC(=O)NCCN1CCNCC1

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Molecular Weight: 573.73
Empirical Formula: C31H47N3O7

Available Amount: 0 mg

Lipinsky:
logP: 1.228
Rotatable bonds: 8
H-donors: 4
H-acceptors: 7
PSA: 145
Number of rings: 5

     

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