COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525061
Chemical Name: (3beta,5beta,8xi,9xi,19E)-3,5,14-trihydroxy-19-(phenylimino)card-20(22)-enolide
Smiles: O=C1OCC(=C1)[C@H]1CC[C@]2([C@]1(C)CCC1C2CC[C@]2([C@@]1(CC[C@@H](C2)O)/C=N/c1ccccc1)O)O

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Molecular Weight: 479.62
Empirical Formula: C29H37NO5

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 2.234
Rotatable bonds: 0
H-donors: 3
H-acceptors: 5
PSA: 99
Number of rings: 6

     

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