COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL526059
Chemical Name: (8xi,14xi,17xi,19E)-3,5,14-trihydroxy-19-[(pyridin-4-ylmethyl)imino]card-20(22)-enolide
Smiles: O=C1OCC(=C1)C1CCC2([C@]1(C)CC[C@H]1C2CCC2([C@]1(/C=N/Cc1ccncc1)CCC(C2)O)O)O

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Molecular Weight: 494.63
Empirical Formula: C29H38N2O5

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 0.767
Rotatable bonds: 5
H-donors: 3
H-acceptors: 5
PSA: 112
Number of rings: 6

     

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