COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525585
Chemical Name: (8xi,14xi,17xi,19E)-3,5,14-trihydroxy-19-[(2-hydroxyethyl)imino]card-20(22)-enolide
Smiles: OCC/N=C/[C@@]12CCC(CC2(O)CCC2[C@@H]1CC[C@]1(C2(O)CCC1C1=CC(=O)OC1)C)O

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Molecular Weight: 447.57
Empirical Formula: C25H37NO6

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: -0.145
Rotatable bonds: 7
H-donors: 4
H-acceptors: 6
PSA: 119
Number of rings: 5

     

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