COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL534320
Chemical Name: (8xi,14xi,17alpha,19E)-3-[(2,6-dideoxy-3-O-methylhexopyranosyl)oxy]-5,14-dihydroxy-19-[(pyridin-2-ylmethyl)imino]card-20(22)-enolide
Smiles: COC1CC(OC2CC[C@]3(C(C2)(O)CCC2[C@@H]3CC[C@]3(C2(O)CC[C@H]3C2=CC(=O)OC2)C)/C=N/Cc2ccccn2)OC(C1O)C

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Molecular Weight: 638.8
Empirical Formula: C36H50N2O8

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 0.878
Rotatable bonds: 8
H-donors: 3
H-acceptors: 8
PSA: 139
Number of rings: 7

     

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