COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL524632
Chemical Name: (1Z,3R,4R,5S,6R,9R,10S,11S,12R)-6-ethyl-4,5-dihydroxy-3,5,9,11,13,15-hexamethyl-8-oxo-12-{[3,4,6-trideoxy-3-(dimethylamino)-D-xylo-hexopyranosyl]oxy}-7,16-dioxa-2-azabicyclo[11.2.1]hexadec-1-en-10-yl
Smiles: CC[C@H]1OC(=O)[C@H](C)[C@@H](OC2O[C@H](C)[C@H]([C@@](C2)(C)OC)O)[C@@H](C)[C@@H](OC2O[C@H](C)C[C@@H]([C@@H]2O)N(C)C)[C@@]2(O/C(=N\[C@@H]([C@@H]([C@]1(C)O)O)C)/C(C)C2)C

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Molecular Weight: 730.94
Empirical Formula: C37H66N2O12

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.294
Rotatable bonds: 2
H-donors: 4
H-acceptors: 12
PSA: 178
Number of rings: 4

     

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