COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL565149
Smiles: OC[C@@H]1O[C@H](OC(=O)[C@@]23CCC(CC3C3=CCC4[C@@]([C@@]3(CC2)C)(C)CCC2[C@]4(C)CC[C@@H](C2(C)C)O[C@@H]2O[C@@H](C)[C@@H]([C@H]([C@H]2O)O)O[C@@H]2O[C@@H]([C@@H]([C@H]2O[C@@H]2OC[C@H]([C@@H]([C@H]2O)O)O)O)

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Saltdata: H2O
Molecular Weight: 1383.54
Empirical Formula: C65H106O31

Physical State: Liquid
Available Amount: 300 mg

Lipinsky:
logP: 3.458
Rotatable bonds: 9
H-donors: 18
H-acceptors: 31
PSA: 491
Number of rings: 11

     

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