COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL372822
Chemical Name: 3-{[2,6-dideoxyhexopyranosyl-(1->4)-2,6-dideoxyhexopyranosyl-(1->4)-2,6-dideoxyhexopyranosyl]oxy}-12,14-dihydroxycard-20(22)-enolide
Smiles: O=C1OCC(=C1)C1CCC2(C1(C)C(O)CC1C2CCC2C1(C)CCC(C2)OC1CC(O)C(C(O1)C)OC1CC(O)C(C(O1)C)OC1CC(O)C(C(O1)C)O)O

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Molecular Weight: 780.95
Empirical Formula: C41H64O14

Physical State: Dry powder
Available Amount: 1007 mg

Lipinsky:
logP: 0.851
Rotatable bonds: 13
H-donors: 6
H-acceptors: 14
PSA: 203
Number of rings: 8

     

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