COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL565467
Chemical Name: (5xi,9xi,18xi)-3-[(2-deoxyhexopyranosyl)oxy]-11-oxoolean-12-en-30-oicacid
Smiles: OCC1OC(CC(C1O)O)OC1CC[C@]2(C(C1(C)C)CC[C@@]1(C2C(=O)C=C2[C@@]1(C)CC[C@@]1(C2C[C@](C)(CC1)C(=O)O)C)C)C

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Molecular Weight: 616.84
Empirical Formula: C36H56O8

Physical State: Dry powder
Available Amount: 5 mg

Lipinsky:
logP: 5.985
Rotatable bonds: 7
H-donors: 4
H-acceptors: 8
PSA: 133
Number of rings: 6

     

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