COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL006565
Chemical Name: 1-O-{13-[(2-O-hexopyranosylhexopyranosyl)oxy]-18-oxokaur-16-en-18-yl}hexopyranose
Smiles: OCC1OC(OC23CCC4C(C2)(CC3=C)CCC2C4(C)CCCC2(C)C(=O)OC2OC(CO)C(C(C2O)O)O)C(C(C1O)O)OC1OC(CO)C(C(C1O)O)O

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Molecular Weight: 804.88
Empirical Formula: C38H60O18

Available Amount: 0 mg

Lipinsky:
logP: 1.192
Rotatable bonds: 21
H-donors: 11
H-acceptors: 18
PSA: 294
Number of rings: 7

     

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