COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525914
Chemical Name: 3-(4-chlorophenyl)-4-oxo-4H-chromen-7-yl2,3,4,6-tetra-O-acetyl-beta-D-glucopyranoside
Smiles: CC(=O)OC[C@H]1O[C@@H](Oc2ccc3c(c2)occ(c3=O)c2ccc(cc2)Cl)[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=O)C)OC(=O)C

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Molecular Weight: 602.98
Empirical Formula: C29H27ClO12

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.999
Rotatable bonds: 6
H-donors: 0
H-acceptors: 12
PSA: 149
Number of rings: 4

     

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