COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL535023
Chemical Name: 2-[(1E)-3-oxo-3-phenylprop-1-en-1-yl]phenyl2-(acetylamino)-2-deoxy-4,6-O-(furan-2-ylmethylidene)-beta-D-glucopyranoside
Smiles: CC(=O)N[C@H]1[C@@H](O[C@H]2[C@H]([C@@H]1O)OC(OC2)c1ccco1)Oc1ccccc1/C=C/C(=O)c1ccccc1

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Molecular Weight: 505.52
Empirical Formula: C28H27NO8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.46
Rotatable bonds: 4
H-donors: 2
H-acceptors: 8
PSA: 116
Number of rings: 5

     

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