COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK384951
Chemical Name: 7-{[4-(carbamoyloxy)-3-hydroxy-5-methoxy-6,6-dimethyltetrahydro-2H-pyran-2-yl]oxy}-3-({[4-hydroxy-3-(3-methylbut-2-en-1-yl)phenyl]carbonyl}amino)-8-methyl-2-oxo-2H-chromen-4-olate(non-preferredname)
Smiles: COC1C(OC(=O)N)C(O)C(OC1(C)C)Oc1ccc2c(c1C)oc(=O)c(c2[O-])NC(=O)c1ccc(c(c1)CC=C(C)C)O

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Saltdata: Na+
Molecular Weight: 611.63
Empirical Formula: C31H35N2O11

Physical State: Dry powder
Available Amount: 262 mg

Lipinsky:
logP: 2.862
Rotatable bonds: 10
H-donors: 5
H-acceptors: 11
PSA: 198
Number of rings: 4

     

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