COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK548216
Chemical Name: {methyl4-[3-{bis[2-(hydroxy-kappaO)ethyl]amino-kappaN}-2-(hydroxy-kappaO)propoxy]benzoatato(3-)}boron
Smiles: COC(=O)c1ccc(cc1)OCC1O[B-]23[N+](C1)(CCO3)CCO2

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Molecular Weight: 321.14
Empirical Formula: C15H20BNO6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 63
Number of rings: 4

     

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