COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK164675
Chemical Name: {3-[(amino-kappaN)(methylsulfanyl)methylidene]pentane-2,4-dionato-kappaO~2~}(diphenyl)boron
Smiles: CSC1=C(C(=O)C)C(=[O+][B-](N1)(c1ccccc1)c1ccccc1)C

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Molecular Weight: 337.25
Empirical Formula: C19H20BNO2S

Physical State: Dry powder
Available Amount: 496 mg

Lipinsky:
logP: 0
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 54
Number of rings: 3

     

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