COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK741696
Chemical Name: 2-({[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]amino}methylidene)-5,5-dimethylcyclohexane-1,3-dione
Smiles: OCC(NC=C1C(=O)CC(CC1=O)(C)C)(CO)CO

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Molecular Weight: 271.31
Empirical Formula: C13H21NO5

Physical State: Dry powder
Available Amount: 269 mg

Lipinsky:
logP: 0.663
Rotatable bonds: 6
H-donors: 4
H-acceptors: 5
PSA: 106
Number of rings: 1

     

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