COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL549520
Chemical Name: 7-chloro-4,6-dimethoxy-4'-({[3-(methoxymethyl)-1H-1,2,4-triazol-5-yl](phenyl)methyl}amino)-6'-methyl-2'H,3H-spiro[1-benzofuran-2,1'-cyclohex[3]ene]-2',3-dione
Smiles: COCc1n[nH]c(n1)C(c1ccccc1)NC1=CC(=O)C2(C(C1)C)Oc1c(C2=O)c(OC)cc(c1Cl)OC

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Molecular Weight: 538.99
Empirical Formula: C27H27ClN4O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.824
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 124
Number of rings: 5

     

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