COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL312379
Chemical Name: (2Z)-2-{[1-(1,1-dioxidotetrahydrothiophen-3-yl)-3,5-dimethyl-1H-pyrazol-4-yl]methylidene}-5,6-dimethoxy-2,3-dihydro-1H-inden-1-one
Smiles: COc1cc2c(cc1OC)C/C(=C/c1c(C)nn(c1C)C1CCS(=O)(=O)C1)/C2=O

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Molecular Weight: 416.5
Empirical Formula: C21H24N2O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.865
Rotatable bonds: 4
H-donors: 0
H-acceptors: 5
PSA: 95
Number of rings: 4

     

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