COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL226963
Chemical Name: 2-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-3-(2-phenylethyl)-6-(propan-2-yl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Smiles: CC(C1OCc2c(C1)c1c(s2)nc(n(c1=O)CCc1ccccc1)SCc1ccc2c(c1)OCO2)C

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Molecular Weight: 520.67
Empirical Formula: C28H28N2O4S2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.229
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 113
Number of rings: 6

     

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