COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL565456
Chemical Name: 6,6,9-trimethyl-3-sulfanyl-6a,7,8,9,10,10a-hexahydro-6H-isochromeno[3,4-d]pyrimidin-1-ol
Smiles: CC1CCC2C(C1)c1c(O)nc(nc1OC2(C)C)S

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Molecular Weight: 280.39
Empirical Formula: C14H20N2O2S

Physical State: Liquid
Available Amount: 55 mg

Lipinsky:
logP: 2.02
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 94
Number of rings: 3

     

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