COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL079590
Chemical Name: N-cyclohexyl-3-{[4-oxo-3-(prop-2-en-1-yl)-3,5,6,7-tetrahydro-4H-cyclopenta[4,5]thieno[2,3-d]pyrimidin-2-yl]sulfanyl}propanamide
Smiles: C=CCn1c(SCCC(=O)NC2CCCCC2)nc2c(c1=O)c1CCCc1s2

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Molecular Weight: 417.6
Empirical Formula: C21H27N3O2S2

Physical State: Dry powder
Available Amount: 106 mg

Lipinsky:
logP: 4.236
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 115
Number of rings: 4

     

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