COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL326145
Chemical Name: 8-butyl-6-[(2-hydroxyethyl)amino]-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
Smiles: CCCCc1nc(NCCO)c(c2c1CSC(C2)(C)C)C#N

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Molecular Weight: 319.47
Empirical Formula: C17H25N3OS

Physical State: Dry powder
Available Amount: 63 mg

Lipinsky:
logP: 4.429
Rotatable bonds: 6
H-donors: 2
H-acceptors: 1
PSA: 94
Number of rings: 2

     

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