COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK524581
Chemical Name: 6-[(2-aminoethyl)amino]-8-butyl-3,3-dimethyl-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
Smiles: CCCCc1nc(NCCN)c(c2c1CSC(C2)(C)C)C#N

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Molecular Weight: 318.49
Empirical Formula: C17H26N4S

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 4.323
Rotatable bonds: 5
H-donors: 3
H-acceptors: 0
PSA: 100
Number of rings: 2

     

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