COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK526377
Chemical Name: 8-butyl-3,3-dimethyl-6-[4-(phenylcarbonyl)piperazin-1-yl]-3,4-dihydro-1H-thiopyrano[3,4-c]pyridine-5-carbonitrile
Smiles: CCCCc1nc(N2CCN(CC2)C(=O)c2ccccc2)c(c2c1CSC(C2)(C)C)C#N

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Molecular Weight: 448.63
Empirical Formula: C26H32N4OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.514
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 85
Number of rings: 4

     

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