COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK600413
Chemical Name: 1-(4-methylpiperidin-1-yl)-3-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(SCC(=O)N2CCOCC2)nc(c2c1CCCC2)N1CCC(CC1)C

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Molecular Weight: 414.57
Empirical Formula: C22H30N4O2S

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 4.803
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 94
Number of rings: 4

     

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