COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK617149
Chemical Name: 3-{[3-(dimethylamino)propyl]sulfanyl}-1-(piperidin-1-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(SCCCN(C)C)nc(c2c1CCCC2)N1CCCCC1

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Molecular Weight: 358.55
Empirical Formula: C20H30N4S

Physical State: Dry powder
Available Amount: 323 mg

Lipinsky:
logP: 5.329
Rotatable bonds: 4
H-donors: 0
H-acceptors: 0
PSA: 68
Number of rings: 3

     

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