COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK031078
Chemical Name: 1-methyl-3-{[3-(2-oxo-2,3-dihydro-1H-benzimidazol-1-yl)propyl]sulfanyl}-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(SCCCn2c(=O)[nH]c3c2cccc3)nc(c2c1CCCC2)C

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Molecular Weight: 378.5
Empirical Formula: C21H22N4OS

Physical State: Dry powder
Available Amount: 202 mg

Lipinsky:
logP: 4.806
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 94
Number of rings: 4

     

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