COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL361045
Chemical Name: 3-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-1-(4-chlorophenyl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Smiles: N#Cc1c(SCc2nc3c([nH]2)cccc3)nc(c2c1CCCC2)c1ccc(cc1)Cl

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Molecular Weight: 430.96
Empirical Formula: C24H19ClN4S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.719
Rotatable bonds: 2
H-donors: 1
H-acceptors: 0
PSA: 90
Number of rings: 5

     

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