COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK788490
Chemical Name: N-(4-bromophenyl)-2-{[4-cyano-1-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl}acetamide
Smiles: N#Cc1c(SCC(=O)Nc2ccc(cc2)Br)nc(c2c1CCCC2)c1cc(OC)c(c(c1)OC)OC

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Molecular Weight: 568.49
Empirical Formula: C27H26BrN3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.973
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 118
Number of rings: 4

     

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