COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK221689
Chemical Name: 2-(5-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]sulfanyl}-4-methyl-4H-1,2,4-triazol-3-yl)-N-(4-methoxyphenyl)acetamide
Smiles: COc1ccc(cc1)NC(=O)Cc1nnc(n1C)SCC(=O)N1CCc2c(C1)cccc2

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Molecular Weight: 451.55
Empirical Formula: C23H25N5O3S

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 3.285
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 114
Number of rings: 4

     

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