COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK230363
Chemical Name: 4-chloro-N-[2-(5-{[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)ethyl]benzamide
Smiles: CCn1c(CCNC(=O)c2ccc(cc2)Cl)nnc1SCC(=O)N1CCc2c(C1)cccc2

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Molecular Weight: 484.02
Empirical Formula: C24H26ClN5O2S

Physical State: Dry powder
Available Amount: 74 mg

Lipinsky:
logP: 4.515
Rotatable bonds: 7
H-donors: 1
H-acceptors: 2
PSA: 105
Number of rings: 4

     

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