COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK245722
Chemical Name: 1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-({4-(prop-2-en-1-yl)-5-[(5,6,7,8-tetrahydronaphthalen-2-yloxy)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)ethanone
Smiles: C=CCn1c(SCC(=O)N2CCc3c(C2)cccc3)nnc1COc1ccc2c(c1)CCCC2

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Molecular Weight: 474.63
Empirical Formula: C27H30N4O2S

Physical State: Dry powder
Available Amount: 121 mg

Lipinsky:
logP: 6.422
Rotatable bonds: 8
H-donors: 0
H-acceptors: 2
PSA: 85
Number of rings: 5

     

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