COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK251329
Chemical Name: 1-(3,4-dihydroisoquinolin-2(1H)-yl)-2-[(4,5-dimethyl-4H-1,2,4-triazol-3-yl)sulfanyl]ethanone
Smiles: O=C(N1CCc2c(C1)cccc2)CSc1nnc(n1C)C

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Molecular Weight: 302.4
Empirical Formula: C15H18N4OS

Physical State: Dry powder
Available Amount: 139 mg

Lipinsky:
logP: 2.268
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 76
Number of rings: 3

     

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