COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL410150
Chemical Name: 2-[(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]-N-[(2E)-5-ethyl-1,3,4-thiadiazol-2(3H)-ylidene]acetamide
Smiles: N#Cc1c(SCC(=O)/N=c/2\[nH]nc(s2)CC)nc(c2c1CCCC2)C

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Molecular Weight: 373.5
Empirical Formula: C17H19N5OS2

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 3.193
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 141
Number of rings: 3

     

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