COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK465184
Chemical Name: 3-[(3-methoxybenzyl)sulfanyl]-4-(prop-2-en-1-yl)-5-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazole
Smiles: C=CCn1c(nnc1c1csc2c1CCCC2)SCc1cccc(c1)OC

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Molecular Weight: 397.57
Empirical Formula: C21H23N3OS2

Physical State: Dry powder
Available Amount: 285 mg

Lipinsky:
logP: 6.748
Rotatable bonds: 7
H-donors: 0
H-acceptors: 1
PSA: 93
Number of rings: 4

     

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