COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK544504
Chemical Name: 2-({5-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-phenyl-4H-1,2,4-triazol-3-yl}sulfanyl)-1-[4-(2-hydroxyethyl)piperazin-1-yl]ethanone
Smiles: OCCN1CCN(CC1)C(=O)CSc1nnc(n1c1ccccc1)CSc1nc2c(s1)cccc2

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Molecular Weight: 526.71
Empirical Formula: C24H26N6O2S3

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 5.161
Rotatable bonds: 8
H-donors: 1
H-acceptors: 2
PSA: 166
Number of rings: 5

     

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