COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL079463
Chemical Name: 2-({5-[(1,3-benzothiazol-2-ylsulfanyl)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(pyridin-3-ylmethyl)acetamide
Smiles: C=CCn1c(SCC(=O)NCc2cccnc2)nnc1CSc1nc2c(s1)cccc2

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Molecular Weight: 468.63
Empirical Formula: C21H20N6OS3

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.833
Rotatable bonds: 10
H-donors: 1
H-acceptors: 1
PSA: 164
Number of rings: 4

     

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