COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL354309
Chemical Name: 1-(azepan-1-yl)-2-{[4-methyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}ethanone
Smiles: O=C(N1CCCCCC1)CSc1nnc(n1C)c1ccncc1

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Molecular Weight: 331.44
Empirical Formula: C16H21N5OS

Physical State: Dry powder
Available Amount: 248 mg

Lipinsky:
logP: 2.821
Rotatable bonds: 3
H-donors: 0
H-acceptors: 1
PSA: 89
Number of rings: 3

     

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