COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL302041
Chemical Name: (2Z)-3-(phenylamino)-3-sulfanyl-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)prop-2-enenitrile
Smiles: N#C/C(=C(\Nc1ccccc1)/S)/c1nnc2n1CCCCC2

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Molecular Weight: 311.41
Empirical Formula: C16H17N5S

Available Amount: 0 mg

Lipinsky:
logP: 1.984
Rotatable bonds: 2
H-donors: 1
H-acceptors: 0
PSA: 105
Number of rings: 3

     

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