COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL265227
Chemical Name: (2E)-3-(3-nitrophenyl)-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\c1cccc(c1)[N+](=O)[O-])/c1nnc2n1CCCCC2

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Molecular Weight: 309.33
Empirical Formula: C16H15N5O2

Available Amount: 0 mg

Lipinsky:
logP: 2.931
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 100
Number of rings: 3

     

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