COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK848378
Chemical Name: 2-[4-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)phenyl]-2,3-dihydro-1H-isoindol-1-imine
Smiles: N=C1N(Cc2c1cccc2)c1ccc(cc1)c1nnc2n1CCCCC2

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Molecular Weight: 343.43
Empirical Formula: C21H21N5

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 2.498
Rotatable bonds: 0
H-donors: 1
H-acceptors: 0
PSA: 57
Number of rings: 5

     

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