COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL027078
Chemical Name: 4-methyl-5-[(8-methyl-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methyl]-4H-1,2,4-triazole-3-thiol
Smiles: Cc1cc2OCCCOc2cc1Cc1nnc(n1C)S

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Molecular Weight: 291.37
Empirical Formula: C14H17N3O2S

Available Amount: 0 mg

Lipinsky:
logP: 2.847
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 87
Number of rings: 3

     

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