COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL389465
Chemical Name: 2-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylmethyl)sulfanyl]-7-(2-methoxyethyl)pyrido[3,4-e][1,2,4]triazolo[1,5-a]pyrimidin-6(7H)-one
Smiles: COCCn1ccc2c(c1=O)cnc1n2nc(n1)SCc1ccc2c(c1)OCCCO2

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Molecular Weight: 439.5
Empirical Formula: C21H21N5O4S

Available Amount: 0 mg

Lipinsky:
logP: 1.778
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 116
Number of rings: 5

     

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