COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL276811
Chemical Name: 6-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-3-[(3,4-dimethoxybenzyl)sulfanyl]-4-(prop-2-en-1-yl)-1,2,4-triazin-5(4H)-one
Smiles: C=CCn1c(SCc2ccc(c(c2)OC)OC)nnc(c1=O)Nc1ccc2c(c1)OCCCO2

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Molecular Weight: 482.56
Empirical Formula: C24H26N4O5S

Available Amount: 0 mg

Lipinsky:
logP: 3.223
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 119
Number of rings: 4

     

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