COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL276810
Chemical Name: 6-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-4-methyl-3-[(thiophen-2-ylmethyl)sulfanyl]-1,2,4-triazin-5(4H)-one
Smiles: Cn1c(nnc(c1=O)Nc1ccc2c(c1)OCCCO2)SCc1cccs1

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Molecular Weight: 402.5
Empirical Formula: C18H18N4O3S2

Physical State: Dry powder
Available Amount: 4 mg

Lipinsky:
logP: 2.336
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 129
Number of rings: 4

     

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