COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK762224
Chemical Name: pentyl2-[(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)sulfanyl]butanoate
Smiles: CCCCCOC(=O)C(Sc1n[nH]c(=O)[nH]c1=O)CC

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Molecular Weight: 301.37
Empirical Formula: C12H19N3O4S

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 2.073
Rotatable bonds: 9
H-donors: 2
H-acceptors: 4
PSA: 122
Number of rings: 1

     

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