COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL079781
Chemical Name: ethyl4-{[2,3-dimethyl-4-oxo-5-(prop-2-en-1-yl)-4,5-dihydrothieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-8-yl]amino}benzoate
Smiles: CCOC(=O)c1ccc(cc1)Nc1nnc2n1c1sc(c(c1c(=O)n2CC=C)C)C

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Molecular Weight: 423.5
Empirical Formula: C21H21N5O3S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.258
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 117
Number of rings: 4

     

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