COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL081359
Chemical Name: ethyl2-({[5-(3,4-difluorophenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl]acetyl}amino)benzoate
Smiles: CCOC(=O)c1ccccc1NC(=O)CN1N=NC2C1C(=O)N(C2=O)c1ccc(c(c1)F)F

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Molecular Weight: 457.39
Empirical Formula: C21H17F2N5O5

Physical State: Dry powder
Available Amount: 49 mg

Lipinsky:
logP: 1.864
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 120
Number of rings: 4

     

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