COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL169825
Chemical Name: 2-ethoxy-4-[3-(pentylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]phenol
Smiles: CCCCCSc1nnc2c(n1)OC(Nc1c2cccc1)c1ccc(c(c1)OCC)O

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Molecular Weight: 438.55
Empirical Formula: C23H26N4O3S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 4.581
Rotatable bonds: 9
H-donors: 2
H-acceptors: 3
PSA: 114
Number of rings: 4

     

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