COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK326321
Chemical Name: 4-[3-(heptylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]benzoicacid
Smiles: CCCCCCCSc1nnc2c(n1)OC(Nc1c2cccc1)c1ccc(cc1)C(=O)O

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Molecular Weight: 450.56
Empirical Formula: C24H26N4O3S

Physical State: Dry powder
Available Amount: 195 mg

Lipinsky:
logP: 5.82
Rotatable bonds: 8
H-donors: 2
H-acceptors: 3
PSA: 122
Number of rings: 4

     

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