COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL482842
Chemical Name: 6-[(1E)-1-phenylprop-1-en-2-yl]-3-(prop-2-en-1-ylsulfanyl)-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepine
Smiles: C=CCSc1nnc2c(n1)OC(Nc1c2cccc1)/C(=C/c1ccccc1)/C

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Molecular Weight: 388.49
Empirical Formula: C22H20N4OS

Physical State: Dry powder
Available Amount: 165 mg

Lipinsky:
logP: 5.367
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 85
Number of rings: 4

     

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