COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK521247
Chemical Name: 2,6-dimethoxy-4-[3-(methylsulfanyl)-7-propanoyl-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]phenylpropanoate
Smiles: CCC(=O)N1C(Oc2c(c3c1cccc3)nnc(n2)SC)c1cc(OC)c(c(c1)OC)OC(=O)CC

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Molecular Weight: 510.57
Empirical Formula: C25H26N4O6S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 3.487
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 138
Number of rings: 4

     

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