COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK521042
Chemical Name: 2,4-dichloro-6-[3-(methylsulfanyl)-7-propanoyl-6,7-dihydro[1,2,4]triazino[5,6-d][3,1]benzoxazepin-6-yl]phenylpropanoate
Smiles: CCC(=O)Oc1c(Cl)cc(cc1C1Oc2nc(SC)nnc2c2c(N1C(=O)CC)cccc2)Cl

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Molecular Weight: 519.41
Empirical Formula: C23H20Cl2N4O4S

Physical State: Dry powder
Available Amount: 102 mg

Lipinsky:
logP: 5.049
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 119
Number of rings: 4

     

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