COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK108537
Chemical Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(1-hydroxy-1-phenyl-1,2,4,5-tetrahydro-3H-3-benzazepin-3-yl)propan-1-one
Smiles: O=C(c1ccc2c(c1)OCCO2)CCN1CCc2c(C(C1)(O)c1ccccc1)cccc2

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Saltdata: HCl
Molecular Weight: 429.52
Empirical Formula: C27H27NO4

Physical State: Dry powder
Available Amount: 152 mg

Lipinsky:
logP: 4.764
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 59
Number of rings: 5

     

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