COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL389659
Chemical Name: ethyl4-({[7-chloro-5-(methylsulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepin-2-yl]carbonyl}amino)benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)C1CCN(c2c(O1)ccc(c2)Cl)S(=O)(=O)C

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Molecular Weight: 452.92
Empirical Formula: C20H21ClN2O6S

Physical State: Dry powder
Available Amount: 79 mg

Lipinsky:
logP: 3.737
Rotatable bonds: 3
H-donors: 1
H-acceptors: 6
PSA: 110
Number of rings: 3

     

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