COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL389801
Chemical Name: 7-chloro-5-(methylsulfonyl)-N-[2-(prop-2-en-1-ylcarbamoyl)phenyl]-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Smiles: C=CCNC(=O)c1ccccc1NC(=O)C1CCN(c2c(O1)ccc(c2)Cl)S(=O)(=O)C

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Molecular Weight: 463.94
Empirical Formula: C21H22ClN3O5S

Physical State: Dry powder
Available Amount: 82 mg

Lipinsky:
logP: 3.087
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 113
Number of rings: 3

     

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