COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL510156
Chemical Name: (3E)-6-methyl-3-{[(5-methyl-6-oxo-5,6-dihydropyrido[2,3-b][1,4]benzothiazepin-8-yl)amino]methylidene}-2H-pyran-2,4(3H)-dione
Smiles: CC1=CC(=O)/C(=C\Nc2ccc3c(c2)C(=O)N(C)c2c(S3)nccc2)/C(=O)O1

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Molecular Weight: 393.42
Empirical Formula: C20H15N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.689
Rotatable bonds: 0
H-donors: 1
H-acceptors: 4
PSA: 113
Number of rings: 4

     

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