COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL081669
Chemical Name: methyl4-(2-amino-6-benzyl-3-cyano-5,5-dioxido-4,6-dihydropyrano[3,2-c][2,1]benzothiazin-4-yl)benzoate
Smiles: COC(=O)c1ccc(cc1)C1C(=C(N)OC2=C1S(=O)(=O)N(c1c2cccc1)Cc1ccccc1)C#N

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Molecular Weight: 499.55
Empirical Formula: C27H21N3O5S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.804
Rotatable bonds: 2
H-donors: 2
H-acceptors: 5
PSA: 131
Number of rings: 5

     

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