COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL441444
Chemical Name: (3E)-3-[4-(dimethylamino)benzylidene]-2-pentyl-2,3-dihydro-4H-1,2-benzothiazin-4-one1,1-dioxide
Smiles: CCCCCN1/C(=C/c2ccc(cc2)N(C)C)/C(=O)c2c(S1(=O)=O)cccc2

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Molecular Weight: 398.53
Empirical Formula: C22H26N2O3S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 6.909
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 66
Number of rings: 3

     

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