COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK181106
Chemical Name: 2-[(1,1-dioxido-1,2-benzothiazol-3-yl)(4-methylphenyl)amino]ethyl4-(piperidin-1-ylsulfonyl)benzoate
Smiles: Cc1ccc(cc1)N(C1=NS(=O)(=O)c2c1cccc2)CCOC(=O)c1ccc(cc1)S(=O)(=O)N1CCCCC1

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Molecular Weight: 567.69
Empirical Formula: C28H29N3O6S2

Physical State: Dry powder
Available Amount: 453 mg

Lipinsky:
logP: 5.464
Rotatable bonds: 4
H-donors: 0
H-acceptors: 6
PSA: 122
Number of rings: 5

     

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