COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK725075
Chemical Name: 2-[4-(dipropylamino)-1,1-dioxido-3-(phenylcarbonyl)-2H-1,2-benzothiazin-2-yl]-1-(4-nitrophenyl)ethanone
Smiles: CCCN(C1=C(C(=O)c2ccccc2)N(CC(=O)c2ccc(cc2)[N+](=O)[O-])S(=O)(=O)c2c1cccc2)CCC

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Molecular Weight: 547.63
Empirical Formula: C29H29N3O6S

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 7.897
Rotatable bonds: 7
H-donors: 0
H-acceptors: 6
PSA: 128
Number of rings: 4

     

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