COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK725065
Chemical Name: 1-(4-bromophenyl)-2-{4-[(2-hydroxyethyl)amino]-1,1-dioxido-3-(phenylcarbonyl)-2H-1,2-benzothiazin-2-yl}ethanone
Smiles: OCCNC1=C(C(=O)c2ccccc2)N(CC(=O)c2ccc(cc2)Br)S(=O)(=O)c2c1cccc2

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Molecular Weight: 541.42
Empirical Formula: C25H21BrN2O5S

Physical State: Dry powder
Available Amount: 319 mg

Lipinsky:
logP: 5.825
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 112
Number of rings: 4

     

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