COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL351286
Chemical Name: ethyl6-[(4-methoxy-7,7-dimethyl-7,8-dihydro-6H-pyrimido[4,5-b][1,4]benzothiazin-9-yl)amino]hexanoate
Smiles: CCOC(=O)CCCCCNC1=C2Sc3ncnc(c3N=C2CC(C1)(C)C)OC

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Saltdata: HBr
Molecular Weight: 418.56
Empirical Formula: C21H30N4O3S

Physical State: Dry powder
Available Amount: 180 mg

Lipinsky:
logP: 2.401
Rotatable bonds: 9
H-donors: 1
H-acceptors: 3
PSA: 111
Number of rings: 3

     

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