COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL351342
Chemical Name: methyl4-{[4-(dimethylamino)-7,7-dimethyl-7,8-dihydro-6H-pyrimido[4,5-b][1,4]benzothiazin-9-yl]amino}butanoate
Smiles: COC(=O)CCCNC1=C2Sc3ncnc(c3N=C2CC(C1)(C)C)N(C)C

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Saltdata: HBr
Molecular Weight: 389.52
Empirical Formula: C19H27N5O2S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 1.43
Rotatable bonds: 5
H-donors: 1
H-acceptors: 2
PSA: 105
Number of rings: 3

     

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