COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK929855
Chemical Name: 3-(1,3-benzodioxol-5-yl)-N-[(2Z)-1,3-benzothiazol-2(3H)-ylidene]-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Smiles: CN1C(c2ccc3c(c2)OCO3)C(C(=O)/N=c/2\sc3c([nH]2)cccc3)c2c(C1=O)cccc2

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Molecular Weight: 457.51
Empirical Formula: C25H19N3O4S

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 3.788
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 105
Number of rings: 6

     

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