COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK932144
Chemical Name: 3-(1,3-benzodioxol-5-yl)-2-methyl-N-[(2Z)-4-methyl-1,3-thiazol-2(3H)-ylidene]-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Smiles: Cc1cs/c(=N\C(=O)C2c3ccccc3C(=O)N(C2c2ccc3c(c2)OCO3)C)/[nH]1

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Molecular Weight: 421.48
Empirical Formula: C22H19N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.896
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 105
Number of rings: 5

     

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