COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK939544
Chemical Name: 3-(3,4-dimethoxyphenyl)-2-methyl-1-oxo-N-[4-(1H-1,2,4-triazol-1-ylmethyl)phenyl]-1,2,3,4-tetrahydroisoquinoline-4-carboxamide
Smiles: COc1ccc(cc1OC)C1N(C)C(=O)c2c(C1C(=O)Nc1ccc(cc1)Cn1ncnc1)cccc2

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Molecular Weight: 497.55
Empirical Formula: C28H27N5O4

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 1.662
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 98
Number of rings: 5

     

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