COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL485488
Chemical Name: (5E)-1-(2,4-dimethylphenyl)-3-methyl-5-[1-({[3-(9-methyl-9H-carbazol-3-yl)-1-oxo-2-(2-phenylethyl)-1,2,3,4-tetrahydroisoquinolin-4-yl]methyl}amino)ethylidene]pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: Cc1ccc(c(c1)C)N1C(=O)/C(=C(/NCC2C(c3ccc4c(c3)c3ccccc3n4C)N(CCc3ccccc3)C(=O)c3c2cccc3)\C)/C(=O)N(C1=O)C

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Molecular Weight: 729.88
Empirical Formula: C46H43N5O4

Physical State: Dry powder
Available Amount: 36 mg

Lipinsky:
logP: 7.605
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 94
Number of rings: 8

     

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