COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL048348
Chemical Name: (8E)-8-{(2E)-[1-(4-methoxyphenyl)ethylidene]hydrazinylidene}-1,3-dimethyl-7-(naphthalen-1-ylmethyl)-3,7,8,9-tetrahydro-1H-purine-2,6-dione
Smiles: COc1ccc(cc1)/C(=N/N=c/1\[nH]c2c(n1Cc1cccc3c1cccc3)c(=O)n(c(=O)n2C)C)/C

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Molecular Weight: 482.54
Empirical Formula: C27H26N6O3

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 4.418
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 89
Number of rings: 5

     

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