COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK644722
Chemical Name: 11-{[(E)-(4-tert-butylphenyl)methylidene]amino}-3-hexyl-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Smiles: CCCCCCn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2/N=C/c1ccc(cc1)C(C)(C)C

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Molecular Weight: 494.64
Empirical Formula: C30H34N6O

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.263
Rotatable bonds: 6
H-donors: 0
H-acceptors: 1
PSA: 75
Number of rings: 5

     

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