COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK541575
Chemical Name: methyl4-{6-[(4-butylphenyl)amino]-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl}benzoate
Smiles: CCCCc1ccc(cc1)Nc1nc2ccccc2n2c1=Nc1c(C2c2ccc(cc2)C(=O)OC)c(nn1c1ccccc1)C

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Molecular Weight: 594.72
Empirical Formula: C37H34N6O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.301
Rotatable bonds: 3
H-donors: 1
H-acceptors: 2
PSA: 84
Number of rings: 7

     

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