COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK540141
Chemical Name: methyl2-[11-(3,5-dimethylphenyl)-2-ethyl-4-oxo-4,11-dihydro-3H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-3-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Smiles: COC(=O)c1c2CCCCc2sc1n1c(CC)nc2c(c1=O)c1nc3ccccc3nc1n2c1cc(C)cc(c1)C

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Molecular Weight: 563.68
Empirical Formula: C32H29N5O3S

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 6.726
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 117
Number of rings: 7

     

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