COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL537435
Chemical Name: methyl4-[(12aS)-2-(2-methoxyethyl)-1,4-dioxo-1,2,3,4,6,7,12,12a-octahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-6-yl]benzoate
Smiles: COCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)C(=O)OC)[nH]c2c1cccc2

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Molecular Weight: 447.49
Empirical Formula: C25H25N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.725
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 91
Number of rings: 5

     

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