COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL536623
Chemical Name: methyl4-{(12aS)-2-[2-(morpholin-4-yl)ethyl]-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: COC(=O)c1ccc(cc1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCN1CCOCC1

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Molecular Weight: 502.57
Empirical Formula: C28H30N4O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.475
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 95
Number of rings: 6

     

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