COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL529135
Chemical Name: methyl4-[(12aS)-2-(1-benzylpiperidin-4-yl)-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)C1CCN(CC1)Cc1ccccc1

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Molecular Weight: 562.67
Empirical Formula: C34H34N4O4

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 3.57
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 85
Number of rings: 7

     

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