COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL536892
Chemical Name: (12aS)-6,6-dimethyl-2-{[(E)-pyridin-4-ylmethylidene]amino}-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Smiles: O=C1N(/N=C/c2ccncc2)CC(=O)N2[C@H]1Cc1c3ccccc3[nH]c1C2(C)C

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Molecular Weight: 387.44
Empirical Formula: C22H21N5O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.03
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 81
Number of rings: 5

     

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