COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL536409
Chemical Name: 4-(2-{[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]amino}-3,4-dioxocyclobut-1-en-1-yl)piperazine-1-carbaldehyde
Smiles: O=CN1CCN(CC1)C1=C(C(=O)C1=O)NC[C@@H]1CCCN2[C@@H]1CCCC2

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Molecular Weight: 360.46
Empirical Formula: C19H28N4O3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.062
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 72
Number of rings: 4

     

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