COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL161360
Chemical Name: 3-(4-{2-[(1-benzylpiperidin-4-yl)amino]-3,4-dioxocyclobut-1-en-1-yl}piperazin-1-yl)propanenitrile
Smiles: N#CCCN1CCN(CC1)C1=C(C(=O)C1=O)NC1CCN(CC1)Cc1ccccc1

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Molecular Weight: 407.52
Empirical Formula: C23H29N5O2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.675
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 79
Number of rings: 4

     

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